Gastherm 3000
V.42.2024.05.23
Thermodynamic and related data for programs VOLCAL, SOLVGAS, and GASWORKS.
These programs compute thermodynamic equilibrium among gases, liquids,
and crystalline and vitreous solids
This version of Gastherm is built from scratch. LogK's are calculated using
program Supcrt96, and data for DH, S, Cp, and V from sources as described
below.
Gastherm contains in order of appearance -
- A text header not read by software, where the version number is
v.# of basis components.date of last modification
- Basis component gases data: mol.wt. of the gas, the element in the gas that makes
it unique (adds an additional chemical element), mol.wt. of that element. All
derived gases, liquids, and solids are a linear combination of these
- Derived gas species data: Stochiometry, logKs at fixed temperature values, and
regression coefficients for computing logKs at other temperatures
- Derived solids and liquids data: Organized as for the derived gases. For a few
minerals, also the integer identifier for its solid solution and real
coefficient for the mixing site
______________________________
Modification Notes -
1990-April: V.4.00. The first recorded history that could be dredged.
Robert Symonds, MTU
2015-June: V.4.01. H. Greenberg, M.H. Reed, J. Palandri. Change chemical element
symbol case from all caps to match those in the periodic table.
2022-May-25: Add a text delimiter between the section for derived gases, and the
section for liquids and solids. Remove blank lines where in the past they were
required wherever the preceding line exceeded 72 characters. Modify SOLVGAS and
GASWORKS to accommodate these changes. Change name for Al2O3 glass from Al2O3(g)
to Al2O3-gl. Some revision of the text header.
2023-06-26: Recompilation of free energy, enthaply, entropy, and heat capacity data,
in parts. Replacement of some older data with newer. Recalculation of logK's from
those data using program Supcrt96.
Currently there are 429 of the 585 derived gases, and 111 of 399 solids and
liquids, compared to the 1990 version. ALL PREVIOUS log K's have been removed.
2023-07-31: Disconnect anorthite/albite-high/sanidine solid solution.
2023-08-29: Fix some incorrect reference tags, HP11 ---> Shock07. Add ref MR2002.
2023-10-12: Correct the name for the only current solid sulfur phase from monoclinic
"S(M) " to orthorhombic "S(ortho)".
2024-04-25: Minor updates to text header.
2025-05-23:
--Add all minerals from Holland and Powell that were not present in Gastherm in
1990. Add all non-silicate minerals from Shock/Helgeson and other miscellaneous
sources that were not present in 1990.
--Adjust and correct (double) the formulas for enstatite(s) and ferrosilite to be
consistent with those in Holland and Powell.
--Change solids and liquids names from chemical forumulas to mineral names for
selected items. E.g. CaSO4(C) becomes anhydrite, Hg(l) becomes mercury, etc.
See the name index table, file GTsolids, for a complete list.
______________________________
For each derived gas, liquid, or solid, its unique record is organized as follows -
- Line 1: Stochiometry for derived gases; mol. wt. as well for solids and liquids.
- Line 2: Log K's at 25 100 200 300 400 500 600 700 800 deg C
- Line 3: Log K's at 900 1000 1100 1200 deg C, all at one atm
- Line 4: Regression coefficients (a,b,c,d,e) for log K's as f(T) from 298.15 to 1473.15K
where interpolation of the log K's between the given temperature values is made by a
least squares curve fit of the data using the equation:
log K (deg K)= a + b/T + c*T + d/T**2 + e*log10(T)
______________________________
Data sources - Citation tags for each derived species are shown at the end of the first
line of log K's. The references for these are listed here. In general, thermodynamic
data for the derived species are valid up to 2000 K. Where the data do not extend
to 2000K, a "*" precedes the citation tag. In cases where the thermodynamic data did
not extend to 1500 K, the heat capacity equation was extrapolated.
Bess05:Bessinger, Brad, and Apps, John A. The Hydrothermal Chemistry of Gold, Arsenic,
Antimony, Mercury and Silver. Unpublished manuscript. Also includes new data for HS-
and H2S. Data added to supcrt and log K's for all relevant phases and species
recomputed, plus many new ones. April-May 2005.
HP11:Holland, T.J.B., Powell, R., 2011. An improved and extended internally consistent
thermodynamic dataset for phases of petrological interest, involving a new equation
of state for solids. J. Metamorph. Geol. 29, 333-383.
JA85:NIST-JANAF Thermochemical Tables. NIST Standard Reference Database 13. Version 1.0,
(1985). Data compiled and evaluated by M.W.Chase,Jr., C.A.Davies, J.R.Downey,Jr.,
D.J. Frurip, R.A. McDonald, and A.N. Syverud. Distributed by Standard Reference Data
Program National Institute of Standards and Technology. Gaithersburg, MD 20899.
https://janaf.nist.gov/
The JA85 data appear to be compiled from these references cited in Gastherm 1990:
JA71:Stull, D. R., and Prophet, H., 1971, Janaf thermochemical tables, 2d ed.:
Natl. Bur. Standards, Natl. Standards Ref. Data Ser., NBS37, 1141 p.
JA74:Chase, M. W., Curnutt, J. L., Hu, A. T., Prophet, H., Syverud, A. N.,
and Walker, L. C., 1974, Janaf thermochemical tables, 1974 supplement:
Jour. Phys. and Chem. Reference Data, v. 3, p. 311-480.
JA75:Chase, M. W., Curnutt, J. L., Prophet, H., McDonald, R. A., and Syverud,
A. N., 1975, Janaf thermochemical tables, 1975 supplement: Jour. Phys. and Chem.
Reference Data, v. 4, p. 1-175.
JA78:Chase, M. W., Jr., Curnutt, J. L., McDonald, R. A., and Syverud, A. N., 1978,
Janaf thermochemical tables, 1978 supplement: Jour. Phys. and Chem.
Reference Data, v. 7, p. 793-940.
JA82:Chase, M. W., Jr., Curnutt, J. L., Downey, J. R., McDonald, R. A.
Syverud, A. N., and Valenzuela, E. A., 1982, Janaf thermochemical tables, 1982
supplement: Jour. Phys. and Chem. Reference Data, v. 11, p. 695-940.
KKH91:Knacke, O., Kubaschewski, O., and Hesselmann, K. (Eds), 1991, Thermochemical
properties of inorganic substances, 2nd edition Berlin, Springer-Verlag, 2412 p.
MR2002:DH, DG, S for chalcocite and bornite adjusted using data from Robie, R.A.,
Seal, R.R., and Hemingway, B.S. (1994) Heat capacity and entropy of bornite
(Cu5FeS4) between 6 and 760K and the thermodynamic properties of phases in the
system Cu-Fe-S. Canadian Mineralogist, 32, 945–956. Changes originally made to
the Shock07 database, and then the enitire records copied to HP11.
RG97:Goodgame, V.Roland, UO PhD dissertation (1997) The distribution and origin of
arsenic and platinum group element mineralization in the Mariners nickel deposit,
Widgiemooltha, Western Australia. Ph.D. thesis, University of Oregon. Estimated from
plotting thermodynamic data for endmembers Ni9S8 and Fe9S8 against sulfur to cation
ratio, then forming an ideal mixing model for pentlandite. The second model for
pentlandite contains experimental enthalpy of formation from Cemic and Kleppa, 1987,
Physics and Chem. of Minerals, v. 14, pp. 52-57. Gersdorffite and cobaltite
estimated by assumption of equilibrium with other sulfides and eqtrapolated using Cp
for cobaltite from Naumov et al., 1971,HNBK THERMOCHEM. DATA, SPRAVOCHNIK
TERMODINACHESNIKH VELICHNIN, MOSCOW ATOMIZDAT, 239 P.
RH95: Robie, R.A., and Hemingway, B.S. (1995). Thermodynamic properties of minerals and
related substances at 298.15K and 1 bar (105 pascals) and at higher temperatures.
USGS Bulletin 2131: 461 p. Minerals with five heat capacity coefficients were
re-regressed to have four, as for Holland and Powell. Cp error for dawsonite coeff
A3 corrected 2020-02-12.
RO78: Robie, R. A., Hemingway, B. S., and Fisher, J. R.,1978, Thermodynamic properties
of minerals and related substances at 298.15 K and 1 bar (105 pascals) pressure and
at higher Temperatures: U.S.Geol. Survey Bull. 1452, 456 p.
Sack00: Sack, R.O., 2000. Internally consistent database for sulfides and sulfosalts
in the system Ag2S-Cu2S-ZnS-Sb2S3-As2S3. Geochim. Cosmochim. Acta 64, 3803-3812.
Shock07:Helgeson,H.C., Delaney,J.M., Nesbitt,H.W., and Bird,D.K., 1978, Summary and
critique of the thermodynamic properties of rock-forming minerals:
Am. Jour. Sci., v. 278-A, p. 1-229.
______________________________
Citations from Gastherm 1990 not cited above:
B672:Pankratz, L.B., 1982, Thermodynamic properties of elements and oxides:
U.S. Bur. Mines Bull. 672, 509 p. NOTE: These data are used only for component
species.
B674:Pankratz, L.B., 1984, Thermodynamic properties of halides:
U.S. Bur. Mines Bull. 674, 826 p. NOTE: These data are used only for component
species.
B677:Pankratz, L.B., Stuve, J.M., and Gokcen, N.A., 1984, Thermodynamic data for
mineral technology: U.S. Bur. Mines Bull. 677, 355 p. NOTE: These data are used
only for component species.
B689: Pankratz,L.B., Mah,A.D., and Watson,S.W., 1987, Thermodynamic properties of
sulfides: U.S. Bur. Mines Bull. 689, 427 p.
BA73: Barin, I., and Knacke, O., 1973, Thermochemical properties of inorganic
substances: Berlin, Springer-Verlag, 921 p.
BA77: Barin, I., Knacke, O., and Kubaschewski, O., 1977, Thermochemical properties of
inorganic substances (supplement): Berlin, Springer-Verlag, 861 p.
______________________________
The following solid solutions indexes are currently in use -
*** 1. Diopside-hedenbergite-jadeite <Break
1. Diopside-hedenbergite
2. Orthoenstatie - ferrosilite
3. Forsterite-fayalite-tephroite-Ni2SiO4
4. Anorthite-(hi-albite)-sanidine <Break
5. Magnetite-ulvospinel
7. Ilmenite-hematite-MgTiO3 <Break
8. MnWO4 - FeWO4
9. CdS-wurtzite(ZnS)
A (*) as the 8th character of a name indicates large uncertainy for that data.
A non-blank character (e.g.$) in the 16th column before itot will cause that
derived gas to be skipped.
Component Molecular Atomic
Species Weight Element Weight Reference
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H2 2.0158 H 1.0079 1 HP11
H2O 18.0152 O 15.9994 2 HP11
CO2 44.0098 C 12.011 3 HP11
H2S(g) 34.0758 S 32.06 4 HP11
HCl 36.4609 Cl 35.453 5 RH95
HF 20.0063 F 18.9984 6 RH95
HBr 80.9119 Br 79.904 7 JA85
NaCl 58.4428 Na 22.9898 8 JA85
KCl 74.5513 K 39.0983 9 JA85
FeCl2 126.753 Fe 55.847 10 JA85
ZnCl2 136.286 Zn 65.38 11 KKH91
Cd 112.4100 Cd 112.41 12 B672
AlF3 83.9767 Al 26.9815 13 JA85
CuCl 98.999 Cu 63.546 14 JA85
BiCl3 315.3394 Bi 208.9804 15 B674
PbCl2 278.1060 Pb 207.2 16 JA85
H2MoO4 161.9534 Mo 95.94 17 JA85
H2WO4 249.8634 W 183.85 18 JA85
AsCl3 181.2806 As 74.9216 19 B674
SbCl3 228.109 Sb 121.75 20 KKH91
SiF4 104.0791 Si 28.0855 21 JA85
MgCl2 95.2110 Mg 24.305 22 JA85
CaCl2 110.9860 Ca 40.08 23 JA85
TiF4 123.8736 Ti 47.88 24 JA85
CrCl4 193.8080 Cr 51.996 25 B674
CoCl2 129.8392 Co 58.9332 26 JA85
NiCl2 129.5960 Ni 58.69 27 JA85
MnCl2 125.8440 Mn 54.9380 28 KKH91
VCl4 192.7535 V 50.9415 29 B674
SrCl2 158.5260 Sr 87.62 30 JA85
GaCl3 176.0790 Ga 69.72 31 B674
LiCl 42.3940 Li 6.941 32 JA85
RbCl 120.9208 Rb 85.4678 33 B674
CsCl 168.3584 Cs 132.9054 34 JA85
H2Se 80.9758 Se 78.96 35 B677
H2Te 129.6158 Te 127.60 36 B677
N2 28.0134 N 14.0067 37 RH95
SnCl2 189.5960 Sn 118.69 38 B674
AgCl 143.3210 Ag 107.868 39 KKH91
Au 196.9665 Au 196.9665 40 B672
Hg 200.59 Hg 200.59 41 JA85
Ir 192.22 Ir 192.22 42 B672
O2 3 -2.000 1 2.000 2
O2 80.078 63.040 48.704 39.355 32.772 27.884 24.110 21.108 HP11
O2 18.662 16.632 14.919 13.454 12.188
O2 0.6168410E+00 0.2495983E+05 0.2375886E-03 0.1319083E+05-0.1807972E+01
Al 4 1.500 1-3.000 6 1.00013
Al 114.848 89.595 68.518 54.900 45.400 38.408 33.057 28.835 JA85
Al 25.423 22.612 20.258 18.259 16.542
Al -0.3242442E+02 0.3850486E+05-0.3913858E-03-0.3364915E+04 0.7387963E+01
AlBr 5 1.000 1-3.000 6 1.000 7 1.00013
AlBr 69.301 53.831 41.004 32.777 27.079 22.915 19.750 17.270 JA85
AlBr 15.279 13.650 12.295 11.153 10.178
AlBr -0.3146712E+02 0.2399333E+05-0.3720943E-03 0.1580981E+05 0.8174483E+01
AlBr3 4 -3.000 6 3.000 7 1.00013
AlBr3 15.571 12.562 10.231 8.852 7.973 7.386 6.982 6.698 JA85
AlBr3 6.495 6.351 6.249 6.177 6.129
AlBr3 -0.2289940E+02 0.5304455E+04-0.3181036E-03 0.5039154E+05 0.8166357E+01
(AlBr3)2 4 -6.000 6 6.000 7 2.00013
(AlBr3)2 18.686 16.748 15.476 14.896 14.651 14.584 14.616 14.706 JA85
(AlBr3)2 14.830 14.974 15.128 15.287 15.448
(AlBr3)2-0.3312096E+02 0.4326820E+04-0.6752628E-03 0.9921823E+05 0.1470234E+02
AlC 6 3.500 1-2.000 2 1.000 3-3.000 6 1.00013
AlC 164.117 129.400 100.442 81.745 68.710 59.124 51.790 46.008 JA85
AlC 41.337 37.491 34.271 31.538 29.192
AlC -0.4139669E+02 0.5307678E+05-0.6517417E-03-0.4891599E+04 0.1121171E+02
AlCl 5 1.000 1 1.000 5-3.000 6 1.00013
AlCl 67.280 52.207 39.699 31.669 26.102 22.030 18.932 16.503 JA85
AlCl 14.551 12.952 11.621 10.498 9.539
AlCl -0.2950948E+02 0.2332037E+05-0.3392978E-03 0.1376374E+05 0.7484102E+01
AlClF 5 0.500 1 1.000 5-2.000 6 1.00013
AlClF 41.210 31.918 24.224 19.297 15.890 13.403 11.516 10.040 JA85
AlClF 8.856 7.890 7.087 6.411 5.835
AlClF -0.2056300E+02 0.1445737E+05-0.2337853E-03 0.1203576E+05 0.5341443E+01
AlClF2 4 1.000 5-1.000 6 1.00013
AlClF2 4.694 3.692 2.903 2.424 2.111 1.896 1.743 1.630 JA85
AlClF2 1.546 1.483 1.434 1.396 1.368
AlClF2 -0.6171675E+01 0.1682024E+04-0.7174576E-04 0.1526921E+05 0.2050442E+01
AlCl2 5 0.500 1 2.000 5-3.000 6 1.00013
AlCl2 46.495 36.234 27.771 22.377 18.661 15.962 13.921 12.332 JA85
AlCl2 11.064 10.032 9.179 8.463 7.857
AlCl2 -0.2557567E+02 0.1609202E+05-0.3059964E-03 0.2362336E+05 0.7243392E+01
AlCl2F 4 2.000 5-2.000 6 1.00013
AlCl2F 9.465 7.525 5.996 5.071 4.467 4.052 3.757 3.541 JA85
AlCl2F 3.380 3.258 3.165 3.094 3.040
AlCl2F -0.1199431E+02 0.3287205E+04-0.1561364E-03 0.2772863E+05 0.4109466E+01
AlCl3 4 3.000 5-3.000 6 1.00013
AlCl3 14.403 11.600 9.396 8.065 7.198 6.605 6.183 5.876 JA85
AlCl3 5.648 5.477 5.347 5.248 5.173
AlCl3 -0.1692841E+02 0.4752629E+04-0.2207426E-03 0.4233660E+05 0.6054112E+01
(AlCl3)2 4 6.000 5-6.000 6 2.00013
(AlCl3)2 14.672 13.510 12.800 12.520 12.443 12.468 12.549 12.659 JA85
(AlCl3)2 12.786 12.920 13.058 13.195 13.329
(AlCl3)2-0.2105162E+02 0.2661059E+04-0.4783678E-03 0.8719652E+05 0.1049133E+02
AlF 4 1.000 1-2.000 6 1.00013
AlF 61.443 47.515 35.921 28.454 23.260 19.449 16.541 14.254 JA85
AlF 12.411 10.897 9.633 8.562 7.646
AlF -0.2416389E+02 0.2143578E+05-0.2705730E-03 0.9366187E+02 0.5573218E+01
AlFO 4 1.000 2-2.000 6 1.00013
AlFO 50.342 39.011 29.571 23.482 19.241 16.123 13.740 11.863 JA85
AlFO 10.348 9.101 8.059 7.175 6.418
AlFO -0.1577158E+02 0.1717629E+05-0.1002588E-03 0.1787882E+05 0.3367559E+01
AlF2 4 0.500 1-1.000 6 1.00013
AlF2 37.292 28.820 21.765 17.218 14.054 11.732 9.959 8.565 JA85
AlF2 7.440 6.517 5.745 5.092 4.532
AlF2 -0.1446973E+02 0.1303786E+05-0.1526961E-03-0.2404449E+04 0.3275512E+01
AlF2O 5 -0.500 1 1.000 2-1.000 6 1.00013
AlF2O 8.634 6.225 4.244 2.984 2.117 1.488 1.013 0.644 JA85
AlF2O 0.350 0.111 -0.086 -0.251 -0.390
AlF2O -0.7537055E+01 0.3680428E+04-0.9251439E-05 0.1728828E+05 0.1469061E+01
(AlF3)2 2 2.00013
(AlF3)2 -28.987 -21.430 -15.112 -11.026 -8.174 -6.076 -4.471 -3.206 JA85
(AlF3)2 -2.185 -1.345 -0.643 -0.048 0.462
(AlF3)2 0.1504324E+02-0.1163238E+05 0.6844895E-05 0.1946540E+05-0.2116054E+01
AlH 4 2.000 1-3.000 6 1.00013
AlH 104.729 81.922 62.843 50.488 41.848 35.477 30.590 26.727 JA85
AlH 23.599 21.016 18.849 17.007 15.421
AlH -0.2337548E+02 0.3461461E+05-0.2704064E-03-0.1587890E+05 0.4957018E+01
AlO 5 0.500 1 1.000 2-3.000 6 1.00013
AlO 111.401 86.919 66.551 53.435 44.312 37.617 32.506 28.483 JA85
AlO 25.241 22.575 20.347 18.460 16.843
AlO -0.3773458E+02 0.3744283E+05-0.5293176E-03 0.2993961E+05 0.9445712E+01
(AlO)2 5 1.000 1 2.000 2-6.000 6 2.00013
(AlO)2 138.362 107.942 82.666 66.412 55.121 46.848 40.541 35.586 JA85
(AlO)2 31.599 28.326 25.598 23.290 21.317
(AlO)2 -0.4887408E+02 0.4655051E+05-0.4678075E-03 0.5193589E+05 0.1239076E+02
AlOCl 5 1.000 2 1.000 5-3.000 6 1.00013
AlOCl 59.613 46.460 35.541 28.524 23.654 20.087 17.369 15.236 JA85
AlOCl 13.520 12.112 10.939 9.948 9.101
AlOCl -0.2146553E+02 0.2007832E+05-0.1787460E-03 0.3261723E+05 0.5424207E+01
AlOH 5 1.000 1 1.000 2-3.000 6 1.00013
AlOH 71.670 55.799 42.511 33.896 27.867 23.415 19.998 17.294 JA85
AlOH 15.102 13.291 11.771 10.476 9.361
AlOH -0.1564988E+02 0.2400078E+05-0.1542508E-03-0.1102978E+05 0.2825273E+01
AlO2 5 -0.500 1 2.000 2-3.000 6 1.00013
AlO2 128.224 100.578 77.469 62.507 52.046 44.331 38.412 33.734 JA85
AlO2 29.945 26.818 24.194 21.963 20.044
AlO2 -0.2288849E+02 0.4148882E+05-0.9441154E-04 0.3149607E+05 0.4700923E+01
AlO2H 4 2.000 2-3.000 6 1.00013
AlO2H 65.973 51.477 39.372 31.543 26.076 22.047 18.959 16.521 JA85
AlO2H 14.548 12.921 11.557 10.398 9.402
AlO2H -0.1485637E+02 0.2181457E+05-0.8577603E-04 0.1920422E+05 0.3019883E+01
AlS 5 0.500 1 1.000 4-3.000 6 1.00013
AlS 102.896 80.183 61.323 49.204 40.792 34.633 29.941 26.257 JA85
AlS 23.293 20.863 18.836 17.123 15.658
AlS -0.4024135E+02 0.3495398E+05-0.5224609E-03 0.3021768E+05 0.1039305E+02
Al2O 5 2.000 1 1.000 2-6.000 6 2.00013
Al2O 138.147 107.449 81.918 65.486 54.067 45.694 39.309 34.290 JA85
Al2O 30.248 26.930 24.161 21.819 19.814
Al2O -0.5185300E+02 0.4722073E+05-0.5950289E-03 0.1614297E+05 0.1277735E+02
Br 3 -0.500 1 1.000 7
Br 23.805 18.594 14.236 11.413 9.436 7.976 6.854 5.966 JA85
Br 5.246 4.650 4.149 3.723 3.355
Br -0.3650986E+01 0.7726576E+04-0.1854186E-04 0.1374249E+05 0.5625049E+00
BrCl 4 -1.000 1 1.000 5 1.000 7
BrCl 25.900 20.869 16.676 13.967 12.075 10.682 9.615 8.772 JA85
BrCl 8.091 7.529 7.058 6.658 6.314
BrCl -0.1341851E+01 0.7451484E+04 0.1564896E-04 0.2145535E+05 0.8096013E+00
BrF 4 -1.000 1 1.000 6 1.000 7
BrF 44.692 35.841 28.395 23.538 20.117 17.577 15.614 14.052 JA85
BrF 12.779 11.721 10.829 10.065 9.404
BrF 0.3836204E+01 0.1291304E+05 0.1087691E-03 0.1242830E+05-0.1061665E+01
BrF3 4 -2.000 1 3.000 6 1.000 7
BrF3 113.934 92.742 74.853 63.140 54.860 48.688 43.904 40.084 JA85
BrF3 36.959 34.355 32.150 30.257 28.614
BrF3 0.2397659E+02 0.3057952E+05 0.3023587E-03 0.2213100E+05-0.5231883E+01
BrF5 4 -3.000 1 5.000 6 1.000 7
BrF5 189.059 154.674 125.610 106.551 93.060 82.988 75.171 68.919 JA85
BrF5 63.800 59.527 55.904 52.791 50.085
BrF5 0.4848973E+02 0.4935726E+05 0.5195880E-03 0.3566804E+05-0.1031831E+02
BrSF5 5 -4.000 1 1.000 4 5.000 6 1.000 7
BrSF5 100.693 84.733 71.107 62.065 55.591 50.704 46.871 43.775 JA85
BrSF5 41.216 39.062 37.219 35.624 34.228
BrSF5 0.6114796E+02 0.2147784E+05 0.8099457E-03 0.5602052E+05-0.1348336E+02
Br2 3 -1.000 1 2.000 7
Br2 19.297 15.670 12.676 10.760 9.436 8.470 7.736 7.162 JA85
Br2 6.701 6.325 6.012 5.749 5.525
Br2 -0.3192506E+01 0.5441416E+04-0.1766906E-04 0.2757491E+05 0.1589835E+01
C 4 2.000 1 1.000 3-2.000 2
C 106.604 84.575 66.139 54.190 45.827 39.654 34.915 31.164 JA85
C 28.125 25.612 23.502 21.704 20.156
C -0.1502079E+02 0.3328117E+05-0.2894088E-03-0.7034443E+04 0.4107823E+01
CBr 5 1.500 1-2.000 2 1.000 3 1.000 7
CBr 79.889 63.860 50.503 41.887 35.884 31.471 28.098 25.439 JA85
CBr 23.292 21.525 20.046 18.792 17.715
CBr -0.1521293E+02 0.2443039E+05-0.2974579E-03 0.1317414E+05 0.5295146E+01
CBrF3 5 -2.000 2 1.000 3 3.000 6 1.000 7
CBrF3 34.045 29.848 26.187 23.703 21.889 20.495 19.383 18.471 JA85
CBrF3 17.705 17.052 16.485 15.988 15.548
CBrF3 0.3222435E+02 0.5355148E+04 0.2271067E-03-0.7660877E+04-0.6515496E+01
CBr4 4 -2.000 2 1.000 3 4.000 7
CBr4 32.797 29.131 26.168 24.314 23.058 22.160 21.491 20.978 JA85
CBr4 20.573 20.249 19.985 19.766 19.583
CBr4 0.3881299E+01 0.5616009E+04-0.1797804E-03 0.5879550E+05 0.3827787E+01
CCl 5 1.500 1-2.000 2 1.000 3 1.000 5
CCl 88.061 70.336 55.509 45.905 39.187 34.230 30.427 27.418 JA85
CCl 24.980 22.967 21.276 19.837 18.598
CCl -0.1038737E+02 0.2678198E+05-0.2254009E-03-0.9136650E+03 0.3515418E+01
CClF3 5 -2.000 2 1.000 3 1.000 5 3.000 6
CClF3 33.532 29.436 25.840 23.385 21.582 20.189 19.073 18.154 JA85
CClF3 17.380 16.717 16.140 15.633 15.183
CClF3 0.3493680E+02 0.5086555E+04 0.2787772E-03-0.9437789E+04-0.7453072E+01
CCl2 5 1.000 1-2.000 2 1.000 3 2.000 5
CCl2 62.270 50.586 40.851 34.570 30.191 26.971 24.506 22.560 JA85
CCl2 20.988 19.691 18.603 17.679 16.883
CCl2 -0.7497404E+01 0.1779121E+05-0.3913251E-03 0.1401528E+05 0.4063314E+01
CCl2F2 5 -2.000 2 1.000 3 2.000 5 2.000 6
CCl2F2 39.593 34.288 29.744 26.718 24.544 22.899 21.604 20.555 JA85
CCl2F2 19.684 18.949 18.319 17.771 17.289
CCl2F2 0.2712807E+02 0.7148259E+04 0.1649360E-03 0.9563196E+04-0.4715108E+01
CCl3 5 0.500 1-2.000 2 1.000 3 3.000 5
CCl3 55.292 45.939 38.128 33.070 29.533 26.923 24.918 23.332 JA85
CCl3 22.046 20.983 20.090 19.330 18.675
CCl3 0.5612120E+01 0.1384085E+05-0.4239321E-04 0.3277954E+05 0.1172502E+01
CCl3F 5 -2.000 2 1.000 3 3.000 5 1.000 6
CCl3F 43.658 37.615 32.518 29.179 26.816 25.051 23.680 22.583 JA85
CCl3F 21.684 20.932 20.294 19.745 19.267
CCl3F 0.1996198E+02 0.8487612E+04 0.7254047E-04 0.3056043E+05-0.2076032E+01
CCl4 4 -2.000 2 1.000 3 4.000 5
CCl4 46.393 39.971 34.621 31.163 28.746 26.963 25.593 24.509 JA85
CCl4 23.630 22.903 22.292 21.771 21.322
CCl4 0.1324434E+02 0.9306896E+04-0.2518829E-04 0.4931985E+05 0.5600719E+00
CF 5 1.500 1-2.000 2 1.000 3 1.000 6
CF 76.437 61.001 48.038 39.608 33.689 29.307 25.933 23.255 JA85
CF 21.079 19.276 17.757 16.461 15.341
CF -0.4528445E+01 0.2322291E+05-0.1507082E-03-0.2382178E+05 0.1369350E+01
CF2 5 1.000 1-2.000 2 1.000 3 2.000 6
CF2 51.931 42.234 34.027 28.644 24.833 21.990 19.785 18.022 JA85
CF2 16.579 15.376 14.356 13.479 12.718
CF2 0.9500296E+01 0.1424255E+05 0.3485966E-04-0.2493007E+05-0.2048548E+01
CF3 5 0.500 1-2.000 2 1.000 3 3.000 6
CF3 53.705 44.493 36.608 31.371 27.621 24.792 22.573 20.782 JA85
CF3 19.302 18.056 16.991 16.068 15.260
CF3 0.2628622E+02 0.1293113E+05 0.2334741E-03-0.2627642E+05-0.6355555E+01
CF3OF 5 -1.000 1-1.000 2 1.000 3 4.000 6
CF3OF 98.043 81.026 66.500 56.876 49.998 44.819 40.765 37.498 JA85
CF3OF 34.802 32.536 30.602 28.929 27.466
CF3OF 0.4543163E+02 0.2382145E+05 0.4925786E-03-0.1888977E+05-0.1100070E+02
CF4 4 -2.000 2 1.000 3 4.000 6
CF4 26.341 23.769 21.384 19.669 18.356 17.304 16.435 15.699 JA85
CF4 15.064 14.508 14.016 13.575 13.177
CF4 0.4263418E+02 0.2614808E+04 0.3451720E-03-0.3456169E+05-0.1001335E+02
CH 4 2.500 1-2.000 2 1.000 3
CH 87.246 69.537 54.739 45.165 38.478 33.550 29.773 26.788 JA85
CH 24.372 22.378 20.705 19.281 18.056
CH -0.1560226E+02 0.2703754E+05-0.4352248E-03-0.1470437E+05 0.5035127E+01
CHCl 5 2.000 1 1.000 3 1.000 5-2.000 2
CHCl 61.611 49.689 39.564 32.901 28.171 24.633 21.880 19.675 JA85
CHCl 17.865 16.352 15.066 13.958 12.992
CHCl 0.1087691E+02 0.1758461E+05-0.6569162E-04-0.5789664E+05-0.3060937E+01
CHClF2 6 1.000 1-2.000 2 1.000 3 1.000 5 2.000 6
CHClF2 23.285 20.840 18.627 17.073 15.904 14.982 14.230 13.600 JA85
CHClF2 13.062 12.594 12.182 11.816 11.487
CHClF2 0.3088585E+02 0.2832371E+04 0.1656664E-03-0.2818736E+05-0.6802735E+01
CHCl2F 6 1.000 1-2.000 2 1.000 3 2.000 5 1.000 6
CHCl2F 26.364 23.334 20.683 18.879 17.557 16.539 15.726 15.056 JA85
CHCl2F 14.493 14.011 13.592 13.224 12.896
CHCl2F 0.2519876E+02 0.3890851E+04 0.9340256E-04-0.1230852E+05-0.4758344E+01
CHCl3 5 1.000 1-2.000 2 1.000 3 3.000 5
CHCl3 26.766 23.802 21.272 19.592 18.387 17.477 16.761 16.181 JA85
CHCl3 15.701 15.295 14.946 14.643 14.376
CHCl3 0.1874856E+02 0.4013634E+04 0.9713153E-05 0.9790950E+04-0.2245952E+01
CHF 5 2.000 1 1.000 3 1.000 6-2.000 2
CHF 56.588 45.699 36.519 30.525 26.301 23.162 20.737 18.806 JA85
CHF 17.232 15.923 14.817 13.869 13.048
CHF 0.2435406E+01 0.1633533E+05-0.1332040E-03-0.3473274E+05-0.8323683E-01
CHFO 5 1.000 1 1.000 3 1.000 6-1.000 2
CHFO 12.815 11.048 9.444 8.318 7.472 6.806 6.265 5.812 JA85
CHFO 5.427 5.092 4.799 4.538 4.305
CHFO 0.1716480E+02 0.2196488E+04 0.1231019E-03-0.3706005E+05-0.4581500E+01
CHF3 5 1.000 1-2.000 2 1.000 3 3.000 6
CHF3 17.673 16.395 15.078 14.046 13.206 12.501 11.896 11.367 JA85
CHF3 10.899 10.480 10.101 9.756 9.440
CHF3 0.4074449E+02 0.7935792E+03 0.2996071E-03-0.5582408E+05-0.1018195E+02
CH2 4 3.000 1-2.000 2 1.000 3
CH2 53.696 43.263 34.502 28.807 24.811 21.854 19.578 17.773 JA85
CH2 16.306 15.090 14.066 13.192 12.436
CH2 -0.3718493E+01 0.1591212E+05-0.2694682E-03-0.3356763E+05 0.1819797E+01
CH2ClF 6 2.000 1 1.000 3 1.000 5 1.000 6-2.000 2
CH2ClF 12.501 11.931 11.272 10.717 10.243 9.832 9.470 9.148 JA85
CH2ClF 8.858 8.594 8.353 8.131 7.925
CH2ClF 0.2945850E+02 0.1865099E+03 0.9583839E-04-0.5369270E+05-0.6873342E+01
CH2Cl2 5 2.000 1 1.000 3 2.000 5-2.000 2
CH2Cl2 10.322 10.303 10.177 10.018 9.854 9.695 9.543 9.400 JA85
CH2Cl2 9.266 9.139 9.020 8.908 8.802
CH2Cl2 0.2265415E+02-0.4305571E+03 0.1426726E-04-0.2618981E+05-0.4282828E+01
CH2F2 5 2.000 1 1.000 3 2.000 6-2.000 2
CH2F2 11.385 11.046 10.504 9.973 9.481 9.032 8.624 8.251 JA85
CH2F2 7.909 7.594 7.302 7.031 6.778
CH2F2 0.3821005E+02-0.4362089E+03 0.2309139E-03-0.7784869E+05-0.9923518E+01
CH2O 4 2.000 1-1.000 2 1.000 3
CH2O 9.790 8.460 7.214 6.315 5.628 5.080 4.628 4.247 JA85
CH2O 3.918 3.632 3.378 3.151 2.946
CH2O 0.1488404E+02 0.1742859E+04 0.3668055E-04-0.6066949E+05-0.4149671E+01
CH3 4 3.500 1-2.000 2 1.000 3
CH3 14.928 12.951 11.258 10.138 9.340 8.740 8.272 7.895 JA85
CH3 7.583 7.321 7.097 6.901 6.729
CH3 0.3957948E+01 0.3194269E+04-0.2668423E-03-0.4057306E+05 0.3202442E+00
CH3Cl 5 3.000 1-2.000 2 1.000 3 1.000 5
CH3Cl -4.834 -2.048 0.133 1.444 2.293 2.871 3.278 3.571 JA85
CH3Cl 3.785 3.943 4.059 4.144 4.205
CH3Cl 0.2461579E+02-0.4555059E+04-0.1965582E-04-0.6085564E+05-0.5448340E+01
CH3F 5 3.000 1-2.000 2 1.000 3 1.000 6
CH3F 0.403 2.077 3.244 3.840 4.152 4.306 4.369 4.375 JA85
CH3F 4.344 4.290 4.221 4.141 4.054
CH3F 0.3262048E+02-0.3128627E+04 0.8161609E-04-0.9208205E+05-0.8370598E+01
CH4 4 4.000 1-2.000 2 1.000 3
CH4 -19.875 -14.173 -9.580 -6.722 -4.798 -3.433 -2.425 -1.660 HP11
CH4 -1.066 -0.596 -0.220 0.085 0.333
CH4 0.2504229E+02-0.8724018E+04-0.1030640E-03-0.9842254E+05-0.5867545E+01
CO 4 1.000 1 1.000 3-1.000 2
CO 5.015 3.589 2.440 1.732 1.261 0.932 0.694 0.516 HP11
CO 0.381 0.276 0.193 0.128 0.076
CO -0.1114323E+02 0.2613845E+04-0.1757710E-03-0.1237897E+05 0.3064564E+01
COCl 5 0.500 1-1.000 2 1.000 3 1.000 5
COCl 32.338 25.978 20.679 17.263 14.884 13.137 11.802 10.750 JA85
COCl 9.903 9.205 8.622 8.129 7.705
COCl -0.5627395E+01 0.9715007E+04-0.9029923E-04 0.3846939E+04 0.2168094E+01
COClF 5 -1.000 2 1.000 3 1.000 5 1.000 6
COClF 21.534 18.324 15.579 13.757 12.452 11.467 10.694 10.070 JA85
COClF 9.554 9.119 8.747 8.425 8.142
COClF 0.1244183E+02 0.4439025E+04 0.8471053E-04-0.1160692E+04-0.2347430E+01
COF 5 0.500 1-1.000 2 1.000 3 1.000 6
COF 45.217 36.280 28.749 23.832 20.367 17.793 15.804 14.221 JA85
COF 12.931 11.858 10.953 10.178 9.507
COF 0.2320537E+01 0.1326722E+05 0.1722112E-04-0.1527711E+05-0.5800590E+00
COF2 4 -1.000 2 1.000 3 2.000 6
COF2 16.341 14.193 12.274 10.943 9.953 9.181 8.556 8.037 JA85
COF2 7.597 7.218 6.887 6.594 6.332
COF2 0.2011912E+02 0.2614652E+04 0.1876356E-03-0.2147379E+05-0.4995917E+01
COS 4 -1.000 2 1.000 3 1.000 4
COS 5.838 4.676 3.742 3.162 2.774 2.500 2.300 2.149 JA85
COS 2.033 1.943 1.871 1.814 1.769
COS -0.3866255E+01 0.1831819E+04 0.4506246E-04 0.1550038E+05 0.1362918E+01
CS 5 1.000 1-2.000 2 1.000 3 1.000 4
CS 34.897 27.515 21.378 17.431 14.690 12.684 11.156 9.957 JA85
CS 8.993 8.204 7.547 6.992 6.519
CS -0.1118542E+02 0.1140519E+05-0.6397416E-04-0.5559943E+03 0.3174258E+01
CS2 4 -2.000 2 1.000 3 2.000 4
CS2 12.319 9.979 8.082 6.896 6.095 5.525 5.104 4.784 JA85
CS2 4.536 4.340 4.183 4.057 3.954
CS2 -0.5865490E+01 0.3662764E+04 0.1099632E-03 0.2442277E+05 0.2259908E+01
C2 4 4.000 1 2.000 3-4.000 2
C2 114.963 91.888 72.668 60.282 51.664 45.339 40.511 36.711 JA85
C2 33.648 31.129 29.024 27.241 25.712
C2 -0.2923594E+02 0.3577526E+05-0.6786011E-03-0.2923956E+05 0.9997984E+01
C2Cl2 5 3.000 1-4.000 2 2.000 3 2.000 5
C2Cl2 46.169 38.679 32.478 28.509 25.765 23.763 22.243 21.053 JA85
C2Cl2 20.098 19.316 18.666 18.117 17.647
C2Cl2 -0.6486447E+01 0.1185152E+05-0.4548654E-03-0.4382923E+04 0.5290192E+01
C2Cl4 5 2.000 1-4.000 2 2.000 3 4.000 5
C2Cl4 48.581 42.383 37.209 33.862 31.522 29.794 28.467 27.416 JA85
C2Cl4 26.563 25.856 25.262 24.754 24.315
C2Cl4 0.1381591E+02 0.9271210E+04-0.2297222E-03 0.1733721E+05 0.1431759E+01
C2Cl6 5 1.000 1-4.000 2 2.000 3 6.000 5
C2Cl6 69.441 61.034 54.002 49.435 46.228 43.851 42.016 40.556 JA85
C2Cl6 39.366 38.376 37.540 36.824 36.203
C2Cl6 0.2918737E+02 0.1204570E+05-0.1156826E-03 0.6066895E+05-0.3216058E+00
C2F2 5 3.000 1-4.000 2 2.000 3 2.000 6
C2F2 76.619 62.961 51.451 43.936 38.640 34.705 31.664 29.241 JA85
C2F2 27.265 25.622 24.232 23.041 22.008
C2F2 0.8644506E+01 0.2044691E+05-0.2286527E-03-0.3643007E+05-0.5125561E-01
C2F4 5 2.000 1-4.000 2 2.000 3 4.000 6
C2F4 61.746 52.693 44.902 39.700 35.956 33.119 30.885 29.073 JA85
C2F4 27.570 26.298 25.207 24.257 23.422
C2F4 0.3725072E+02 0.1271882E+05 0.7084322E-04-0.5141810E+05-0.7115380E+01
C2F6 5 1.000 1-4.000 2 2.000 3 6.000 6
C2F6 47.089 42.870 39.032 36.318 34.265 32.637 31.302 30.180 JA85
C2F6 29.217 28.379 27.639 26.978 26.384
C2F6 0.6590564E+02 0.4503977E+04 0.4263886E-03-0.2800408E+05-0.1363348E+02
C2HCl 5 4.000 1 2.000 3 1.000 5-4.000 2
C2HCl 29.363 24.974 21.376 19.100 17.544 16.422 15.580 14.927 JA85
C2HCl 14.408 13.988 13.641 13.351 13.104
C2HCl -0.8148722E+01 0.7279975E+04-0.5179571E-03-0.7899069E+04 0.5390270E+01
C2HF 5 4.000 1 2.000 3 1.000 6-4.000 2
C2HF 45.463 37.786 31.380 27.244 24.362 22.241 20.619 19.339 JA85
C2HF 18.303 17.449 16.732 16.122 15.596
C2HF -0.3694456E+01 0.1202980E+05-0.4686853E-03-0.2557754E+05 0.3732885E+01
C2H2 4 5.000 1-4.000 2 2.000 3
C2H2 14.664 13.060 11.783 11.006 10.497 10.144 9.891 9.703 JA85
C2H2 9.560 9.448 9.359 9.287 9.227
C2H2 -0.8536610E+01 0.3208843E+04-0.6187177E-03-0.2403323E+05 0.5210457E+01
C2H4 4 6.000 1-4.000 2 2.000 3
C2H4 -9.998 -5.591 -2.058 0.128 1.591 2.624 3.380 3.949 JA85
C2H4 4.387 4.728 4.998 5.213 5.384
C2H4 0.2420782E+02-0.6630451E+04-0.2939192E-03-0.9472240E+05-0.4370287E+01
C2H4O 4 5.000 1-3.000 2 2.000 3
C2H4O 15.750 15.297 14.652 14.048 13.502 13.011 12.567 12.163 JA85
C2H4O 11.793 11.453 11.138 10.844 10.570
C2H4O 0.4035203E+02-0.1167589E+03-0.9080870E-05-0.9366629E+05-0.9357310E+01
C3 4 6.000 1 3.000 3-6.000 2
C3 99.196 79.914 63.883 53.579 46.429 41.197 37.214 34.088 JA85
C3 31.575 29.515 27.797 26.345 25.102
C3 -0.2984687E+02 0.3046445E+05-0.8233906E-03-0.5529440E+05 0.1120742E+02
C3O2 4 4.000 1 3.000 3-4.000 2
C3O2 27.890 23.709 20.265 18.078 16.577 15.491 14.673 14.037 JA85
C3O2 13.530 13.118 12.777 12.491 12.247
C3O2 -0.7152596E+01 0.6981160E+04-0.4845031E-03-0.2161036E+05 0.4855783E+01
C4 4 8.000 1 4.000 3-8.000 2
C4 115.356 93.943 76.115 64.632 56.648 50.791 46.321 42.804 JA85
C4 39.968 37.636 35.686 34.032 32.613
C4 -0.2345810E+02 0.3353602E+05-0.1003864E-02-0.4907810E+05 0.1098639E+02
C5 4 10.000 1 5.000 3-10.00 2
C5 105.416 86.895 71.526 61.668 54.841 49.852 46.058 43.084 JA85
C5 40.694 38.735 37.102 35.721 34.538
C5 -0.2443081E+02 0.2950923E+05-0.1198081E-02-0.5137653E+05 0.1285449E+02
Ca 4 1.000 1-2.000 5 1.00023
Ca 75.788 59.418 45.654 36.689 30.386 25.713 22.110 19.247 JA85
Ca 16.917 14.985 13.355 11.963 10.759
Ca -0.6971195E+01 0.2446509E+05-0.7859564E-04-0.2214420E+05 0.3942032E+00
CaBr 5 0.500 1-2.000 5 1.000 7 1.00023
CaBr 44.216 34.577 26.498 21.253 17.577 14.860 12.772 11.117 JA85
CaBr 9.775 8.664 7.730 6.934 6.248
CaBr -0.7600681E+01 0.1452508E+05-0.8414302E-04-0.8054611E+04 0.1299266E+01
CaBr2 4 -2.000 5 2.000 7 1.00023
CaBr2 -4.448 -3.550 -2.767 -2.239 -1.854 -1.560 -1.326 -1.136 JA85
CaBr2 -0.976 -0.841 -0.724 -0.622 -0.532
CaBr2 -0.3394424E+01-0.1204904E+04-0.5259921E-04 0.6281896E+04 0.1185185E+01
CaCl 4 0.500 1-1.000 5 1.00023
CaCl 44.308 34.639 26.520 21.240 17.533 14.788 12.674 10.997 JA85
CaCl 9.634 8.505 7.554 6.743 6.042
CaCl -0.5579409E+01 0.1447457E+05-0.3321809E-04-0.8407692E+04 0.5835504E+00
CaF 5 0.500 1-2.000 5 1.000 6 1.00023
CaF 46.634 36.464 27.886 22.278 18.322 15.380 13.105 11.292 JA85
CaF 9.812 8.582 7.542 6.651 5.878
CaF -0.1221473E+01 0.1506509E+05 0.1454278E-04-0.2010586E+05-0.9906649E+00
CaF2 4 -2.000 5 2.000 6 1.00023
CaF2 8.079 6.320 4.778 3.729 2.963 2.375 1.906 1.521 JA85
CaF2 1.200 0.925 0.688 0.481 0.297
CaF2 0.6891292E+01 0.2348227E+04 0.1177330E-03-0.1770363E+05-0.2636643E+01
CaO 4 1.000 2-2.000 5 1.00023
CaO 94.347 74.244 57.471 46.632 39.067 33.495 29.226 25.854 JA85
CaO 23.126 20.875 18.987 17.382 16.001
CaO -0.2079289E+02 0.3037157E+05-0.3899487E-03 0.2813272E+05 0.5283211E+01
CaOH 5 0.500 1 1.000 2-2.000 5 1.00023
CaOH 55.276 43.487 33.584 27.137 22.606 19.247 16.657 14.599 JA85
CaOH 12.924 11.535 10.363 9.362 8.497
CaOH -0.3368619E+01 0.1746552E+05-0.2144493E-04 0.3609909E+04 0.1243957E-01
Ca(OH)2 4 2.000 2-2.000 5 1.00023
Ca(OH)2 28.433 22.815 18.104 15.038 12.882 11.281 10.045 9.061 JA85
Ca(OH)2 8.259 7.592 7.029 6.547 6.130
Ca(OH)2 0.2964519E+01 0.8027766E+04 0.4676810E-04 0.3370641E+05-0.7475866E+00
CaS 4 1.000 4-2.000 5 1.00023
CaS 69.711 54.664 42.259 34.349 28.896 24.929 21.926 19.581 JA85
CaS 17.705 16.174 14.904 13.835 12.925
CaS -0.3549971E+02 0.2343364E+05-0.7117387E-03 0.5609190E+05 0.1058631E+02
Ca2 4 2.000 1-4.000 5 2.00023
Ca2 151.878 119.674 92.693 75.193 62.941 53.895 46.949 41.453 JA85
Ca2 36.998 33.318 30.228 27.598 25.333
Ca2 -0.2533269E+02 0.4884919E+05-0.2570736E-03-0.4791977E+05 0.5651980E+01
Cl 3 -0.500 1 1.000 5
Cl 35.144 27.629 21.327 17.231 14.354 12.224 10.583 9.281 JA85
Cl 8.222 7.345 6.606 5.975 5.431
Cl -0.1791897E+01 0.1103218E+05 0.5718981E-04 0.1746841E+05-0.1130844E+00
ClF 4 -1.000 1 1.000 5 1.000 6
ClF 55.871 44.756 35.389 29.269 24.952 21.741 19.257 17.278 JA85
ClF 15.663 14.319 13.184 12.211 11.369
ClF 0.5899212E+01 0.1619935E+05 0.1425716E-03 0.7057856E+04-0.1811722E+01
ClF3 4 -2.000 1 1.000 5 3.000 6
ClF3 140.615 114.038 91.602 76.913 66.531 58.792 52.795 48.006 JA85
ClF3 44.090 40.827 38.063 35.692 33.634
ClF3 0.2704233E+02 0.3842442E+05 0.3610190E-03 0.2087411E+05-0.6323027E+01
ClF5 4 -3.000 1 1.000 5 5.000 6
ClF5 232.233 189.171 152.793 128.956 112.094 99.516 89.760 81.963 JA85
ClF5 75.583 70.261 65.751 61.878 58.514
ClF5 0.5163202E+02 0.6209314E+05 0.5581821E-03 0.3305419E+05-0.1139603E+02
ClF5S 5 -4.000 1 1.000 4 1.000 5 5.000 6
ClF5S 99.007 83.397 70.047 61.173 54.807 49.995 46.214 43.156 JA85
ClF5S 40.626 38.492 36.666 35.083 33.696
ClF5S 0.6395995E+02 0.2082412E+05 0.8680613E-03 0.5686434E+05-0.1442587E+02
ClO 4 -1.500 1 1.000 2 1.000 5
ClO 73.813 58.486 45.608 37.220 31.322 26.947 23.572 20.890 JA85
ClO 18.707 16.896 15.369 14.065 12.938
ClO 0.7096867E+00 0.2247432E+05 0.1728739E-03 0.2168199E+05-0.1039169E+01
ClO2 4 -2.500 1 2.000 2 1.000 5
ClO2 118.206 94.230 74.053 60.888 51.614 44.724 39.401 35.163 JA85
ClO2 31.709 28.839 26.416 24.343 22.550
ClO2 0.8352793E+01 0.3495342E+05 0.3334981E-03 0.3179284E+05-0.3167667E+01
ClO3F 5 -4.000 1 3.000 2 1.000 5 1.000 6
ClO3F 193.935 156.197 124.330 103.457 88.700 77.696 69.166 62.353 JA85
ClO3F 56.781 52.137 48.205 44.830 41.902
ClO3F 0.3611214E+02 0.5434499E+05 0.7116241E-03 0.4088662E+05-0.1015313E+02
Cl2O 4 -2.000 1 1.000 2 2.000 5
Cl2O 91.837 73.736 58.539 48.647 41.693 36.537 32.561 29.402 JA85
Cl2O 26.832 24.700 22.903 21.368 20.042
Cl2O 0.5524472E+01 0.2646123E+05 0.2148552E-03 0.3989774E+05-0.1192936E+01
cobalt 4 1.000 1-2.000 5 1.00026
cobalt 52.343 40.526 30.613 24.169 19.647 16.299 13.722 11.676 JA85
cobalt 10.014 8.636 7.476 6.486 5.630
cobalt -0.8812521E+01 0.1763172E+05-0.8772668E-04 0.1047944E+04 0.8215170E+00
CoCl:Co 4 0.500 1-1.000 5 1.00026
CoCl:Co 30.449 23.627 17.936 14.260 11.697 9.811 8.368 7.229 JA85
CoCl:Co 6.310 5.553 4.920 4.382 3.921
CoCl:Co -0.8660192E+01 0.1033117E+05-0.4201696E-04 0.6765319E+04 0.1776055E+01
(CoCl2)2 2 2.00026
(CoCl2)2 -20.930 -15.175 -10.323 -7.155 -4.923 -3.265 -1.985 -0.965 JA85
(CoCl2)2 -0.135 0.555 1.137 1.635 2.065
(CoCl2)2 0.6753044E+01-0.8567651E+04-0.3228474E-04 0.1324874E+05 0.3691756E+00
CoCl3 4 -0.500 1 1.000 5 1.00026
CoCl3 8.415 7.673 7.139 6.847 6.677 6.575 6.514 6.479 JA85
CoCl3 6.460 6.454 6.455 6.461 6.472
CoCl3 -0.2115963E+01 0.1131026E+04-0.5667048E-04 0.5339388E+05 0.2486887E+01
CoF2:Co 4 -2.000 5 2.000 6 1.00026
CoF2:Co 17.084 13.574 10.595 8.634 7.241 6.199 5.388 4.739 JA85
CoF2:Co 4.205 3.759 3.380 3.054 2.770
CoF2:Co 0.3210630E+01 0.5080348E+04 0.4681495E-04-0.8150531E+04-0.1248169E+01
Cr 4 2.000 1-4.000 5 1.00025
Cr 64.253 48.242 34.827 26.127 20.036 15.539 12.085 9.352 JA85
Cr 7.137 5.305 3.766 2.455 1.325
Cr -0.2598029E+02 0.2444840E+05-0.3166589E-03-0.3683791E+05 0.3532828E+01
CrO 5 1.000 1 1.000 2-4.000 5 1.00025
CrO 69.607 52.426 37.981 28.575 21.967 17.070 13.298 10.304 JA85
CrO 7.869 5.851 4.152 2.701 1.448
CrO -0.1898954E+02 0.2585736E+05-0.6253461E-04-0.4005578E+05 0.9455669E+00
CrO2 4 2.000 2-4.000 5 1.00025
CrO2 67.260 50.832 36.990 27.955 21.590 16.863 13.213 10.309 JA85
CrO2 7.943 5.979 4.321 2.904 1.678
CrO2 -0.1137447E+02 0.2438344E+05 0.1322837E-03-0.2775589E+05-0.1161966E+01
CrO3 5 -1.000 1 3.000 2-4.000 5 1.00025
CrO3 74.702 57.412 42.823 33.280 26.542 21.527 17.645 14.550 JA85
CrO3 12.024 9.921 8.144 6.621 5.302
CrO3 -0.1642360E+01 0.2521740E+05 0.2954894E-03-0.3466045E+04-0.3347993E+01
cesium 4 0.500 1-1.000 5 1.00034
cesium 37.159 29.253 22.600 18.262 15.208 12.941 11.192 9.800 JA85
cesium 8.666 7.724 6.929 6.249 5.660
cesium -0.1800908E+01 0.1175688E+05-0.3696539E-04-0.9042578E+04-0.1455450E+00
(CsCl)2 2 2.00034
(CsCl)2 -24.724 -18.413 -13.129 -9.704 -7.306 -5.536 -4.177 -3.101 JA85
(CsCl)2 -2.230 -1.509 -0.904 -0.389 0.055
(CsCl)2 0.9991602E+01-0.9539422E+04 0.6780940E-04 0.3743700E+04-0.1124525E+01
CsF 4 -1.000 5 1.000 6 1.00034
CsF 11.318 9.023 7.059 5.757 4.825 4.123 3.573 3.130 JA85
CsF 2.765 2.457 2.195 1.968 1.769
CsF 0.3940762E+01 0.3268659E+04 0.5324918E-04-0.1024553E+05-0.1409010E+01
(CsF)2 4 -2.000 5 2.000 6 2.00034
(CsF)2 -1.395 0.244 1.532 2.309 2.813 3.157 3.400 3.576 JA85
(CsF)2 3.705 3.802 3.874 3.929 3.969
(CsF)2 0.1775025E+02-0.2856709E+04 0.1415119E-03-0.1785525E+05-0.3800892E+01
CsO 5 -0.500 1 1.000 2-1.000 5 1.00034
CsO 75.974 60.043 46.657 37.940 31.812 27.268 23.764 20.980 JA85
CsO 18.715 16.837 15.253 13.900 12.731
CsO -0.1961466E+01 0.2353481E+05 0.8740341E-04 0.6974527E+04-0.4466644E+00
CsOH 4 1.000 2-1.000 5 1.00034
CsOH 22.986 18.403 14.556 12.052 10.292 8.986 7.979 7.179 JA85
CsOH 6.527 5.986 5.530 5.140 4.803
CsOH 0.1116854E+01 0.6687360E+04 0.3047917E-04 0.1213241E+05-0.2852925E+00
(CsOH)2 4 2.000 2-2.000 5 2.00034
(CsOH)2 24.132 20.824 17.873 15.827 14.305 13.117 12.155 11.357 JA85
(CsOH)2 10.679 10.095 9.585 9.133 8.730
(CsOH)2 0.3101604E+02 0.3902522E+04 0.3351397E-03-0.1955392E+05-0.8023293E+01
(CES.)2 4 1.000 1-2.000 5 2.00034
(CES.)2 69.798 55.620 43.737 36.022 30.614 26.617 23.544 21.110 JA85
(CES.)2 19.137 17.505 16.135 14.968 13.964
(CES.)2 -0.2987704E+01 0.2109798E+05 0.1651842E-03 0.1005145E+05 0.7518486E+00
Cs2O 4 1.000 2-2.000 5 2.00034
Cs2O 78.515 62.822 49.623 41.019 34.965 30.472 27.006 24.249 JA85
Cs2O 22.004 20.140 18.568 17.225 16.063
Cs2O 0.2756451E+01 0.2317414E+05 0.8233001E-04-0.3761687E+03-0.8034994E+00
Cs2SO4 6 -4.000 1 1.000 4-2.000 5 2.00034 4.000 2
Cs2SO4 37.031 31.299 26.322 22.953 20.497 18.611 17.109 15.879 JA85
Cs2SO4 14.850 13.974 13.218 12.557 11.975
Cs2SO4 0.4076101E+02 0.6687546E+04 0.8561739E-03 0.5485260E+05-0.1092472E+02
Cu 4 0.500 1-1.000 5 1.00014
Cu 24.365 18.929 14.352 11.367 9.265 7.704 6.499 5.540 JA85
Cu 4.758 4.109 3.561 3.091 2.685
Cu -0.2395424E+01 0.8091796E+04-0.3426626E-04-0.7954894E+04-0.1131022E+00
(CuCl)3 2 3.00014
(CuCl)3 -78.438 -59.732 -44.062 -33.896 -26.776 -21.516 -17.475 -14.277 JA85
(CuCl)3 -11.684 -9.540 -7.740 -6.207 -4.887
(CuCl)3 0.2168746E+02-0.2811402E+05 0.3059889E-04 0.4178839E+04-0.2378999E+01
CuF 4 -1.000 5 1.000 6 1.00014
CuF 13.427 10.682 8.335 6.779 5.666 4.828 4.172 3.643 JA85
CuF 3.207 2.840 2.527 2.256 2.019
CuF 0.4521418E+01 0.3905035E+04 0.5766007E-04-0.1084849E+05-0.1651741E+01
CuF2 5 -0.500 1-1.000 5 2.000 6 1.00014
CuF2 20.285 16.859 13.908 11.935 10.512 9.432 8.580 7.889 JA85
CuF2 7.314 6.829 6.412 6.049 5.731
CuF2 0.1353246E+02 0.4618734E+04 0.1725228E-03-0.4572672E+04-0.3531603E+01
CuO 5 -0.500 1 1.000 2-1.000 5 1.00014
CuO 60.711 47.868 37.072 30.041 25.096 21.429 18.600 16.353 JA85
CuO 14.524 13.006 11.727 10.634 9.690
CuO -0.1805210E+01 0.1896904E+05 0.8116447E-04 0.3851460E+04-0.4743408E+00
F 3 -0.500 1 1.000 6
F 59.161 46.732 36.269 29.441 24.632 21.060 18.300 16.104 JA85
F 14.313 12.826 11.570 10.495 9.564
F 0.1798386E+00 0.1831750E+05 0.4954469E-04-0.2934278E+04-0.9852115E+00
FO 4 -1.500 1 1.000 2 1.000 6
FO 106.682 84.691 66.167 54.071 45.545 39.207 34.308 30.407 JA85
FO 27.225 24.580 22.346 20.434 18.779
FO 0.5751679E+01 0.3218772E+05 0.2501866E-03 0.6966042E+04-0.2901980E+01
FO2 4 -2.500 1 2.000 2 1.000 6
FO2 133.005 105.881 83.028 68.101 57.576 49.749 43.698 38.878 JA85
FO2 34.945 31.676 28.914 26.550 24.503
FO2 0.1040736E+02 0.3957090E+05 0.3904559E-03 0.1646035E+05-0.4213237E+01
FS2F 4 -3.000 1 2.000 4 2.000 6
FS2F 47.744 38.903 31.447 26.565 23.114 20.542 18.549 16.958 JA85
FS2F 15.659 14.579 13.666 12.884 12.208
FS2F 0.1523011E+02 0.1233530E+05 0.5495590E-03 0.4677493E+05-0.3859064E+01
F2O 4 -2.000 1 1.000 2 2.000 6
F2O 143.858 115.192 91.020 75.218 64.067 55.767 49.346 44.225 JA85
F2O 40.045 36.566 33.625 31.105 28.922
F2O 0.1624690E+02 0.4174973E+05 0.3745099E-03 0.1251164E+05-0.5120557E+01
Fe 4 1.000 1-2.000 5 1.00010
Fe 58.653 45.569 34.600 27.477 22.485 18.794 15.956 13.708 JA85
Fe 11.884 10.374 9.105 8.024 7.091
Fe -0.1107755E+02 0.1968277E+05-0.7504468E-04-0.9611812E+04 0.1553770E+01
FeBr2 4 -2.000 5 2.000 7 1.00010
FeBr2 -2.886 -2.444 -2.046 -1.767 -1.558 -1.393 -1.259 -1.146 JA85
FeBr2 -1.051 -0.968 -0.895 -0.831 -0.773
FeBr2 -0.4717335E+01-0.4647989E+03-0.7397963E-04 0.2605752E+02 0.1378913E+01
(FeBr2)2 4 -4.000 5 4.000 7 2.00010
(FeBr2)2 -27.316 -20.457 -14.680 -10.909 -8.251 -6.275 -4.748 -3.531 JA85
(FeBr2)2 -2.539 -1.713 -1.016 -0.418 0.099
(FeBr2)2 0.4767560E+01-0.1007222E+05-0.1500345E-04-0.7251633E+03 0.6916422E+00
FeCl 4 0.500 1-1.000 5 1.00010
FeCl 48.340 37.779 28.894 23.104 19.031 16.010 13.680 11.829 JA85
FeCl 10.323 9.074 8.020 7.121 6.344
FeCl -0.3619620E+01 0.1571109E+05 0.6412642E-04-0.1223070E+05-0.2494100E+00
(FeCl2)2 2 2.00010
(FeCl2)2 -19.166 -13.929 -9.574 -6.770 -4.820 -3.389 -2.297 -1.438 JA85
(FeCl2)2 -0.745 -0.175 0.301 0.704 1.050
(FeCl2)2 0.1290335E+02-0.8011491E+04 0.1286069E-03-0.7236227E+04-0.2083540E+01
FeCl3 4 -0.500 1 1.000 5 1.00010
FeCl3 0.530 1.219 1.779 2.129 2.366 2.535 2.661 2.758 JA85
FeCl3 2.834 2.895 2.946 2.988 3.024
FeCl3 0.7607559E+01-0.1204935E+04 0.1484854E-03 0.2887017E+04-0.1258044E+01
(FeCl3)2 4 -1.000 1 2.000 5 2.00010
(FeCl3)2 -16.977 -10.404 -4.962 -1.479 0.928 2.683 4.014 5.055 JA85
(FeCl3)2 5.889 6.571 7.137 7.614 8.022
(FeCl3)2 0.2929793E+02-0.1043382E+05 0.3352522E-03 0.8396404E+04-0.4637063E+01
FeF 5 0.500 1-2.000 5 1.000 6 1.00010
FeF 44.640 34.839 26.542 21.099 17.247 14.374 12.146 10.367 JA85
FeF 8.912 7.700 6.673 5.793 5.029
FeF 0.2591187E+01 0.1436976E+05 0.1768707E-03-0.2594624E+05-0.2387810E+01
FeF2 4 -2.000 5 2.000 6 1.00010
FeF2 20.287 16.269 12.843 10.574 8.953 7.731 6.775 6.004 JA85
FeF2 5.368 4.833 4.377 3.983 3.638
FeF2 0.9276760E+01 0.5476905E+04 0.1989839E-03 0.1081713E+05-0.3047308E+01
FeF3 5 -0.500 1-2.000 5 3.000 6 1.00010
FeF3 -3.780 -2.289 -1.195 -0.596 -0.250 -0.046 0.071 0.134 JA85
FeF3 0.162 0.166 0.154 0.131 0.101
FeF3 0.2459207E+02-0.3054573E+04 0.3812722E-03-0.2695362E+05-0.7249103E+01
Fe(OH)2 4 2.000 2-2.000 5 1.00010
Fe(OH)2 20.222 16.319 12.936 10.656 8.999 7.731 6.724 5.902 JA85
Fe(OH)2 5.215 4.631 4.127 3.687 3.298
Fe(OH)2 0.1788140E+02 0.4917610E+04 0.3292237E-03 0.1140395E+05-0.5811260E+01
FeS 4 1.000 4-2.000 5 1.00010
FeS 54.546 42.309 32.028 25.337 20.637 17.156 14.476 12.351 JA85
FeS 10.624 9.195 7.993 6.968 6.085
FeS -0.6236635E+01 0.1820579E+05 0.1955493E-03-0.7775710E+04-0.1013519E+00
Ga 4 1.500 1-3.000 5 1.00031
Ga 63.850 48.855 36.318 28.201 22.526 18.341 15.131 12.593 JA85
Ga 10.537 8.840 7.416 6.204 5.161
Ga -0.2001061E+02 0.2267101E+05-0.1911536E-03 0.1724191E+04 0.3176188E+01
H 2 0.500 1
H 35.613 27.927 21.448 17.214 14.227 12.005 10.287 8.917 JA85
H 7.799 6.869 6.083 5.410 4.826
H 0.6399540E+00 0.1124920E+05 0.6843049E-04-0.3889658E+03-0.1120664E+01
HCO 4 1.500 1-1.000 2 1.000 3
HCO 34.007 27.118 21.306 17.509 14.833 12.845 11.309 10.086 JA85
HCO 9.090 8.261 7.561 6.962 6.443
HCO -0.6143676E+00 0.1040504E+05-0.8050091E-04-0.3135412E+05 0.4016467E-01
HClO 4 -1.000 1 1.000 5 1.000 2
HClO 45.932 36.781 29.074 24.041 20.491 17.851 15.810 14.183 JA85
HClO 12.856 11.753 10.821 10.022 9.331
HClO 0.5415127E+01 0.1325434E+05 0.1662452E-03 0.1577463E+05-0.1683403E+01
(HF)2 2 2.000 6
(HF)2 1.114 1.973 2.576 2.883 3.040 3.115 3.141 3.138 JA85
(HF)2 3.116 3.082 3.040 2.994 2.944
(HF)2 0.2101731E+02-0.1933260E+04 0.1790220E-03-0.1618660E+05-0.5371102E+01
(HF)3 2 3.000 6
(HF)3 1.796 3.778 5.236 6.031 6.484 6.744 6.887 6.956 JA85
(HF)3 6.976 6.964 6.929 6.880 6.820
(HF)3 0.4108363E+02-0.4293433E+04 0.3414746E-03-0.1032308E+05-0.1005205E+02
(HF)4 2 4.000 6
(HF)4 2.196 5.244 7.513 8.775 9.514 9.955 10.213 10.356 JA85
(HF)4 10.421 10.435 10.412 10.363 10.298
(HF)4 0.5833705E+02-0.6404556E+04 0.4373840E-03-0.1501836E+05-0.1399169E+02
(HF)5 2 5.000 6
(HF)5 2.470 6.626 9.741 11.492 12.532 13.165 13.549 13.772 JA85
(HF)5 13.889 13.933 13.925 13.882 13.813
(HF)5 0.7514931E+02-0.8525057E+04 0.5018562E-03-0.2513653E+05-0.1776283E+02
(HF)6 2 6.000 6
(HF)6 0.699 6.386 10.704 13.176 14.681 15.628 16.230 16.608 JA85
(HF)6 16.836 16.960 17.010 17.008 16.968
(HF)6 0.9286958E+02-0.1135674E+05 0.6190690E-03-0.2688586E+05-0.2180777E+02
(HF)7 2 7.000 6
(HF)7 3.017 9.423 14.263 17.012 18.669 19.698 20.339 20.731 JA85
(HF)7 20.955 21.064 21.091 21.061 20.990
(HF)7 0.1106237E+03-0.1297813E+05 0.7389989E-03-0.2969362E+05-0.2585001E+02
OH 3 -0.500 1 1.000 2
OH 46.046 36.172 27.903 22.537 18.777 15.998 13.862 12.170 JA85
OH 10.797 9.661 8.707 7.894 7.194
OH -0.5171238E+01 0.1467446E+05 0.3398783E-04 0.1381748E+05 0.7408916E+00
HO2 3 -1.500 1 2.000 2
HO2 82.609 65.488 51.063 41.642 34.999 30.059 26.240 23.198 JA85
HO2 20.716 18.653 16.910 15.418 14.125
HO2 0.4876028E+01 0.2500301E+05 0.2212901E-03 0.8529862E+04-0.2541785E+01
HS 3 -0.500 1 1.000 4
HS 24.245 18.803 14.252 11.305 9.245 7.726 6.562 5.642 JA85
HS 4.899 4.287 3.774 3.339 2.967
HS -0.4339237E+01 0.8108577E+04 0.1331301E-03 0.8659804E+04 0.5055168E+00
HSO3F 5 -4.000 1 3.000 2 1.000 4 1.000 6
HSO3F 53.162 43.723 35.629 30.231 26.349 23.407 21.091 19.214 JA85
HSO3F 17.659 16.347 15.223 14.248 13.394
HSO3F 0.3728403E+02 0.1229886E+05 0.7900262E-03 0.4404138E+05-0.1054932E+02
HgBr 4 -0.500 1 1.000 7 1.00041
HgBr 15.804 13.029 10.726 9.245 8.217 7.463 6.888 6.437 JA85
HgBr 6.073 5.774 5.525 5.314 5.134
HgBr -0.8945779E+00 0.4193510E+04-0.3404030E-04 0.1096744E+05 0.1018507E+01
HgBr2 4 -1.000 1 2.000 7 1.00041
HgBr2 -6.612 -3.986 -1.742 -0.256 0.803 1.598 2.219 2.718 JA85
HgBr2 3.128 3.472 3.765 4.018 4.239
HgBr2 0.3893166E+01-0.3914715E+04 0.2947666E-05 0.2589352E+05 0.9427308E+00
HgCl 4 -0.500 1 1.000 5 1.00041
HgCl 21.070 17.227 14.014 11.931 10.474 9.398 8.571 7.917 JA85
HgCl 7.387 6.949 6.581 6.267 5.997
HgCl 0.6176954E+00 0.5723103E+04-0.1058042E-04 0.7401181E+04 0.4755631E+00
HgCl2 4 -1.000 1 2.000 5 1.00041
HgCl2 2.400 3.220 3.920 4.380 4.704 4.946 5.132 5.281 JA85
HgCl2 5.402 5.503 5.588 5.661 5.724
HgCl2 0.7614788E+01-0.1386927E+04 0.6436250E-04 0.2139840E+05-0.3326005E+00
HgF 4 -0.500 1 1.000 6 1.00041
HgF 39.471 31.895 25.508 21.334 18.389 16.198 14.503 13.152 JA85
HgF 12.049 11.131 10.355 9.691 9.115
HgF 0.5321668E+01 0.1106015E+05 0.7931992E-04 0.2038574E+04-0.1209619E+01
HgF2 4 -1.000 1 2.000 6 1.00041
HgF2 39.836 33.058 27.294 23.490 20.781 18.748 17.161 15.885 JA85
HgF2 14.836 13.956 13.206 12.560 11.996
HgF2 0.1665484E+02 0.9545391E+04 0.1770754E-03 0.1479927E+04-0.3598251E+01
HgH 3 0.500 1 1.00041
HgH 32.105 25.841 20.525 17.025 14.540 12.679 11.230 10.069 JA85
HgH 9.116 8.318 7.640 7.056 6.548
HgH 0.7947456E+01 0.9002439E+04 0.9722919E-04-0.8081812E+04-0.2414638E+01
HgO 4 -1.000 1 1.000 2 1.00041
HgO 38.622 30.800 24.233 19.960 16.957 14.732 13.016 11.654 JA85
HgO 10.546 9.627 8.853 8.193 7.623
HgO 0.1075708E+01 0.1145777E+05 0.1076001E-03 0.1558243E+05-0.4407317E+00
K 4 0.500 1-1.000 5 1.000 9
K 34.795 27.344 21.070 16.977 14.094 11.953 10.299 8.983 JA85
K 7.910 7.019 6.267 5.623 5.065
K -0.1069001E+01 0.1102956E+05 0.5023091E-05-0.6292864E+04-0.4283909E+00
KBr 4 -1.000 5 1.000 7 1.000 9
KBr -3.707 -2.952 -2.303 -1.871 -1.562 -1.328 -1.144 -0.996 JA85
KBr -0.873 -0.769 -0.681 -0.604 -0.537
KBr -0.1386565E+01-0.1079701E+04-0.1065876E-04 0.5109309E+04 0.5037596E+00
(KBr)2 4 -2.000 5 2.000 7 2.000 9
(KBr)2 -32.501 -24.646 -18.039 -13.733 -10.704 -8.457 -6.723 -5.345 JA85
(KBr)2 -4.223 -3.292 -2.506 -1.835 -1.255
(KBr)2 0.6092358E+01-0.1165943E+05-0.1261313E-04 0.5377903E+04 0.1841985E+00
KCN 7 2.500 1-2.000 2 1.000 3-1.000 5 1.000 9 0.50037
KCN 22.593 18.670 15.402 13.299 11.838 10.767 9.951 9.309 JA85
KCN 8.792 8.367 8.012 7.711 7.452
KCN -0.4469679E+01 0.6290231E+04-0.2682054E-03-0.2200744E+05 0.2543091E+01
(KCl)2 2 2.000 9
(KCl)2 -26.440 -19.819 -14.276 -10.681 -8.164 -6.305 -4.877 -3.747 JA85
(KCl)2 -2.831 -2.074 -1.438 -0.896 -0.429
(KCl)2 0.9367098E+01-0.9959750E+04 0.4072181E-04 0.3387859E+03-0.9771111E+00
KF 4 -1.000 5 1.000 6 1.000 9
KF 12.038 9.594 7.504 6.118 5.128 4.382 3.798 3.327 JA85
KF 2.939 2.613 2.334 2.093 1.882
KF 0.3857472E+01 0.3499063E+04 0.3629700E-04-0.1161643E+05-0.1388398E+01
(KF)2 4 -2.000 5 2.000 6 2.000 9
(KF)2 -5.613 -3.143 -1.155 0.076 0.901 1.482 1.908 2.229 JA85
(KF)2 2.477 2.672 2.827 2.952 3.054
(KF)2 0.1782193E+02-0.4106031E+04 0.1526500E-03-0.1616353E+05-0.3850133E+01
KH 4 1.000 1-1.000 5 1.000 9
KH 42.198 33.531 26.198 21.387 17.982 15.440 13.468 11.891 JA85
KH 10.600 9.523 8.609 7.825 7.143
KH 0.5239596E+01 0.1262851E+05 0.6731283E-04-0.1210425E+05-0.2134521E+01
KO 5 -0.500 1 1.000 2-1.000 5 1.000 9
KO 73.004 57.675 44.795 36.406 30.509 26.136 22.764 20.084 JA85
KO 17.904 16.095 14.570 13.268 12.142
KO -0.1946366E+01 0.2264191E+05 0.7644317E-04 0.6869668E+04-0.4409488E+00
KOH 4 1.000 2-1.000 5 1.000 9
KOH 23.287 18.658 14.772 12.241 10.462 9.142 8.124 7.314 JA85
KOH 6.654 6.106 5.644 5.249 4.908
KOH 0.1382914E+01 0.6740856E+04 0.3098942E-04 0.1308933E+05-0.3480857E+00
(KOH)2 4 2.000 2-2.000 5 2.000 9
(KOH)2 20.931 18.255 15.834 14.134 12.855 11.847 11.024 10.336 JA85
(KOH)2 9.749 9.239 8.791 8.393 8.036
(KOH)2 0.3055799E+02 0.2999572E+04 0.3067959E-03-0.2258214E+05-0.7890696E+01
K2 4 1.000 1-2.000 5 2.000 9
K2 63.782 50.774 39.777 32.574 27.483 23.691 20.754 18.413 JA85
K2 16.500 14.909 13.565 12.413 11.416
K2 0.7549503E+01 0.1903330E+05 0.3424766E-03-0.2227035E+05-0.3013625E+01
K2SO4 6 -4.000 1 1.000 4-2.000 5 2.000 9 4.000 2
K2SO4 33.419 28.482 24.174 21.243 19.094 17.438 16.113 15.024 JA85
K2SO4 14.109 13.329 12.653 12.061 11.538
K2SO4 0.4049233E+02 0.5547601E+04 0.8201024E-03 0.5268670E+05-0.1071651E+02
Li 4 0.500 1-1.000 5 1.00032
Li 43.548 34.292 26.507 21.433 17.865 15.218 13.176 11.553 JA85
Li 10.232 9.135 8.210 7.419 6.735
Li -0.2906105E+01 0.1381995E+05-0.5067242E-04-0.1326263E+05 0.1075189E+00
LiAlF4 5 -1.000 5 1.000 6 1.00013 1.00032
LiAlF4 -39.025 -29.631 -21.793 -16.732 -13.204 -10.611 -8.629 -7.067 JA85
LiAlF4 -5.807 -4.771 -3.905 -3.171 -2.542
LiAlF4 0.1627380E+02-0.1438535E+05 0.6323222E-04 0.6673313E+04-0.2887123E+01
LiBr 4 -1.000 5 1.000 7 1.00032
LiBr -2.454 -1.948 -1.507 -1.208 -0.990 -0.823 -0.690 -0.582 JA85
LiBr -0.491 -0.414 -0.347 -0.289 -0.238
LiBr -0.2245418E+01-0.6513512E+03-0.5168996E-04 0.1726301E+04 0.7969817E+00
(LiBr)2 4 -2.000 5 2.000 7 2.00032
(LiBr)2 -31.692 -23.893 -17.316 -13.018 -9.988 -7.736 -5.995 -4.609 JA85
(LiBr)2 -3.479 -2.539 -1.746 -1.066 -0.478
(LiBr)2 0.5588321E+01-0.1160309E+05-0.1611288E-04 0.1921737E+05 0.5760064E+00
LiClO 4 -1.000 1 1.00032 1.000 2
LiClO 74.922 60.000 47.427 39.214 33.422 29.115 25.784 23.130 JA85
LiClO 20.965 19.164 17.642 16.340 15.212
LiClO 0.7693777E+01 0.2174747E+05 0.2050027E-03 0.1099336E+05-0.2383531E+01
(LiCl)2 2 2.00032
(LiCl)2 -29.124 -21.832 -15.708 -11.726 -8.932 -6.864 -5.272 -4.010 JA85
(LiCl)2 -2.984 -2.136 -1.422 -0.813 -0.288
(LiCl)2 0.8929613E+01-0.1096724E+05 0.1112059E-04 0.1144213E+05-0.5663689E+00
(LiCl)3 2 3.00032
(LiCl)3 -57.327 -42.652 -30.388 -22.456 -16.919 -12.842 -9.722 -7.260 JA85
(LiCl)3 -5.271 -3.633 -2.261 -1.097 -0.099
(LiCl)3 0.2751580E+02-0.2245586E+05 0.1092023E-03 0.2108874E+05-0.3958570E+01
LiF 4 -1.000 5 1.000 6 1.00032
LiF 6.269 4.978 3.843 3.068 2.501 2.064 1.716 1.430 JA85
LiF 1.190 0.985 0.807 0.652 0.514
LiF 0.5423286E+01 0.1744292E+04 0.6749008E-04-0.1728120E+05-0.1952135E+01
LiFO 6 -1.000 1-1.000 5 1.000 6 1.00032 1.000 2
LiFO 92.855 74.286 58.619 48.371 41.135 35.748 31.577 28.251 JA85
LiFO 25.534 23.272 21.359 19.720 18.298
LiFO 0.1063173E+02 0.2706611E+05 0.2304530E-03 0.1335047E+03-0.3486495E+01
(LiF)2 4 -2.000 5 2.000 6 2.00032
(LiF)2 -25.809 -19.188 -13.718 -10.226 -7.819 -6.068 -4.744 -3.712 JA85
(LiF)2 -2.888 -2.218 -1.664 -1.199 -0.804
(LiF)2 0.2048526E+02-0.1043892E+05 0.1725143E-03-0.3839365E+04-0.4562745E+01
(LiF)3 4 -3.000 5 3.000 6 3.00032
(LiF)3 -53.115 -39.568 -28.354 -21.177 -16.217 -12.601 -9.860 -7.718 JA85
(LiF)3 -6.004 -4.605 -3.446 -2.472 -1.644
(LiF)3 0.3742427E+02-0.2113480E+05 0.2394721E-03-0.1294669E+05-0.7912352E+01
LiH 4 1.000 1-1.000 5 1.00032
LiH 42.012 33.384 26.071 21.265 17.859 15.314 13.337 11.754 JA85
LiH 10.458 9.375 8.457 7.667 6.980
LiH 0.5980413E+01 0.1259501E+05 0.8057494E-04-0.2267912E+05-0.2417194E+01
LiNaO 5 1.000 2-2.000 5 1.000 8 1.00032
LiNaO 57.831 46.192 36.355 29.911 25.354 21.957 19.324 17.222 JA85
LiNaO 15.503 14.071 12.858 11.817 10.914
LiNaO 0.7255417E+01 0.1698598E+05 0.1348172E-03-0.1219870E+05-0.2545483E+01
LiO 5 -0.500 1 1.000 2-1.000 5 1.00032
LiO 72.001 56.881 44.170 35.889 30.065 25.745 22.413 19.764 JA85
LiO 17.609 15.820 14.311 13.023 11.909
LiO -0.1653599E+01 0.2234638E+05 0.7445334E-04 0.2088379E+04-0.5420184E+00
LiOH 4 1.000 2-1.000 5 1.00032
LiOH 19.649 15.747 12.474 10.344 8.847 7.737 6.881 6.201 JA85
LiOH 5.647 5.187 4.799 4.468 4.181
LiOH 0.8988791E+00 0.5690708E+04 0.1302139E-04 0.1175478E+05-0.1910647E+00
(LiOH)2 4 2.000 2-2.000 5 2.00032
(LiOH)2 4.698 5.352 5.738 5.870 5.881 5.831 5.748 5.648 JA85
(LiOH)2 5.539 5.427 5.314 5.202 5.093
(LiOH)2 0.3050960E+02-0.1974363E+04 0.2794837E-03-0.1352604E+05-0.7727303E+01
Li2 4 1.000 1-2.000 5 2.00032
Li2 73.312 58.385 45.763 37.495 31.650 27.296 23.923 21.232 JA85
Li2 19.033 17.202 15.652 14.323 13.171
Li2 0.5977640E+01 0.2206092E+05 0.1152291E-03-0.4428184E+05-0.2503417E+01
Li2ClF 4 -1.000 5 1.000 6 2.00032
Li2ClF -24.244 -17.885 -12.608 -9.224 -6.879 -5.166 -3.864 -2.845 JA85
Li2ClF -2.028 -1.359 -0.803 -0.335 0.063
Li2ClF 0.1726282E+02-0.9907184E+04 0.1163144E-03 0.1482490E+03-0.3360115E+01
Li2O 4 1.000 2-2.000 5 2.00032
Li2O 49.962 40.017 31.609 26.098 22.200 19.293 17.039 15.239 JA85
Li2O 13.766 12.538 11.498 10.606 9.831
Li2O 0.7188534E+01 0.1449192E+05 0.1183766E-03-0.1032295E+05-0.2324493E+01
Li2O2 5 -1.000 1 2.000 2-2.000 5 2.00032
Li2O2 79.771 64.002 50.744 42.102 36.022 31.508 28.025 25.254 JA85
Li2O2 22.997 21.124 19.543 18.192 17.024
Li2O2 0.5260404E+01 0.2310687E+05 0.1523046E-03 0.1862063E+05-0.1311434E+01
Li2SO4 6 -4.000 1 1.000 4-2.000 5 2.00032 4.000 2
Li2SO4 35.468 30.026 25.298 22.096 19.758 17.962 16.531 15.357 JA85
Li2SO4 14.374 13.537 12.813 12.181 11.623
Li2SO4 0.3977686E+02 0.6287676E+04 0.8086849E-03 0.5633748E+05-0.1061766E+02
Mg 4 1.000 1-2.000 5 1.00022
Mg 56.191 43.687 33.174 26.328 21.516 17.950 15.202 13.019 JA85
Mg 11.243 9.770 8.529 7.468 6.552
Mg -0.8258742E+01 0.1879668E+05-0.1060274E-03-0.2634443E+05 0.7004903E+00
MgBr 5 0.500 1-2.000 5 1.000 7 1.00022
MgBr 32.548 25.200 19.050 15.063 12.274 10.216 8.636 7.387 JA85
MgBr 6.375 5.538 4.836 4.239 3.725
MgBr -0.8239835E+01 0.1113680E+05-0.7714181E-04-0.6533104E+04 0.1427110E+01
MgBr2 4 -2.000 5 2.000 7 1.00022
MgBr2 -3.910 -3.114 -2.415 -1.938 -1.589 -1.321 -1.106 -0.930 JA85
MgBr2 -0.782 -0.656 -0.547 -0.451 -0.366
MgBr2 -0.3549576E+01-0.1054337E+04-0.4890040E-04 0.8157815E+04 0.1252268E+01
(MgBr2)2 4 -4.000 5 4.000 7 2.00022
(MgBr2)2 -28.837 -21.551 -15.385 -11.341 -8.479 -6.343 -4.687 -3.363 JA85
(MgBr2)2 -2.280 -1.377 -0.612 0.044 0.613
(MgBr2)2 0.1683228E+01-0.1058843E+05-0.1418097E-03 0.8677890E+04 0.1995643E+01
MgCl 4 0.500 1-1.000 5 1.00022
MgCl 40.890 31.856 24.273 19.344 15.885 13.325 11.355 9.793 JA85
MgCl 8.524 7.473 6.589 5.834 5.183
MgCl -0.6639972E+01 0.1358960E+05-0.6087046E-04-0.1201736E+05 0.8501182E+00
MgClF 4 -1.000 5 1.000 6 1.00022
MgClF 0.969 0.797 0.621 0.485 0.376 0.285 0.208 0.141 JA85
MgClF 0.082 0.030 -0.016 -0.058 -0.096
MgClF 0.3954206E+01 0.1176527E+03 0.8176177E-04-0.7748683E+04-0.1340492E+01
(MgCl2)2 2 2.00022
(MgCl2)2 -22.629 -16.667 -11.671 -8.428 -6.156 -4.477 -3.187 -2.165 JA85
(MgCl2)2 -1.337 -0.652 -0.077 0.412 0.834
(MgCl2)2 0.8639881E+01-0.8921829E+04-0.3257197E-04-0.5592462E+03-0.5370557E+00
MgF 5 0.500 1-2.000 5 1.000 6 1.00022
MgF 38.693 30.069 22.787 18.022 14.658 12.154 10.217 8.672 JA85
MgF 7.411 6.361 5.473 4.712 4.052
MgF -0.1608714E+01 0.1280042E+05 0.3739709E-05-0.2413645E+05-0.9540701E+00
MgF2 4 -2.000 5 2.000 6 1.00022
MgF2 4.552 3.538 2.608 1.950 1.453 1.060 0.739 0.470 JA85
MgF2 0.240 0.041 -0.134 -0.289 -0.428
MgF2 0.8438572E+01 0.1205522E+04 0.1414984E-03-0.2250241E+05-0.3119440E+01
(MgF2)2 4 -4.000 5 4.000 6 2.00022
(MgF2)2 -28.101 -20.808 -14.848 -11.089 -8.529 -6.690 -5.316 -4.260 JA85
(MgF2)2 -3.427 -2.758 -2.213 -1.763 -1.387
(MgF2)2 0.3008161E+02-0.1173553E+05 0.2412827E-03-0.2391196E+05-0.7526742E+01
MgH 4 1.500 1-2.000 5 1.00022
MgH 61.120 47.814 36.570 29.208 24.008 20.135 17.136 14.743 JA85
MgH 12.788 11.160 9.783 8.601 7.577
MgH 0.1723788E-01 0.1969697E+05 0.2636782E-04-0.3673756E+05-0.1841116E+01
MgO 4 1.000 2-2.000 5 1.00022
MgO 82.631 64.480 48.708 38.079 30.373 24.497 19.846 16.061 JA85
MgO 12.909 10.239 7.942 5.943 4.185
MgO 0.5536566E+02 0.2475070E+05 0.1275726E-02-0.1438716E+06-0.2202959E+02
MgOH 5 0.500 1 1.000 2-2.000 5 1.00022
MgOH 46.303 36.271 27.841 22.352 18.492 15.630 13.423 11.669 JA85
MgOH 10.241 9.056 8.056 7.202 6.464
MgOH -0.3404166E+01 0.1486207E+05-0.1956716E-04 0.1406455E+04-0.6079886E-01
Mg(OH)2 4 2.000 2-2.000 5 1.00022
Mg(OH)2 21.571 17.379 13.850 11.543 9.914 8.699 7.757 7.004 JA85
Mg(OH)2 6.388 5.874 5.438 5.064 4.738
Mg(OH)2 0.4427213E+01 0.5905612E+04 0.4536815E-04 0.2415622E+05-0.1191777E+01
MgS 4 1.000 4-2.000 5 1.00022
MgS 59.327 45.974 34.354 26.510 20.816 16.468 13.024 10.219 JA85
MgS 7.883 5.903 4.200 2.719 1.416
MgS 0.4425847E+02 0.1792237E+05 0.1239393E-02-0.9410036E+05-0.1792503E+02
Mg2 4 2.000 1-4.000 5 2.00022
Mg2 114.212 89.458 68.695 55.212 45.764 38.782 33.416 29.168 JA85
Mg2 25.722 22.873 20.479 18.440 16.684
Mg2 -0.2041741E+02 0.3757403E+05-0.1735124E-03-0.5495422E+05 0.3748508E+01
Mn 4 1.000 1-2.000 5 1.00028
Mn 57.210 44.425 33.665 26.652 21.718 18.057 15.234 12.989 JA85
Mn 11.162 9.645 8.366 7.273 6.327
Mn -0.6947426E+01 0.1913081E+05-0.5267530E-04-0.2548773E+05 0.1191648E+00
Mo 4 3.000 1 1.00017-4.000 2
Mo 85.194 66.155 50.317 40.132 33.060 27.883 23.939 20.843 JA85
Mo 18.354 16.312 14.610 13.171 11.940
Mo -0.3982000E+02 0.2994002E+05-0.6671166E-03-0.4830553E+05 0.1023952E+02
MoBr 5 2.500 1 1.000 7 1.00017-4.000 2
MoBr 58.639 45.432 34.523 27.565 22.775 19.296 16.669 14.624 JA85
MoBr 12.993 11.666 10.570 9.651 8.871
MoBr -0.3962540E+02 0.2131058E+05-0.6591083E-03-0.3228465E+05 0.1105226E+02
MoBr2 5 2.000 1 2.000 7 1.00017-4.000 2
MoBr2 18.505 14.250 10.909 8.906 7.616 6.743 6.134 5.698 JA85
MoBr2 5.381 5.150 4.979 4.855 4.764
MoBr2 -0.3732813E+02 0.7922579E+04-0.6085902E-03 0.6218063E+04 0.1187026E+02
MoBr3 5 1.500 1 3.000 7 1.00017-4.000 2
MoBr3 -1.754 -1.115 -0.364 0.284 0.847 1.343 1.783 2.177 JA85
MoBr3 2.533 2.856 3.150 3.420 3.669
MoBr3 -0.3225580E+02 0.6844459E+03-0.6957917E-03-0.7505138E+04 0.1151697E+02
MoBr4 5 1.000 1-4.000 2 4.000 7 1.00017
MoBr4 -19.211 -14.118 -9.616 -6.523 -4.239 -2.466 -1.041 0.136 JA85
MoBr4 1.130 1.982 2.724 3.377 3.957
MoBr4 -0.2634354E+02-0.6076538E+04-0.5966170E-03 0.1084829E+05 0.1114160E+02
MoCl4 5 1.000 1-4.000 2 4.000 5 1.00017
MoCl4 -17.531 -12.803 -8.662 -5.840 -3.772 -2.178 -0.904 0.143 JA85
MoCl4 1.023 1.774 2.425 2.995 3.500
MoCl4 -0.2010519E+02-0.5772513E+04-0.5329193E-03-0.1406604E+04 0.8935377E+01
MoCl5 5 0.500 1 5.000 5 1.00017-4.000 2
MoCl5 -7.354 -3.662 -0.383 1.880 3.555 4.856 5.905 6.772 JA85
MoCl5 7.503 8.132 8.678 9.159 9.587
MoCl5 -0.1347532E+02-0.4447074E+04-0.4897839E-03 0.2295871E+05 0.8456341E+01
MoCl6 4 6.000 5 1.00017-4.000 2
MoCl6 15.490 15.629 15.905 16.198 16.479 16.741 16.981 17.202 JA85
MoCl6 17.405 17.592 17.765 17.925 18.074
MoCl6 -0.4790251E+01 0.6248501E+03-0.4025421E-03 0.2898608E+05 0.7265700E+01
MoF 5 2.500 1 1.000 6 1.00017-4.000 2
MoF 69.476 54.042 41.204 32.949 27.219 23.025 19.832 17.326 JA85
MoF 15.312 13.660 12.284 11.121 10.127
MoF -0.3252966E+02 0.2433359E+05-0.5418847E-03-0.4462697E+05 0.8508594E+01
MoF2 5 2.000 1 2.000 6 1.00017-4.000 2
MoF2 43.622 34.242 26.462 21.477 18.032 15.520 13.615 12.126 JA85
MoF2 10.934 9.961 9.153 8.473 7.893
MoF2 -0.2355250E+02 0.1511063E+05-0.4630006E-03-0.4130596E+05 0.6909014E+01
MoF3 5 1.500 1 3.000 6 1.00017-4.000 2
MoF3 18.066 14.685 11.894 10.120 8.904 8.025 7.364 6.852 JA85
MoF3 6.445 6.115 5.843 5.615 5.421
MoF3 -0.1190944E+02 0.5851198E+04-0.4189799E-03-0.4041192E+05 0.4417156E+01
MoF4 5 1.000 1-4.000 2 4.000 6 1.00017
MoF4 10.222 9.176 8.279 7.689 7.271 6.960 6.720 6.528 JA85
MoF4 6.371 6.241 6.130 6.034 5.950
MoF4 0.2127463E+01 0.1913890E+04-0.1923113E-03-0.4220207E+05 0.8920832E+00
MoF5 5 0.500 1 5.000 6 1.00017-4.000 2
MoF5 11.332 10.994 10.661 10.411 10.212 10.049 9.911 9.791 JA85
MoF5 9.686 9.591 9.506 9.428 9.357
MoF5 0.1388015E+02 0.4035763E+03-0.8093317E-04-0.2056081E+05-0.1473590E+01
MoF6 4 6.000 6 1.00017-4.000 2
MoF6 9.309 10.453 11.304 11.780 12.063 12.235 12.340 12.401 JA85
MoF6 12.433 12.445 12.443 12.431 12.412
MoF6 0.2727354E+02-0.2124764E+04 0.3313308E-04-0.3022770E+05-0.4246576E+01
MoO 4 2.000 1-3.000 2 1.00017
MoO 66.497 51.201 38.514 30.382 24.756 20.650 17.535 15.098 JA85
MoO 13.146 11.550 10.226 9.110 8.160
MoO -0.3875035E+02 0.2427208E+05-0.5397124E-03-0.3590176E+05 0.9862115E+01
MoO2 4 1.000 1-2.000 2 1.00017
MoO2 54.121 41.536 31.091 24.389 19.749 16.360 13.785 11.770 JA85
MoO2 10.154 8.833 7.735 6.810 6.022
MoO2 -0.3038381E+02 0.1983794E+05-0.3533458E-03-0.2287266E+05 0.7408020E+01
MoO2Cl2 4 -2.000 2 2.000 5 1.00017
MoO2Cl2 -13.460 -10.553 -7.999 -6.255 -4.974 -3.983 -3.190 -2.536 JA85
MoO2Cl2 -1.986 -1.515 -1.106 -0.746 -0.426
MoO2Cl2 -0.1501469E+02-0.3577825E+04-0.2445281E-03 0.5123638E+04 0.5484091E+01
MoO3 3 -1.000 2 1.00017
MoO3 39.922 30.715 23.076 18.175 14.782 12.304 10.422 8.948 JA85
MoO3 7.767 6.801 5.999 5.324 4.749
MoO3 -0.2092222E+02 0.1441766E+05-0.1874283E-03-0.7178968E+04 0.5101704E+01
N 2 0.50037
N 79.807 63.164 49.182 40.079 33.680 28.936 25.278 22.372 JA85
N 20.007 18.045 16.392 14.979 13.757
N -0.2461109E+01 0.2463270E+05 0.2079409E-04 0.5495460E+04-0.1691024E+00
NBr 4 -0.500 1 1.000 7 0.50037
NBr 58.745 46.884 36.940 30.478 25.944 22.587 20.003 17.953 JA85
NBr 16.287 14.906 13.745 12.753 11.898
NBr -0.9056138E+00 0.1751535E+05 0.3501856E-04 0.2021172E+05 0.2691697E+00
CN 5 2.000 1-2.000 2 1.000 3 0.50037
CN 59.959 47.836 37.709 31.161 26.590 23.223 20.645 18.609 JA85
CN 16.963 15.605 14.466 13.499 12.666
CN -0.1138196E+02 0.1858206E+05-0.2911386E-03-0.1489184E+05 0.3746601E+01
CBrN 6 1.500 1-2.000 2 1.000 3 1.000 7 0.50037
CBrN 27.306 22.668 18.829 16.370 14.668 13.426 12.481 11.741 JA85
CBrN 11.147 10.659 10.254 9.910 9.617
CBrN -0.4293991E+01 0.7246768E+04-0.2509150E-03 0.5299700E+04 0.2953951E+01
ClCN 6 1.500 1-2.000 2 1.000 3 1.000 5 0.50037
ClCN 28.654 23.739 19.649 17.014 15.181 13.835 12.806 11.995 JA85
ClCN 11.341 10.802 10.350 9.967 9.637
ClCN -0.2193591E+01 0.7579358E+04-0.2261634E-03 0.1100091E+04 0.2215200E+01
HCN 5 2.500 1-2.000 2 1.000 3 0.50037
HCN 10.858 9.282 7.982 7.155 6.586 6.173 5.861 5.618 JA85
HCN 5.424 5.265 5.132 5.020 4.924
HCN -0.2817512E+01 0.2672717E+04-0.2563113E-03-0.1254420E+05 0.1991835E+01
CNC 5 4.000 1-4.000 2 2.000 3 0.50037
CNC 69.046 55.838 44.826 37.721 32.771 29.133 26.351 24.158 JA85
CNC 22.387 20.928 19.707 18.670 17.779
CNC -0.1198938E+02 0.2038178E+05-0.4426670E-03-0.1344820E+05 0.5236688E+01
CF3CN 6 2.500 1-4.000 2 2.000 3 3.000 6 0.50037
CF3CN 41.870 36.720 32.256 29.253 27.077 25.416 24.099 23.025 JA85
CF3CN 22.128 21.366 20.707 20.130 19.621
CF3CN 0.3167589E+02 0.7071951E+04-0.1070065E-05-0.3322167E+05-0.5314844E+01
NF 4 -0.500 1 1.000 6 0.50037
NF 90.918 72.503 56.978 46.833 39.676 34.352 30.234 26.952 JA85
NF 24.273 22.045 20.161 18.548 17.150
NF 0.7184514E+01 0.2695338E+05 0.1714225E-03-0.1454371E+04-0.2709019E+01
NF2 4 -1.000 1 2.000 6 0.50037
NF2 106.442 85.655 68.083 56.565 48.416 42.337 37.622 33.854 JA85
NF2 30.772 28.201 26.023 24.153 22.529
NF2 0.1871216E+02 0.3011582E+05 0.2896547E-03-0.4310239E+04-0.5381819E+01
NF3 4 -1.500 1 3.000 6 0.50037
NF3 128.877 104.576 83.991 70.464 60.869 53.695 48.117 43.650 JA85
NF3 39.987 36.925 34.326 32.090 30.145
NF3 0.3407637E+02 0.3477403E+05 0.4618067E-03 0.6249533E+04-0.8907103E+01
NH 3 0.500 1 0.50037
NH 64.921 51.667 40.542 33.307 28.227 24.465 21.566 19.266 JA85
NH 17.395 15.845 14.539 13.424 12.461
NH -0.2538323E+01 0.1971896E+05-0.4228057E-04 0.2323344E+04 0.5286548E+00
HNCO 5 1.500 1-1.000 2 1.000 3 0.50037
HNCO 12.866 11.102 9.616 8.646 7.961 7.452 7.058 6.743 JA85
HNCO 6.485 6.270 6.088 5.931 5.794
HNCO 0.3926717E+01 0.2633541E+04-0.8769388E-04-0.2814180E+04 0.6633778E-01
NH2 3 1.000 1 0.50037
NH2 35.013 28.291 22.609 18.886 16.254 14.293 12.772 11.558 JA85
NH2 10.565 9.737 9.035 8.433 7.910
NH2 0.4482813E+01 0.9920822E+04-0.2499399E-04-0.1676908E+05-0.1029861E+01
NH3 3 1.500 1 0.50037
NH3 -2.866 -1.301 -0.087 0.634 1.095 1.403 1.616 1.766 JA85
NH3 1.872 1.947 2.000 2.035 2.058
NH3 0.1495655E+02-0.2610026E+04-0.2016117E-04-0.3631583E+05-0.3497331E+01
NO 4 -1.000 1 1.000 2 0.50037
NO 55.212 43.504 33.640 27.198 22.658 19.282 16.674 14.597 JA85
NO 12.903 11.495 10.307 9.289 8.409
NO 0.1343077E+01 0.1716832E+05 0.1450955E-03-0.6151362E+03-0.1515604E+01
NOBr 5 -1.500 1 1.000 2 1.000 7 0.50037
NOBr 63.854 51.160 40.483 33.521 28.619 24.979 22.168 19.932 JA85
NOBr 18.110 16.597 15.321 14.229 13.285
NOBr 0.5173004E+01 0.1851962E+05 0.1863827E-03 0.1905608E+05-0.1496936E+01
ONCl 5 -1.500 1 1.000 2 1.000 5 0.50037
ONCl 68.315 54.717 43.266 35.788 30.516 26.596 23.565 21.151 JA85
ONCl 19.182 17.544 16.161 14.976 13.951
ONCl 0.7131962E+01 0.1977415E+05 0.1984592E-03 0.1718531E+05-0.2179229E+01
ONF 5 -1.500 1 1.000 2 1.000 6 0.50037
ONF 79.481 63.621 50.224 41.448 35.243 30.617 27.032 24.168 JA85
ONF 21.827 19.876 18.225 16.808 15.578
ONF 0.1241814E+02 0.2294374E+05 0.2901834E-03 0.4800898E+04-0.4054010E+01
HNO 4 -0.500 1 1.000 2 0.50037
HNO 59.732 47.671 37.456 30.748 25.995 22.445 19.687 17.481 JA85
HNO 15.675 14.167 12.888 11.789 10.834
HNO 0.1043296E+02 0.1746489E+05 0.2064508E-03-0.1437028E+05-0.3709273E+01
NO2 4 -2.000 1 2.000 2 0.50037
NO2 89.050 70.818 55.417 45.330 38.198 32.883 28.764 25.475 RH95
NO2 22.787 20.547 18.652 17.026 15.616
NO2 0.1157252E+02 0.2641832E+05 0.3488867E-03 0.1413514E+04-0.4546460E+01
NO2Cl 5 -2.500 1 2.000 2 1.000 5 0.50037
NO2Cl 106.230 85.479 67.951 56.466 48.342 42.283 37.584 33.830 JA85
NO2Cl 30.760 28.200 26.031 24.171 22.556
NO2Cl 0.2095292E+02 0.2979204E+05 0.4592968E-03 0.2645828E+05-0.6094537E+01
HNO2-CIS 4 -1.500 1 2.000 2 0.50037
HNO2-CIS 72.743 58.369 46.193 38.192 32.518 28.274 24.974 22.332 JA85
HNO2-CIS 20.166 18.356 16.819 15.498 14.349
HNO2-CIS 0.1774853E+02 0.2047911E+05 0.3598757E-03 0.1161297E+05-0.5629832E+01
HNO2-TRA 4 -1.500 1 2.000 2 0.50037
HNO2-TRA 72.384 58.090 45.993 38.052 32.424 28.218 24.951 22.336 JA85
HNO2-TRA 20.194 18.405 16.888 15.584 14.450
HNO2-TRA 0.1673827E+02 0.2038036E+05 0.3581629E-03 0.1716335E+05-0.5257822E+01
NO3 4 -3.000 1 3.000 2 0.50037
NO3 140.464 112.364 88.640 73.105 62.123 53.936 47.591 42.524 JA85
NO3 38.381 34.929 32.007 29.500 27.325
NO3 0.2307546E+02 0.4043324E+05 0.5861717E-03 0.3596551E+05-0.7599531E+01
NS 4 -1.000 1 1.000 4 0.50037
NS 47.061 37.065 28.665 23.195 19.349 16.499 14.302 12.557 JA85
NS 11.139 9.963 8.974 8.130 7.402
NS -0.5398886E+00 0.1468993E+05 0.2144893E-03 0.9079267E+04-0.7417650E+00
CNN 5 2.000 1-2.000 2 1.000 3 1.00037
CNN 89.612 72.223 57.652 48.196 41.570 36.671 32.905 29.921 JA85
CNN 27.498 25.493 23.806 22.368 21.127
CNN -0.4121650E+01 0.2615920E+05-0.2383453E-03-0.5375869E+04 0.2476069E+01
NCN 5 2.000 1-2.000 2 1.000 3 1.00037
NCN 70.329 56.848 45.511 38.124 32.927 29.072 26.097 23.732 JA85
NCN 21.805 20.206 18.856 17.701 16.702
NCN 0.2960311E+01 0.2007097E+05-0.1049662E-03-0.1199682E+05 0.8752808E-01
C4N2 5 8.000 1-8.000 2 4.000 3 1.00037
C4N2 45.538 39.504 34.563 31.445 29.321 27.794 26.652 25.770 JA85
C4N2 25.072 24.507 24.042 23.653 23.323
C4N2 -0.1129047E+02 0.1042530E+05-0.9676054E-03-0.4311028E+05 0.9147641E+01
N2F4 4 -2.000 1 4.000 6 1.00037
N2F4 206.990 168.655 136.165 114.801 99.638 88.292 79.465 72.391 JA85
N2F4 66.586 61.732 57.608 54.058 50.967
N2F4 0.6030574E+02 0.5468690E+05 0.7197066E-03 0.1500711E+05-0.1500137E+02
N2H4 3 2.000 1 1.00037
N2H4 27.898 24.443 21.341 19.177 17.557 16.284 15.249 14.384 JA85
N2H4 13.646 13.005 12.443 11.942 11.493
N2H4 0.3642368E+02 0.4022973E+04 0.1650148E-03-0.2516090E+05-0.8803993E+01
N2O 4 -1.000 1 1.000 2 1.00037
N2O 58.292 46.855 37.176 30.823 26.321 22.957 20.345 18.254 JA85
N2O 16.541 15.111 13.898 12.856 11.949
N2O 0.1306921E+02 0.1636508E+05 0.2486738E-03 0.8897006E+04-0.3976729E+01
N2O3 4 -3.000 1 3.000 2 1.00037
N2O3 144.600 116.075 91.975 76.182 65.011 56.679 50.219 45.058 JA85
N2O3 40.836 37.317 34.336 31.779 29.559
N2O3 0.2632135E+02 0.4108698E+05 0.5903482E-03 0.2107237E+05-0.8058772E+01
N2O4 4 -4.000 1 4.000 2 1.00037
N2O4 177.293 142.813 113.630 94.469 80.889 70.741 62.858 56.549 JA85
N2O4 51.380 47.063 43.401 40.254 37.519
N2O4 0.4229845E+02 0.4925811E+05 0.8179612E-03 0.3003835E+05-0.1244718E+02
N2O5 4 -5.000 1 5.000 2 1.00037
N2O5 220.876 177.837 141.519 117.746 100.944 88.423 78.719 70.972 JA85
N2O5 64.639 59.362 54.896 51.066 47.743
N2O5 0.4143415E+02 0.6177573E+05 0.9404123E-03 0.7993357E+05-0.1169341E+02
N3 2 1.50037
N3 75.751 61.127 48.760 40.650 34.908 30.623 27.297 24.638 JA85
N3 22.461 20.644 19.104 17.781 16.631
N3 0.1493983E+02 0.2112633E+05 0.1927541E-03-0.2822164E+03-0.4082220E+01
Na 4 0.500 1-1.000 5 1.000 8
Na 32.037 25.112 19.279 15.471 12.789 10.797 9.257 8.032 JA85
Na 7.034 6.203 5.502 4.902 4.383
Na -0.1412450E+01 0.1027789E+05-0.8870965E-05-0.9868197E+04-0.3673994E+00
NaAlF4 5 -1.000 5 1.000 6 1.000 8 1.00013
NaAlF4 -39.411 -29.957 -22.071 -16.980 -13.431 -10.823 -8.829 -7.259 JA85
NaAlF4 -5.991 -4.949 -4.077 -3.339 -2.706
NaAlF4 0.1628180E+02-0.1446345E+05 0.7620326E-04 0.4093146E+04-0.2930307E+01
NaBr 4 -1.000 5 1.000 7 1.000 8
NaBr -3.200 -2.546 -1.983 -1.606 -1.335 -1.129 -0.968 -0.837 JA85
NaBr -0.728 -0.636 -0.557 -0.489 -0.429
NaBr -0.1529432E+01-0.9186655E+03-0.1902173E-04 0.4396816E+04 0.5524047E+00
(NaBr)2 4 -2.000 5 2.000 7 2.000 8
(NaBr)2 -34.202 -25.913 -18.939 -14.393 -11.195 -8.821 -6.990 -5.534 JA85
(NaBr)2 -4.349 -3.365 -2.535 -1.826 -1.213
(NaBr)2 0.6286757E+01-0.1229661E+05-0.2832508E-04 0.6260893E+04 0.2797597E+00
(NaCl)2 2 2.000 8
(NaCl)2 -28.602 -21.453 -15.463 -11.576 -8.853 -6.842 -5.296 -4.072 JA85
(NaCl)2 -3.079 -2.258 -1.569 -0.981 -0.475
(NaCl)2 0.9878225E+01-0.1076594E+05 0.4226163E-04 0.3961996E+04-0.9813439E+00
NaF 4 -1.000 5 1.000 6 1.000 8
NaF 12.558 10.005 7.822 6.373 5.338 4.558 3.947 3.455 JA85
NaF 3.049 2.707 2.416 2.163 1.943
NaF 0.4196644E+01 0.3643772E+04 0.4841916E-04-0.1162230E+05-0.1512918E+01
(NaF)2 4 -2.000 5 2.000 6 2.000 8
(NaF)2 -13.677 -9.440 -5.968 -3.774 -2.276 -1.197 -0.390 0.233 JA85
(NaF)2 0.725 1.121 1.445 1.713 1.938
(NaF)2 0.1977925E+02-0.6838742E+04 0.1577280E-03-0.6991749E+04-0.4238322E+01
NaH 4 1.000 1-1.000 5 1.000 8
NaH 36.609 29.063 22.661 18.449 15.461 13.225 11.486 10.094 JA85
NaH 8.951 7.996 7.185 6.487 5.879
NaH 0.6062056E+01 0.1096323E+05 0.7414431E-04-0.1887693E+05-0.2438412E+01
NaO 5 -0.500 1 1.000 2-1.000 5 1.000 8
NaO 69.355 54.755 42.486 34.496 28.877 24.711 21.499 18.946 JA85
NaO 16.868 15.145 13.692 12.450 11.378
NaO -0.2142677E+01 0.2158090E+05 0.6206868E-04 0.4558282E+04-0.3858833E+00
NaOH 4 1.000 2-1.000 5 1.000 8
NaOH 23.499 18.813 14.880 12.320 10.520 9.185 8.156 7.337 JA85
NaOH 6.671 6.118 5.651 5.252 4.907
NaOH 0.8868857E+00 0.6856859E+04 0.9591880E-05 0.1080909E+05-0.2062744E+00
(NaOH)2 4 2.000 2-2.000 5 2.000 8
(NaOH)2 17.664 15.666 13.817 12.489 11.472 10.658 9.985 9.416 JA85
(NaOH)2 8.925 8.495 8.115 7.774 7.467
(NaOH)2 0.3086572E+02 0.1963487E+04 0.3118158E-03-0.1890459E+05-0.7948321E+01
Na2 4 1.000 1-2.000 5 2.000 8
Na2 55.393 44.046 34.382 28.002 23.462 20.058 17.406 15.279 JA85
Na2 13.531 12.069 10.827 9.757 8.826
Na2 0.1323091E+02 0.1644241E+05 0.3254185E-03-0.5061548E+05-0.5057184E+01
Na2SO4 6 -4.000 1 1.000 4-2.000 5 2.000 8 4.000 2
Na2SO4 32.401 27.675 23.543 20.726 18.656 17.056 15.775 14.720 JA85
Na2SO4 13.832 13.074 12.416 11.840 11.330
Na2SO4 0.4136171E+02 0.5163896E+04 0.8499027E-03 0.5847222E+05-0.1098904E+02
Ni 4 1.000 1-2.000 5 1.00027
Ni 49.116 37.860 28.390 22.220 17.882 14.665 12.184 10.214 JA85
Ni 8.611 7.281 6.160 5.203 4.376
Ni -0.7638487E+01 0.1685665E+05-0.1233746E-04-0.2203348E+05 0.1893893E+00
Ni(CO)4 6 5.000 1-4.000 2 4.000 3-2.000 5 1.00027
Ni(CO)4 -4.999 -1.224 2.076 4.323 5.968 7.235 8.246 9.076 JA85
Ni(CO)4 9.770 10.362 10.873 11.318 11.711
Ni(CO)4 -0.1002032E+02-0.4359102E+04-0.7286890E-03-0.2412370E+05 0.8135383E+01
NiCl 4 0.500 1-1.000 5 1.00027
NiCl 24.529 18.773 13.949 10.820 8.629 7.012 5.770 4.787 JA85
NiCl 3.990 3.332 2.780 2.309 1.904
NiCl -0.7448503E+01 0.8764611E+04-0.6494336E-04-0.1213596E+05 0.1106023E+01
NiS 4 1.000 4-2.000 5 1.00027
NiS 40.197 30.785 22.863 17.698 14.065 11.370 9.292 7.642 JA85
NiS 6.301 5.189 4.253 3.455 2.767
NiS -0.4612483E+01 0.1393149E+05 0.2308861E-03-0.8956892E+04-0.7618032E+00
O 3 -1.000 1 1.000 2
O 80.639 63.352 48.832 39.378 32.734 27.809 24.012 20.995 JA85
O 18.542 16.507 14.792 13.327 12.062
O -0.4194221E+01 0.2553179E+05 0.9394030E-04 0.1092185E+05-0.3846471E+00
O3 3 -3.000 1 3.000 2
O3 148.709 118.120 92.369 75.562 63.719 54.919 48.119 42.705 JA85
O3 38.292 34.624 31.527 28.878 26.585
O3 0.8725038E+01 0.4464584E+05 0.4252886E-03 0.2977685E+05-0.4130537E+01
Pb 4 1.000 1-2.000 5 1.00016
Pb 27.057 20.564 15.127 11.603 9.135 7.313 5.913 4.805 JA85
Pb 3.905 3.161 2.535 2.000 1.539
Pb -0.1009897E+02 0.9917079E+04-0.2236302E-03-0.1179308E+05 0.1654216E+01
PbBr 5 0.500 1-2.000 5 1.000 7 1.00016
PbBr 13.563 10.161 7.318 5.479 4.194 3.249 2.524 1.951 JA85
PbBr 1.488 1.105 0.785 0.512 0.277
PbBr -0.6620844E+01 0.5233600E+04-0.1030752E-03-0.6453126E+04 0.1104730E+01
PbBr2 4 -2.000 5 2.000 7 1.00016
PbBr2 -7.297 -5.802 -4.519 -3.665 -3.052 -2.589 -2.224 -1.930 JA85
PbBr2 -1.686 -1.481 -1.305 -1.153 -1.019
PbBr2 -0.3434481E+01-0.2068023E+04-0.6089351E-04 0.3575813E+04 0.1233235E+01
PbBr4 $5 -1.000 1-2.000 5 4.000 7 1.00016
PbBr4 -46.795 -35.461 -25.894 -19.638 -15.224 -11.941 -9.402 -7.379 JA85
PbBr4 -5.729 -4.356 -3.197 -2.203 -1.343
PbBr4 0.6537360E+01-0.1684262E+05-0.4926283E-04 0.3134799E+05 0.1139698E+01
PbCl 4 0.500 1-1.000 5 1.00016
PbCl 13.619 10.210 7.348 5.487 4.181 3.215 2.471 1.881 JA85
PbCl 1.401 1.003 0.669 0.383 0.135
PbCl -0.5040916E+01 0.5188442E+04-0.8666164E-04-0.9924055E+04 0.5638652E+00
PbCl4 $4 -1.000 1 2.000 5 1.00016
PbCl4 -20.757 -14.711 -9.641 -6.351 -4.047 -2.347 -1.043 -0.011 JA85
PbCl4 0.825 1.515 2.094 2.587 3.011
PbCl4 0.1367317E+02-0.9317142E+04 0.8327227E-04 0.2556806E+05-0.1411514E+01
PbF 5 0.500 1-2.000 5 1.000 6 1.00016
PbF 28.447 22.002 16.552 12.981 10.455 8.571 7.112 5.946 JA85
PbF 4.992 4.196 3.523 2.944 2.441
PbF -0.5307720E+00 0.9499433E+04-0.9355214E-05-0.1619378E+05-0.1090569E+01
PbF2 4 -2.000 5 2.000 6 1.00016
PbF2 17.588 13.997 10.903 8.836 7.347 6.218 5.329 4.608 JA85
PbF2 4.010 3.505 3.072 2.695 2.364
PbF2 0.8899333E+01 0.4991381E+04 0.1186697E-03-0.1846098E+05-0.3184640E+01
PbF4 $5 -1.000 1-2.000 5 4.000 6 1.00016
PbF4 0.203 1.911 3.183 3.890 4.306 4.555 4.702 4.785 JA85
PbF4 4.826 4.837 4.829 4.806 4.774
PbF4 0.3191812E+02-0.3587375E+04 0.3261040E-03-0.9846840E+04-0.7949094E+01
PbH 4 1.500 1-2.000 5 1.00016
PbH 35.280 27.298 20.521 16.061 12.896 10.529 8.688 7.214 JA85
PbH 6.004 4.993 4.133 3.394 2.750
PbH 0.1470657E+01 0.1175892E+05-0.1116730E-04-0.3716769E+05-0.2105072E+01
PbO 4 1.000 2-2.000 5 1.00016
PbO 47.194 36.567 27.619 21.782 17.670 14.617 12.259 10.383 JA85
PbO 8.853 7.583 6.511 5.594 4.800
PbO -0.3585212E+01 0.1570206E+05 0.4611592E-04-0.6496125E+04-0.7381062E+00
PbS 4 1.000 4-2.000 5 1.00016
PbS 19.455 14.478 10.311 7.610 5.720 4.326 3.256 2.411 JA85
PbS 1.727 1.163 0.691 0.290 -0.054
PbS -0.6708370E+01 0.7447991E+04 0.1037312E-03 0.2082905E+04 0.4560077E+00
Pb2 4 2.000 1-4.000 5 2.00016
Pb2 47.619 36.629 27.362 21.310 17.044 13.875 11.425 9.475 JA85
Pb2 7.884 6.561 5.443 4.485 3.654
Pb2 -0.7448388E+01 0.1653126E+05-0.1755313E-03-0.3998523E+05 0.4985758E-01
Rb 4 0.500 1-1.000 5 1.00033
Rb 35.906 28.240 21.786 17.576 14.611 12.409 10.709 9.356 JA85
Rb 8.253 7.337 6.563 5.901 5.328
Rb -0.1326946E+01 0.1136921E+05-0.1691770E-04-0.7712173E+04-0.3264503E+00
Rb2 4 1.000 1-2.000 5 2.00033
Rb2 66.923 53.317 41.887 34.449 29.224 25.354 22.374 20.009 JA85
Rb2 18.088 16.497 15.159 14.018 13.034
Rb2 -0.2897461E+00 0.2018543E+05 0.2055598E-03-0.1724593E+04-0.2147519E+00
S 3 -1.000 1 1.000 4
S 47.237 36.792 28.061 22.407 18.453 15.537 13.300 11.532 JA85
S 10.101 8.920 7.930 7.089 6.366
S -0.8367484E+01 0.1556873E+05 0.9499902E-04 0.1970280E+05 0.1267647E+01
SCl 4 -1.500 1 1.000 4 1.000 5
SCl 45.014 35.568 27.684 22.588 19.028 16.407 14.398 12.813 JA85
SCl 11.532 10.476 9.593 8.844 8.201
SCl -0.5260686E+01 0.1400704E+05 0.1645683E-03 0.3189879E+05 0.1166726E+01
SCl2 4 -2.000 1 1.000 4 2.000 5
SCl2 34.731 28.159 22.680 19.139 16.666 14.844 13.448 12.347 JA85
SCl2 11.456 10.723 10.110 9.590 9.144
SCl2 0.1600685E+01 0.9554568E+04 0.2301668E-03 0.4170433E+05 0.2207896E+00
SF 4 -1.500 1 1.000 4 1.000 6
SF 51.528 40.736 31.672 25.772 21.626 18.554 16.186 14.306 JA85
SF 12.778 11.512 10.446 9.537 8.753
SF -0.1146913E+00 0.1584282E+05 0.2131098E-03 0.1477712E+05-0.6967765E+00
SF2 4 -2.000 1 1.000 4 2.000 6
SF2 49.137 39.595 31.522 26.223 22.469 19.666 17.490 15.749 JA85
SF2 14.325 13.137 12.131 11.268 10.519
SF2 0.1302414E+02 0.1353762E+05 0.3995475E-03 0.1669087E+05-0.3879437E+01
SF3 4 -2.500 1 1.000 4 3.000 6
SF3 65.037 53.122 43.017 36.365 31.639 28.099 25.343 23.133 JA85
SF3 21.319 19.802 18.514 17.405 16.440
SF3 0.2369957E+02 0.1670086E+05 0.4900198E-03 0.2423492E+05-0.6100905E+01
SF4 4 -3.000 1 1.000 4 4.000 6
SF4 72.306 59.895 49.311 42.299 37.287 33.511 30.554 28.171 JA85
SF4 26.205 24.553 23.143 21.924 20.859
SF4 0.3870746E+02 0.1691239E+05 0.6554694E-03 0.3110829E+05-0.9566357E+01
SF5 4 -3.500 1 1.000 4 5.000 6
SF5 100.131 83.195 68.765 59.216 52.396 47.261 43.243 40.006 JA85
SF5 37.336 35.092 33.177 31.523 30.077
SF5 0.5156741E+02 0.2319752E+05 0.7321320E-03 0.4276128E+05-0.1209996E+02
SF6 4 -4.000 1 1.000 4 6.000 6
SF6 99.702 84.080 70.656 61.688 55.225 50.320 46.452 43.313 JA85
SF6 40.706 38.501 36.608 34.963 33.518
SF6 0.7229493E+02 0.2056412E+05 0.9605567E-03 0.4050595E+05-0.1709782E+02
SO 4 -2.000 1 1.000 2 1.000 4
SO 42.160 32.765 24.888 19.769 16.177 13.519 11.474 9.853 JA85
SO 8.537 7.448 6.534 5.755 5.084
SO -0.3365093E+01 0.1377043E+05 0.2380132E-03 0.2234224E+05-0.3974587E+00
SOF2 5 -3.000 1 1.000 2 1.000 4 2.000 6
SOF2 50.095 40.724 32.749 27.478 23.719 20.893 18.686 16.911 JA85
SOF2 15.450 14.225 13.182 12.283 11.499
SOF2 0.2292999E+02 0.1284990E+05 0.5555996E-03 0.2570571E+05-0.6623186E+01
SO2 4 -3.000 1 2.000 2 1.000 4
SO2 33.309 26.000 19.822 15.769 12.900 10.758 9.096 7.769 RH95
SO2 6.684 5.781 5.017 4.363 3.797
SO2 0.7552068E+01 0.1019762E+05 0.5043127E-03 0.2965434E+05-0.3608909E+01
SO2ClF 6 -4.000 1 2.000 2 1.000 4 1.000 5 1.000 6
SO2ClF 61.031 49.959 40.546 34.330 29.899 26.570 23.971 21.881 JA85
SO2ClF 20.161 18.719 17.492 16.434 15.513
SO2ClF 0.2901956E+02 0.1510348E+05 0.6662374E-03 0.4392775E+05-0.7815393E+01
SO2Cl2 5 -4.000 1 2.000 2 1.000 4 2.000 5
SO2Cl2 64.907 53.134 43.187 36.660 32.037 28.583 25.901 23.755 JA85
SO2Cl2 21.998 20.532 19.290 18.224 17.299
SO2Cl2 0.2290479E+02 0.1638114E+05 0.5845099E-03 0.5699935E+05-0.5559217E+01
SO2F2 5 -4.000 1 2.000 2 1.000 4 2.000 6
SO2F2 57.655 47.295 38.422 32.515 28.275 25.067 22.547 20.508 JA85
SO2F2 18.822 17.401 16.185 15.132 14.211
SO2F2 0.3650001E+02 0.1377035E+05 0.7748851E-03 0.3104472E+05-0.1035036E+02
SO3 4 -4.000 1 3.000 2 1.000 4
SO3 60.928 48.564 38.089 31.200 26.309 22.650 19.804 17.525 RH95
SO3 15.656 14.095 12.772 11.635 10.648
SO3 0.1883269E+02 0.1722902E+05 0.6880377E-03 0.3874178E+05-0.6600347E+01
SSF2 4 -3.000 1 2.000 4 2.000 6
SSF2 36.426 29.869 24.324 20.681 18.096 16.163 14.660 13.458 JA85
SSF2 12.473 11.652 10.956 10.360 9.844
SSF2 0.1674378E+02 0.8863286E+04 0.5818950E-03 0.4945070E+05-0.4354613E+01
S2 3 -2.000 1 2.000 4
S2 25.409 19.486 14.573 11.416 9.225 7.621 6.401 5.443 HP11
S2 4.675 4.047 3.526 3.087 2.714
S2 -0.7713311E+01 0.8772990E+04 0.2397236E-03 0.3755891E+05 0.1294648E+01
S2Cl 4 -2.500 1 2.000 4 1.000 5
S2Cl 36.004 28.593 22.430 18.458 15.693 13.663 12.113 10.894 JA85
S2Cl 9.912 9.107 8.436 7.871 7.388
S2Cl -0.2955130E+01 0.1084808E+05 0.3337667E-03 0.4886487E+05 0.7780699E+00
S2F10 4 -7.000 1 2.000 410.000 6
S2F10 168.006 142.780 121.047 106.485 95.963 87.955 81.625 76.475 JA85
S2F10 72.189 68.558 65.435 62.716 60.323
S2F10 0.1341386E+03 0.3262366E+05 0.1756899E-02 0.8185159E+05-0.3111719E+02
S3 3 -3.000 1 3.000 4
S3 33.139 26.070 20.236 16.508 13.933 12.057 10.636 9.527 JA85
S3 8.641 7.921 7.325 6.828 6.407
S3 -0.8359848E+01 0.1045616E+05 0.3159365E-03 0.6505700E+05 0.2264231E+01
S4 3 -4.000 1 4.000 4
S4 39.223 31.302 24.774 20.606 17.730 15.635 14.050 12.813 JA85
S4 11.827 11.025 10.364 9.812 9.347
S4 -0.5681908E+01 0.1153125E+05 0.4912762E-03 0.9399924E+05 0.2030776E+01
S5 3 -5.000 1 5.000 4
S5 40.429 33.086 27.063 23.234 20.602 18.694 17.255 16.139 JA85
S5 15.253 14.537 13.951 13.466 13.060
S5 -0.2708432E+00 0.1046932E+05 0.7078845E-03 0.1219480E+06 0.1617616E+01
S6 3 -6.000 1 6.000 4
S6 44.229 36.445 30.070 26.024 23.246 21.235 19.721 18.548 JA85
S6 17.619 16.870 16.259 15.754 15.333
S6 0.1721936E+01 0.1099404E+05 0.8636880E-03 0.1439311E+06 0.1518023E+01
S7 3 -7.000 1 7.000 4
S7 50.967 42.066 34.773 30.142 26.961 24.655 22.919 21.572 JA85
S7 20.505 19.644 18.940 18.357 17.871
S7 0.2560972E+01 0.1256375E+05 0.9534404E-03 0.1637561E+06 0.1673347E+01
S8 3 -8.000 1 8.000 4
S8 54.939 45.781 38.253 33.455 30.146 27.739 25.921 24.506 JA85
S8 23.382 22.472 21.726 21.107 20.591
S8 0.1037419E+02 0.1265254E+05 0.1233961E-02 0.1752620E+06-0.8548164E-01
Si 4 2.000 1-4.000 6 1.00021
Si 153.578 119.477 91.064 72.741 59.982 50.609 43.447 37.807 JA85
Si 33.257 29.514 26.385 23.733 21.459
Si -0.5109397E+02 0.5220673E+05-0.5868353E-03 0.7629837E+04 0.1198613E+02
SiBr 5 1.500 1-4.000 6 1.000 7 1.00021
SiBr 125.169 97.364 74.276 59.443 49.153 41.621 35.886 31.386 JA85
SiBr 27.769 24.804 22.333 20.247 18.465
SiBr -0.5142637E+02 0.4293820E+05-0.5933193E-03 0.2322112E+05 0.1313255E+02
SiBr2 5 1.000 1-4.000 6 2.000 7 1.00021
SiBr2 85.110 66.152 50.502 40.513 33.627 28.618 24.829 21.874 JA85
SiBr2 19.514 17.592 16.000 14.665 13.532
SiBr2 -0.4624091E+02 0.2967642E+05-0.5297977E-03 0.3804984E+05 0.1274861E+02
SiBr3 5 0.500 1-4.000 6 3.000 7 1.00021
SiBr3 69.855 54.880 42.584 34.780 29.431 25.561 22.649 20.390 JA85
SiBr3 18.596 17.143 15.947 14.950 14.108
SiBr3 -0.4020060E+02 0.2357928E+05-0.4760721E-03 0.5967817E+05 0.1230218E+02
SiBr4 4 -4.000 6 4.000 7 1.00021
SiBr4 44.312 35.586 28.547 24.169 21.227 19.142 17.606 16.441 JA85
SiBr4 15.536 14.820 14.246 13.778 13.394
SiBr4 -0.3450223E+02 0.1424147E+05-0.5017336E-03 0.7006988E+05 0.1228942E+02
SiC 6 4.000 1-2.000 2 1.000 3-4.000 6 1.00021
SiC 187.771 147.494 114.172 92.845 78.099 67.340 59.174 52.784 JA85
SiC 47.662 43.474 39.995 37.064 34.565
SiC -0.8013621E+02 0.6242605E+05-0.1197955E-02 0.9378144E+05 0.2337155E+02
SiCH3Cl3 7 4.000 1-2.000 2 1.000 3 3.000 5-4.000 6 1.00021
SiCH3Cl3 49.870 41.530 34.615 30.181 27.109 24.863 23.155 21.814 JA85
SiCH3Cl3 20.735 19.850 19.112 18.486 17.950
SiCH3Cl3-0.7667163E+01 0.1314735E+05-0.5549668E-03-0.6362086E+04 0.5527638E+01
SiCH3F3 6 4.000 1-2.000 2 1.000 3-1.000 6 1.00021
SiCH3F3 21.562 18.800 16.405 14.796 13.633 12.748 12.049 11.478 JA85
SiCH3F3 11.003 10.598 10.248 9.941 9.669
SiCH3F3 0.1139830E+02 0.4194121E+04-0.2864946E-03-0.5267111E+05-0.1303564E+01
SiC2 6 6.000 1-4.000 2 2.000 3-4.000 6 1.00021
SiC2 157.515 123.982 96.120 78.215 65.789 56.692 49.765 44.327 JA85
SiC2 39.954 36.368 33.379 30.853 28.692
SiC2 -0.5895732E+02 0.5217095E+05-0.1001339E-02-0.1463628E+05 0.1695472E+02
Si(CH3)4 6 16.000 1-8.000 2 4.000 3-4.000 6 1.00021
Si(CH3)4 12.625 16.861 20.097 21.992 23.186 23.972 24.503 24.863 JA85
Si(CH3)4 25.106 25.264 25.359 25.408 25.421
Si(CH3)4 0.5059347E+02-0.5987134E+04-0.1117321E-02-0.2161717E+06-0.6111536E+01
SiCl 5 1.500 1 1.000 5-4.000 6 1.00021
SiCl 128.358 99.872 76.181 60.934 50.337 42.568 36.643 31.986 JA85
SiCl 28.237 25.158 22.590 20.417 18.558
SiCl -0.4756045E+02 0.4378969E+05-0.5121684E-03 0.1717706E+05 0.1172250E+02
ClSiF3 4 1.000 5-1.000 6 1.00021
ClSiF3 19.651 15.605 12.279 10.164 8.711 7.657 6.862 6.243 JA85
ClSiF3 5.751 5.350 5.020 4.744 4.509
ClSiF3 -0.8814703E+01 0.6276200E+04-0.1115796E-03 0.2216124E+05 0.2909425E+01
SiCl2 5 1.000 1 2.000 5-4.000 6 1.00021
SiCl2 84.323 65.511 49.953 40.002 33.128 28.118 24.319 21.352 JA85
SiCl2 18.976 17.037 15.429 14.077 12.927
SiCl2 -0.4202327E+02 0.2927446E+05-0.4476882E-03 0.3501178E+05 0.1127485E+02
SiCl3 5 0.500 1 3.000 5-4.000 6 1.00021
SiCl3 66.069 51.813 40.073 32.598 27.457 23.726 20.909 18.717 JA85
SiCl3 16.970 15.551 14.378 13.396 12.564
SiCl3 -0.3510329E+02 0.2234184E+05-0.4335460E-03 0.4443063E+05 0.1045362E+02
SiCl4 4 4.000 5-4.000 6 1.00021
SiCl4 40.205 32.285 25.857 21.831 19.104 17.156 15.709 14.602 JA85
SiCl4 13.733 13.040 12.477 12.015 11.630
SiCl4 -0.2569714E+02 0.1266656E+05-0.3546875E-03 0.6227987E+05 0.9223684E+01
SiF 4 1.500 1-3.000 6 1.00021
SiF 121.749 94.553 71.894 57.283 47.109 39.637 33.929 29.434 JA85
SiF 25.809 22.828 20.336 18.225 16.415
SiF -0.4187718E+02 0.4168002E+05-0.4467823E-03 0.1855582E+04 0.9676148E+01
FSiCl3 4 3.000 5-3.000 6 1.00021
FSiCl3 39.736 31.696 25.124 20.973 18.140 16.100 14.572 13.391 JA85
FSiCl3 12.458 11.706 11.090 10.578 10.148
FSiCl3 -0.2220399E+02 0.1271811E+05-0.3054988E-03 0.4574210E+05 0.7621834E+01
SiF2 4 1.000 1-2.000 6 1.00021
SiF2 74.216 57.367 43.353 34.335 28.068 23.475 19.973 17.220 JA85
SiF2 15.005 13.187 11.671 10.389 9.292
SiF2 -0.3019967E+02 0.2594646E+05-0.2855935E-03 0.5495274E+04 0.7037649E+01
SiF3 4 0.500 1-1.000 6 1.00021
SiF3 39.259 30.271 22.795 17.983 14.639 12.188 10.318 8.849 JA85
SiF3 7.666 6.695 5.885 5.200 4.613
SiF3 -0.1663628E+02 0.1385908E+05-0.1789000E-03 0.9795257E+03 0.3820665E+01
SiH 4 2.500 1-4.000 6 1.00021
SiH 142.573 111.024 84.697 67.693 55.834 47.111 40.437 35.174 JA85
SiH 30.923 27.422 24.491 22.004 19.870
SiH -0.4287342E+02 0.4821647E+05-0.4815718E-03-0.1131755E+05 0.9698584E+01
SiHBr3 5 1.000 1-4.000 6 3.000 7 1.00021
SiHBr3 55.729 44.278 34.859 28.870 24.755 21.772 19.521 17.771 JA85
SiHBr3 16.377 15.245 14.310 13.528 12.866
SiHBr3 -0.2650444E+02 0.1793890E+05-0.3994991E-03 0.4478082E+05 0.8762204E+01
SiHCl3 5 1.000 1 3.000 5-4.000 6 1.00021
SiHCl3 51.171 40.598 31.866 26.287 22.435 19.628 17.501 15.839 JA85
SiHCl3 14.509 13.423 12.522 11.765 11.120
SiHCl3 -0.1946757E+02 0.1632269E+05-0.2644940E-03 0.3956759E+05 0.6274447E+01
SiHF3 4 1.000 1-1.000 6 1.00021
SiHF3 22.708 17.739 13.546 10.804 8.869 7.429 6.315 5.426 JA85
SiHF3 4.701 4.097 3.586 3.148 2.768
SiHF3 -0.6353366E+00 0.7358339E+04-0.1851661E-04-0.1004497E+05-0.4922895E+00
SiH2Br2 5 2.000 1-4.000 6 2.000 7 1.00021
SiH2Br2 67.495 53.316 41.513 33.908 28.616 24.729 21.761 19.424 JA85
SiH2Br2 17.539 15.988 14.691 13.593 12.650
SiH2Br2 -0.1844220E+02 0.2168606E+05-0.3184282E-03 0.1324222E+05 0.5313455E+01
SiH2Cl2 5 2.000 1 2.000 5-4.000 6 1.00021
SiH2Cl2 64.259 50.709 39.397 32.086 26.982 23.223 20.343 18.070 JA85
SiH2Cl2 16.231 14.714 13.442 12.362 11.432
SiH2Cl2 -0.1367268E+02 0.2055722E+05-0.2338027E-03 0.6858031E+04 0.3627096E+01
SiH2F2 4 2.000 1-2.000 6 1.00021
SiH2F2 45.202 35.404 27.128 21.710 17.883 15.034 12.827 11.066 JA85
SiH2F2 9.627 8.429 7.414 6.544 5.788
SiH2F2 -0.3485250E+00 0.1452256E+05-0.4265586E-04-0.2647420E+05-0.1150923E+01
SiH3Br 5 3.000 1-4.000 6 1.000 7 1.00021
SiH3Br 79.689 62.793 48.611 39.389 32.917 28.126 24.437 21.510 JA85
SiH3Br 19.131 17.160 15.499 14.082 12.858
SiH3Br -0.9203467E+01 0.2539575E+05-0.1951237E-03-0.2000627E+05 0.1615682E+01
SiH3Cl 5 3.000 1 1.000 5-4.000 6 1.00021
SiH3Cl 78.330 61.696 47.713 38.607 32.206 27.460 23.802 20.895 JA85
SiH3Cl 18.530 16.567 14.912 13.498 12.275
SiH3Cl -0.6464490E+01 0.2489313E+05-0.1371301E-03-0.2320764E+05 0.6484079E+00
SiH3F 4 3.000 1-3.000 6 1.00021
SiH3F 68.878 54.104 41.620 33.447 27.673 23.373 20.043 17.386 JA85
SiH3F 15.214 13.405 11.874 10.560 9.420
SiH3F 0.9598915E-01 0.2193282E+05-0.6725787E-04-0.4521548E+05-0.1718494E+01
SiH4 4 4.000 1-4.000 6 1.00021
SiH4 92.491 72.859 56.274 45.417 37.749 32.040 27.620 24.094 JA85
SiH4 21.214 18.815 16.784 15.043 13.532
SiH4 0.3822511E+00 0.2919949E+05-0.9276215E-04-0.6387743E+05-0.2053276E+01
SiO 5 1.000 1 1.000 2-4.000 6 1.00021
SiO 100.270 77.019 57.686 45.248 36.608 30.276 25.450 21.659 JA85
SiO 18.608 16.105 14.019 12.255 10.746
SiO -0.4438430E+02 0.3582653E+05-0.3913941E-03 0.8656198E+04 0.9905629E+01
SiOF2 4 1.000 2-2.000 6 1.00021
SiOF2 52.511 40.452 30.403 23.921 19.405 16.087 13.550 11.552 JA85
SiOF2 9.940 8.615 7.506 6.567 5.762
SiOF2 -0.1795868E+02 0.1831522E+05-0.8454894E-04 0.1395749E+05 0.3600153E+01
SiO2 4 2.000 2-4.000 6 1.00021
SiO2 108.842 84.279 63.806 50.597 41.394 34.630 29.459 25.386 JA85
SiO2 22.098 19.394 17.133 15.216 13.573
SiO2 -0.3521948E+02 0.3737386E+05-0.2315578E-03 0.2005933E+05 0.7497613E+01
SiS 5 1.000 1 1.000 4-4.000 6 1.00021
SiS 97.867 75.175 56.364 44.302 35.950 29.849 25.214 21.585 JA85
SiS 18.675 16.296 14.318 12.653 11.234
SiS -0.4924003E+02 0.3515476E+05-0.3708958E-03 0.2644956E+05 0.1172404E+02
Si2 4 4.000 1-8.000 6 2.00021
Si2 258.383 201.021 153.152 122.232 100.667 84.803 72.665 63.093 JA85
Si2 55.361 48.994 43.664 39.142 35.260
Si2 -0.7730733E+02 0.8756173E+05-0.7723799E-03-0.1338386E+05 0.1713026E+02
Si2C 6 6.000 1-2.000 2 1.000 3-8.000 6 2.00021
Si2C 237.507 185.313 141.942 114.063 94.711 80.540 69.745 61.271 JA85
Si2C 54.455 48.865 44.205 40.267 36.900
Si2C -0.9500541E+02 0.8086889E+05-0.1301206E-02 0.2035577E+04 0.2491153E+02
Si3 4 6.000 1-12.00 6 3.00021
Si3 347.971 270.801 206.654 165.398 136.744 115.749 99.749 87.180 JA85
Si3 77.066 68.768 61.847 55.996 50.990
Si3 -0.1362164E+03 0.1190693E+06-0.1654300E-02 0.3053338E+05 0.3434184E+02
Sr 4 1.000 1-2.000 5 1.00030
Sr 74.517 58.568 45.148 36.399 30.242 25.673 22.146 19.342 JA85
Sr 17.057 15.161 13.560 12.191 11.006
Sr -0.4316617E+01 0.2373248E+05-0.6041072E-04-0.1856925E+05-0.2176735E+00
SrBr 5 0.500 1-2.000 5 1.000 7 1.00030
SrBr 38.345 30.041 23.071 18.541 15.361 13.008 11.196 9.759 JA85
SrBr 8.591 7.623 6.808 6.113 5.512
SrBr -0.5382731E+01 0.1247827E+05-0.9119686E-04-0.8787781E+04 0.8088689E+00
SrBr2 4 -2.000 5 2.000 7 1.00030
SrBr2 -7.131 -5.515 -4.142 -3.237 -2.594 -2.112 -1.738 -1.438 JA85
SrBr2 -1.192 -0.986 -0.811 -0.661 -0.531
SrBr2 -0.1090770E+01-0.2327275E+04-0.5681562E-04 0.4213807E+04 0.7011953E+00
SrCl 4 0.500 1-1.000 5 1.00030
SrCl 42.031 32.976 25.362 20.402 16.914 14.328 12.333 10.748 JA85
SrCl 9.458 8.387 7.484 6.712 6.044
SrCl -0.3873533E+01 0.1354252E+05-0.7244946E-04-0.1333000E+05 0.2643902E+00
SrF 5 0.500 1-2.000 5 1.000 6 1.00030
SrF 43.794 34.357 26.386 21.167 17.480 14.734 12.607 10.909 JA85
SrF 9.522 8.367 7.388 6.549 5.821
SrF 0.9301075E+00 0.1390181E+05 0.1752819E-04-0.1814965E+05-0.1440369E+01
SrF2 4 -2.000 5 2.000 6 1.00030
SrF2 12.024 9.553 7.406 5.957 4.905 4.101 3.464 2.944 JA85
SrF2 2.510 2.142 1.824 1.547 1.302
SrF2 0.8704531E+01 0.3322042E+04 0.1353198E-03-0.1514499E+05-0.3108893E+01
SrO 4 1.000 2-2.000 5 1.00030
SrO 85.420 67.260 52.087 42.268 35.403 30.341 26.456 23.383 JA85
SrO 20.894 18.837 17.110 15.640 14.373
SrO -0.1559180E+02 0.2729934E+05-0.2968231E-03 0.2448879E+05 0.3743254E+01
SrOH 5 0.500 1 1.000 2-2.000 5 1.00030
SrOH 54.315 42.873 33.255 26.988 22.579 19.308 16.783 14.775 JA85
SrOH 13.139 11.781 10.634 9.654 8.805
SrOH -0.1504740E+01 0.1688811E+05-0.2626124E-04 0.5118984E+04-0.3528124E+00
Sr(OH)2 4 2.000 2-2.000 5 1.00030
Sr(OH)2 31.695 25.488 20.276 16.879 14.486 12.708 11.333 10.238 JA85
Sr(OH)2 9.343 8.599 7.970 7.431 6.964
Sr(OH)2 0.4240656E+01 0.8855807E+04 0.5511998E-04 0.3370317E+05-0.1068423E+01
SrS 4 1.000 4-2.000 5 1.00030
SrS 68.120 53.531 41.463 33.738 28.393 24.491 21.526 19.204 JA85
SrS 17.339 15.813 14.542 13.469 12.553
SrS -0.2863349E+02 0.2252716E+05-0.5713966E-03 0.4463433E+05 0.8432333E+01
Ti 4 2.000 1-4.000 6 1.00024
Ti 147.628 114.919 87.651 70.055 57.795 48.784 41.894 36.465 JA85
Ti 32.082 28.475 25.456 22.897 20.700
Ti -0.4767641E+02 0.5006925E+05-0.6178238E-03-0.1207849E+04 0.1114157E+02
TiBr 5 1.500 1-4.000 6 1.000 7 1.00024
TiBr 111.062 86.245 65.567 52.232 42.944 36.120 30.905 26.797 JA85
TiBr 23.482 20.755 18.475 16.541 14.883
TiBr -0.3714345E+02 0.3791984E+05-0.4198937E-03 0.1233209E+05 0.8490084E+01
TiBr2 5 1.000 1-4.000 6 2.000 7 1.00024
TiBr2 53.272 40.996 30.923 24.538 20.166 17.008 14.635 12.797 JA85
TiBr2 11.339 10.160 9.190 8.382 7.701
TiBr2 -0.4024287E+02 0.1957077E+05-0.5284145E-03 0.3258746E+05 0.1118038E+02
TiBr3 5 0.500 1-4.000 6 3.000 7 1.00024
TiBr3 29.686 23.025 17.671 14.357 12.141 10.578 9.433 8.570 JA85
TiBr3 7.904 7.380 6.963 6.626 6.352
TiBr3 -0.3339900E+02 0.1100479E+05-0.4338632E-03 0.5448676E+05 0.1038264E+02
TiBr4 4 -4.000 6 4.000 7 1.00024
TiBr4 10.257 8.485 7.236 6.591 6.250 6.076 6.001 5.987 JA85
TiBr4 6.011 6.060 6.125 6.200 6.282
TiBr4 -0.2777813E+02 0.3711663E+04-0.4043674E-03 0.5583804E+05 0.1013507E+02
TiCl 5 1.500 1 1.000 5-4.000 6 1.00024
TiCl 110.621 85.877 65.248 51.934 42.654 35.832 30.615 26.502 JA85
TiCl 23.182 20.449 18.161 16.222 14.557
TiCl -0.3500905E+02 0.3770447E+05-0.3585292E-03 0.1293666E+05 0.7731047E+01
TiCl2 5 1.000 1 2.000 5-4.000 6 1.00024
TiCl2 63.011 48.835 37.139 29.678 24.537 20.799 17.973 15.769 JA85
TiCl2 14.009 12.576 11.389 10.394 9.549
TiCl2 -0.3630281E+02 0.2223092E+05-0.4715680E-03 0.2979036E+05 0.9924048E+01
TiCl3 5 0.500 1 3.000 5-4.000 6 1.00024
TiCl3 30.595 23.798 18.281 14.824 12.483 10.810 9.568 8.616 JA85
TiCl3 7.871 7.275 6.791 6.394 6.064
TiCl3 -0.2589309E+02 0.1087213E+05-0.2994777E-03 0.5259964E+05 0.7888806E+01
TiCl4 4 4.000 5-4.000 6 1.00024
TiCl4 11.916 9.744 8.100 7.155 6.575 6.204 5.961 5.803 JA85
TiCl4 5.700 5.636 5.600 5.584 5.583
TiCl4 -0.2023405E+02 0.3977219E+04-0.2810799E-03 0.4740483E+05 0.7420252E+01
TiF 4 1.500 1-3.000 6 1.00024
TiF 103.490 80.147 60.655 48.053 39.256 32.779 27.818 23.902 JA85
TiF 20.735 18.125 15.937 14.079 12.483
TiF -0.3075521E+02 0.3548577E+05-0.3141837E-03 0.1436495E+03 0.6190263E+01
TiF2 4 1.000 1-2.000 6 1.00024
TiF2 47.224 36.145 26.973 21.102 17.042 14.080 11.833 10.075 JA85
TiF2 8.666 7.514 6.558 5.752 5.066
TiF2 -0.2748667E+02 0.1730580E+05-0.3584099E-03 0.1031938E+05 0.6731858E+01
TiF3 4 0.500 1-1.000 6 1.00024
TiF3 11.234 8.114 5.551 3.924 2.807 1.998 1.389 0.916 JA85
TiF3 0.540 0.235 -0.017 -0.227 -0.405
TiF3 -0.1152251E+02 0.4898737E+04-0.1132215E-03 0.1319393E+05 0.2510218E+01
TiO 5 1.000 1 1.000 2-4.000 6 1.00024
TiO 116.801 90.313 68.218 53.950 44.001 36.684 31.087 26.674 JA85
TiO 23.111 20.177 17.722 15.639 13.852
TiO -0.3790894E+02 0.4035835E+05-0.3069725E-03 0.5157869E+04 0.7832393E+01
TiOCl 6 0.500 1 1.000 2 1.000 5-4.000 6 1.00024
TiOCl 85.423 66.205 50.220 39.930 32.777 27.530 23.527 20.380 JA85
TiOCl 17.845 15.764 14.027 12.557 11.299
TiOCl -0.3159118E+02 0.2940496E+05-0.2747859E-03 0.2267875E+05 0.7361803E+01
TiOCl2 5 1.000 2 2.000 5-4.000 6 1.00024
TiOCl2 52.165 40.311 30.522 24.270 19.956 16.817 14.440 12.585 JA85
TiOCl2 11.103 9.895 8.895 8.056 7.343
TiOCl2 -0.2779071E+02 0.1839746E+05-0.2184712E-03 0.3469500E+05 0.7244132E+01
TiOF 5 0.500 1 1.000 2-3.000 6 1.00024
TiOF 84.023 65.062 49.249 39.039 31.920 26.685 22.680 19.522 JA85
TiOF 16.973 14.873 13.116 11.627 10.348
TiOF -0.2605242E+02 0.2880551E+05-0.1842995E-03 0.1346179E+05 0.5401135E+01
TiOF2 4 1.000 2-2.000 6 1.00024
TiOF2 49.656 38.369 28.972 22.914 18.696 15.598 13.232 11.368 JA85
TiOF2 9.866 8.630 7.598 6.724 5.974
TiOF2 -0.1656366E+02 0.1711439E+05-0.7926997E-04 0.2029808E+05 0.3480769E+01
TiO2 4 2.000 2-4.000 6 1.00024
TiO2 97.767 75.429 56.803 44.781 36.401 30.240 25.529 21.816 JA85
TiO2 18.820 16.354 14.291 12.543 11.044
TiO2 -0.3220369E+02 0.3395257E+05-0.1649845E-03 0.1617530E+05 0.6450136E+01
V 4 2.000 1-4.000 5 1.00029
V 101.918 78.218 58.230 45.175 35.973 29.137 23.855 19.650 JA85
V 16.222 13.374 10.968 8.910 7.127
V -0.1393188E+02 0.3547309E+05-0.6251649E-04-0.7543087E+05-0.9134201E+00
VO 5 1.000 1 1.000 2-4.000 5 1.00029
VO 76.828 58.301 42.717 32.564 25.427 20.136 16.058 12.819 JA85
VO 10.184 8.000 6.159 4.587 3.229
VO -0.1739994E+02 0.2781269E+05-0.3556532E-04-0.4157609E+05 0.5746848E+00
VO2 4 2.000 2-4.000 5 1.00029
VO2 57.319 42.956 30.853 22.952 17.387 13.254 10.063 7.524 JA85
VO2 5.456 3.739 2.291 1.053 -0.018
VO2 -0.1141263E+02 0.2133091E+05 0.1362394E-03-0.2635578E+05-0.1033244E+01
W 4 3.000 1 1.00018-4.000 2
W 128.670 100.882 77.583 62.461 51.868 44.042 38.028 33.267 JA85
W 29.405 26.212 23.527 21.240 19.268
W -0.2566172E+02 0.4235086E+05-0.4565290E-03-0.6801376E+05 0.5329498E+01
WBr 5 2.500 1 1.000 7 1.00018-4.000 2
WBr 90.467 70.809 54.511 44.066 36.840 31.567 27.563 24.431 JA85
WBr 21.920 19.868 18.162 16.725 15.500
WBr -0.4438795E+02 0.3108286E+05-0.7537681E-03-0.3067443E+05 0.1259776E+02
WBr5 5 0.500 1 5.000 7 1.00018-4.000 2
WBr5 -3.581 -0.688 2.010 3.960 5.461 6.665 7.663 8.508 JA85
WBr5 9.236 9.874 10.438 10.942 11.396
WBr5 -0.2677896E+02-0.2661911E+04-0.7104784E-03 0.2701964E+05 0.1294597E+02
WBr6 4 6.000 7 1.00018-4.000 2
WBr6 0.960 4.115 7.027 9.111 10.701 11.968 13.011 13.891 JA85
WBr6 14.646 15.304 15.884 16.402 16.866
WBr6 -0.1897050E+02-0.3189075E+04-0.6599226E-03 0.3532315E+05 0.1229618E+02
WCl 5 2.500 1 1.000 5 1.00018-4.000 2
WCl 94.481 73.997 56.991 46.075 38.510 32.980 28.776 25.481 JA85
WCl 22.835 20.669 18.866 17.345 16.046
WCl -0.4217340E+02 0.3219358E+05-0.7007744E-03-0.2964452E+05 0.1180836E+02
WCl2 5 2.000 1 2.000 5 1.00018-4.000 2
WCl2 15.344 11.564 8.630 6.900 5.806 5.083 4.590 4.249 JA85
WCl2 4.010 3.842 3.727 3.648 3.597
WCl2 -0.4171946E+02 0.7452155E+04-0.8294279E-03-0.7338699E+04 0.1309337E+02
WCl4 5 1.000 1 4.000 5 1.00018-4.000 2
WCl4 0.075 1.160 2.263 3.124 3.824 4.413 4.917 5.358 JA85
WCl4 5.747 6.095 6.409 6.693 6.953
WCl4 -0.2311855E+02-0.2860396E+03-0.5314312E-03 0.5712618E+04 0.9799080E+01
WCl5 5 0.500 1 5.000 5 1.00018-4.000 2
WCl5 7.803 8.339 8.989 9.556 10.051 10.486 10.873 11.218 JA85
WCl5 11.530 11.813 12.070 12.307 12.525
WCl5 -0.1753060E+02 0.4091997E+03-0.5520248E-03 0.2148404E+05 0.9652324E+01
(WCl5)2 5 1.000 110.000 5 2.00018-8.000 2
(WCl5)2 13.091 15.656 18.133 19.980 21.435 22.625 23.625 24.482 JA85
(WCl5)2 25.229 25.887 26.474 27.001 27.478
(WCl5)2 -0.2090021E+02-0.1736121E+04-0.9872885E-03 0.2465372E+05 0.1609712E+02
WCl6 4 6.000 5 1.00018-4.000 2
WCl6 15.400 15.536 15.833 16.156 16.470 16.763 17.035 17.285 JA85
WCl6 17.516 17.729 17.926 18.108 18.278
WCl6 -0.8502727E+01 0.8047247E+03-0.4811699E-03 0.2792750E+05 0.8500094E+01
WF 5 2.500 1 1.000 6 1.00018-4.000 2
WF 96.746 75.734 58.187 46.849 38.942 33.126 28.676 25.168 JA85
WF 22.334 20.001 18.048 16.390 14.967
WF -0.2951021E+02 0.3244662E+05-0.4525796E-03-0.4511108E+05 0.7303534E+01
WF6 4 -4.000 2 6.000 6 1.00018
WF6 -9.518 -4.514 -0.394 2.229 4.033 5.341 6.328 7.095 JA85
WF6 7.706 8.200 8.608 8.948 9.234
WF6 0.2428598E+02-0.7716826E+04-0.2537028E-04-0.2561500E+05-0.3081886E+01
WO 4 2.000 1-3.000 2 1.00018
WO 95.570 74.323 56.633 45.241 37.323 31.517 27.090 23.611 JA85
WO 20.810 18.510 16.592 14.969 13.579
WO -0.3919556E+02 0.3311255E+05-0.5503354E-03-0.3914697E+05 0.9824444E+01
WOCl4 4 -3.000 2 4.000 5 1.00018
WOCl4 3.977 4.881 5.770 6.440 6.974 7.413 7.785 8.105 JA85
WOCl4 8.385 8.633 8.855 9.056 9.238
WOCl4 -0.8875196E+01-0.6194342E+03-0.3000268E-03 0.1828410E+05 0.5986641E+01
WO2 4 1.000 1-2.000 2 1.00018
WO2 77.961 60.465 45.912 36.548 30.046 25.282 21.653 18.804 JA85
WO2 16.512 14.633 13.067 11.743 10.612
WO2 -0.3338833E+02 0.2723030E+05-0.3798214E-03-0.2145151E+05 0.8233371E+01
WO2Cl2 4 -2.000 2 2.000 5 1.00018
WO2Cl2 -11.633 -9.289 -7.185 -5.716 -4.615 -3.751 -3.047 -2.460 JA85
WO2Cl2 -1.960 -1.527 -1.147 -0.810 -0.508
WO2Cl2 -0.1951203E+02-0.2573903E+04-0.2928963E-03 0.5096977E+04 0.6685146E+01
WO3 3 -1.000 2 1.00018
WO3 58.585 45.577 34.776 27.839 23.030 19.512 16.837 14.739 JA85
WO3 13.055 11.677 10.530 9.563 8.738
WO3 -0.2493643E+02 0.2019685E+05-0.2203283E-03 0.5279016E+02 0.6403864E+01
(WO3)2 3 -2.000 2 2.00018
(WO3)2 24.084 18.467 14.074 11.450 9.765 8.632 7.844 7.285 JA85
(WO3)2 6.882 6.591 6.380 6.230 6.124
(WO3)2 -0.4852022E+02 0.1027918E+05-0.6344209E-03 0.3294429E+05 0.1533529E+02
(WO3)3 3 -3.000 2 3.00018
(WO3)3 -6.271 -4.968 -3.466 -2.192 -1.098 -0.144 0.698 1.450 JA85
(WO3)3 2.127 2.741 3.301 3.815 4.290
(WO3)3 -0.5589138E+02 0.5052367E+03-0.8619613E-03 0.4193365E+05 0.1928159E+02
(WO3)4 3 -4.000 2 4.00018
(WO3)4 -23.448 -17.973 -12.842 -9.114 -6.232 -3.908 -1.975 -0.332 JA85
(WO3)4 1.091 2.340 3.449 4.443 5.342
(WO3)4 -0.7105138E+02-0.4796411E+04-0.1200658E-02 0.4228005E+05 0.2569192E+02
W3O8 4 1.000 1-4.000 2 3.00018
W3O8 3.790 2.573 1.961 1.867 2.007 2.259 2.565 2.894 JA85
W3O8 3.230 3.563 3.888 4.203 4.506
W3O8 -0.6297365E+02 0.4633322E+04-0.1014199E-02 0.1037317E+05 0.2077610E+02
Zn 4 1.000 1-2.000 5 1.00011
Zn 30.702 23.186 16.853 12.721 9.811 7.652 5.985 4.659 JA85
Zn 3.579 2.682 1.926 1.278 0.718
Zn -0.7177704E+01 0.1131215E+05-0.5749448E-04-0.2569322E+05 0.9890783E-01
******** Begin Solids and Liquids ********
acanthit 247.80 3 1.000 4-2.000 5 2.00039
acanthit -56.083 -42.939 -31.973 -24.984 -20.179 -16.666 -13.981 -11.865 Shock07
acanthit -10.158 -8.754 -7.580 -6.585 -5.733
acanthit 0.5779731E+02-0.2251860E+05 0.2695370E-02 0.1475657E+06-0.1649782E+02
acmite 231.01 7 -0.500 1 6.000 2-3.000 5 -8.00 6 1.000 8 2.00021 1.00010
acmite -5.544 -3.905 -2.347 -1.218 -0.355 0.328 0.886 1.349
acmite 1.742 2.078 2.369 2.623 2.846
acmite -0.1720141E+02-0.2027009E+04-0.8964995E-03 0.8814750E+05 0.7165967E+01
Ag(C) 107.87 3 0.500 1-1.000 5 1.00039
Ag(C) -27.481 -21.113 -15.793 -12.350 -9.946 -8.176 -6.821 -5.752 Shock07
Ag(C) -4.890 -4.180 -3.588 -3.087 -2.658
Ag(C) 0.5929737E+01-0.9478154E+04-0.2331389E-03-0.1261462E+05-0.5695876E+00
Ag2O(C) 231.74 3 1.000 2-2.000 5 2.00039
Ag2O(C) -16.884 -11.563 -7.148 -4.325 -2.385 -0.984 0.061 0.860 Bess05
Ag2O(C) 1.482 1.971 2.360 2.669 2.916
Ag2O(C) 0.8773787E+01-0.7922289E+04-0.1649778E-02-0.1077646E+05 0.6170495E+00
akermani 272.63 6 7.000 2-6.000 5-8.000 6 2.00021 1.00022 2.00023
akermani -59.731 -47.456 -37.042 -30.197 -25.347 -21.728 -18.922 -16.681 HP11
akermani -14.851 -13.328 -12.042 -10.940 -9.988
akermani-0.1136685E+02-0.1787450E+05-0.6796886E-03 0.4174037E+05 0.4574921E+01
akimotoi 100.39 5 3.000 2 1.00022 1.00021-2.000 5-4.000 6
akimotoi -6.393 -5.043 -3.749 -2.804 -2.076 -1.493 -1.014 -0.611 HP11
akimotoi -0.265 0.035 0.299 0.532 0.741
akimotoi-0.1468477E+02-0.1765824E+04-0.3779667E-03 0.8340711E+05 0.5410841E+01
akimo-Fe 131.93 5 3.000 2 1.00010 1.00021-2.000 5-4.000 6
akimo-Fe 10.117 8.105 6.691 5.953 5.548 5.326 5.212 5.164 HP11
akimo-Fe 5.158 5.179 5.218 5.269 5.326
akimo-Fe-0.2679386E+02 0.3528043E+04-0.5177673E-03 0.1304500E+06 0.9604053E+01
alabandi 87.00 3 1.000 4-2.000 5 1.00028
alabandi -17.456 -13.462 -10.123 -7.959 -6.445 -5.328 -4.471 -3.794 HP11
alabandi -3.246 -2.794 -2.415 -2.094 -1.818
alabandi 0.2823498E+01-0.5886589E+04-0.1152478E-03-0.1190810E+05-0.1484744E+00
albit-hi 262.22 6 8.000 2-1.000 5-15.00 6 1.000 8 1.00013 3.00021
albit-hi 1.949 0.164 -0.929 -1.366 -1.496 -1.470 -1.360 -1.205 HP11
albit-hi -1.025 -0.835 -0.640 -0.445 -0.254
albit-hi-0.5138735E+02 0.3925722E+04-0.8229720E-03 0.1481579E+06 0.1565936E+02
albit-lo 262.22 6 8.000 2-1.000 5-15.00 6 1.000 8 1.00013 3.00021
albit-lo 0.379 -0.913 -1.592 -1.759 -1.700 -1.533 -1.315 -1.073 HP11
albit-lo -0.824 -0.575 -0.331 -0.095 0.132
albit-lo-0.5086894E+02 0.3225734E+04-0.8490098E-03 0.1453451E+06 0.1578009E+02
almandin 497.75 6 12.000 2-6.000 5-18.00 6 3.00010 2.00013 3.00021
almandin -26.967 -21.663 -16.916 -13.645 -11.239 -9.387 -7.912 -6.706 HP11
almandin -5.700 -4.847 -4.115 -3.478 -2.920
almandin-0.2559242E+02-0.7755662E+04-0.9412656E-03 0.1851839E+06 0.9228574E+01
alunite 414.20 7 -8.000 114.000 2 2.000 4-1.000 5-9.000 6 1.000 9 3.00013
alunite -27.286 -10.964 3.283 12.819 19.645 24.774 28.771 31.976 HP11
alunite 34.605 36.803 38.670 40.277 41.676
alunite 0.6977166E+02-0.2939649E+05 0.9816677E-03 0.8019723E+06-0.3142464E+01
amesite 557.40 6 -8.000 5-20.00 6 4.00022 4.00013 2.00021 18.00 2
amesite -178.368-134.217 -97.294 -73.438 -56.819 -44.620 -35.315 -28.003 HP11
amesite -22.123 -17.303 -13.291 -9.907 -7.021
amesite 0.9027942E+02-0.6933158E+05-0.4492348E-03 0.2520184E+06-0.1568412E+02
analcite 220.15 6 -1.000 5-11.00 6 1.000 8 1.00013 2.00021 7.000 2
analcite -12.926 -9.947 -7.992 -7.110 -6.752 -6.676 -6.763 -6.946 HP11
analcite -7.187 -7.463 -7.760 -8.069 -8.384 analcite NaAlSi2O7H2, 97.400
analcite 0.6143613E+02-0.6506437E+04-0.1995360E-03-0.1495833E+06-0.2052883E+02
andalusi 162.05 4 5.000 2-10.00 6 2.00013 1.00021
andalusi -16.485 -13.551 -10.801 -8.823 -7.313 -6.112 -5.127 -4.300 HP11
andalusi -3.593 -2.979 -2.439 -1.960 -1.532
andalusi-0.3066371E+02-0.3695497E+04-0.5782670E-03 0.1257096E+06 0.1023736E+02
andradit 508.18 7 -1.000 1 12.00 2 2.00010 3.00023 3.00021-10.00 5-12.00 6
andradit -82.952 -64.288 -48.473 -38.114 -30.803 -25.371 -21.178 -17.844 HP11
andradit -15.132 -12.884 -10.992 -9.378 -7.986
andradit 0.8226010E+01-0.2863835E+05-0.4881642E-03 0.1779816E+06 0.1219998E+01
anglesit 303.26 5 -4.000 1 4.000 2 1.000 4-2.000 5 1.00016
anglesit 22.138 20.170 18.574 17.559 16.847 16.310 15.880 15.518 HP11
anglesit 15.203 14.919 14.656 14.409 14.173
anglesit-0.8974553E+01 0.3750758E+04-0.2907198E-02-0.3273204E+04 0.7854725E+01
anhydrit 136.14 5 -4.000 1 4.000 2 1.000 4-2.000 5 1.00023
anhydrit -15.012 -9.388 -4.671 -1.628 0.482 2.018 3.179 4.078 HP11
anhydrit 4.791 5.364 5.831 6.215 6.533
anhydrit 0.1937992E+02-0.9160081E+04-0.7540479E-03 0.7946537E+05-0.1753155E+01
ankerite 215.95 5 2.000 2 2.000 3 1.00010 1.00023-4.000 5
ankerite -56.141 -40.153 -26.951 -18.533 -12.740 -8.538 -5.369 -2.908 HP11
ankerite -0.951 0.635 1.940 3.028 3.945
ankerite 0.5712587E+02-0.2541721E+05 0.8818124E-04 0.1079630E+05-0.1138234E+02
annite 511.89 7 -7.000 5-15.00 6 1.000 9 3.00010 1.00013 3.0002112.000 2
annite -41.826 -31.485 -22.989 -17.614 -13.949 -11.317 -9.353 -7.844 HP11
annite -6.657 -5.706 -4.933 -4.296 -3.766
annite 0.4573888E+02-0.1746421E+05 0.4088392E-03 0.7012100E+05-0.1208372E+02
anorthit 278.21 6 8.000 2-2.000 5-14.00 6 2.00013 2.00021 1.00023
anorthit -37.628 -30.690 -24.294 -19.750 -16.312 -13.595 -11.379 -9.526 HP11
anorthit -7.947 -6.582 -5.385 -4.326 -3.381
anorthit-0.6542576E+02-0.8528841E+04-0.1331331E-02 0.2102264E+06 0.2199919E+02
anthophy 780.82 5 24.000 2-14.00 5-32.00 6 8.00021 7.00022
anthophy-110.279 -87.455 -67.409 -53.803 -43.902 -36.338 -30.351 -25.482 HP11
anthophy -21.437 -18.019 -15.089 -12.549 -10.324
anthophy-0.8331604E+02-0.3237787E+05-0.3010070E-02 0.4494550E+06 0.3130990E+02
antho-Fe 1001.62 5 -14.00 5-32.00 6 7.00010 8.0002124.000 2
antho-Fe 7.455 5.972 5.008 4.532 4.271 4.116 4.014 3.941 HP11
antho-Fe 3.882 3.829 3.778 3.727 3.672
antho-Fe-0.2100046E+02 0.1604110E+04-0.2132563E-02 0.2606503E+06 0.8397455E+01
antimony 121.75 3 1.500 1-3.000 5 1.00020
antimony 2.625 1.334 0.213 -0.538 -1.080 -1.493 -1.822 -2.092 RG97
antimony -2.320 -2.518 -2.692 -2.848 -2.990
antimony-0.8302701E+01 0.2404709E+04-0.7323308E-03-0.5843545E+05 0.1510647E+01
antimnse 480.40 3 -6.000 5 2.00020 3.00035
antimnse -0.786 -0.704 -0.795 -0.956 -1.129 -1.298 -1.455 -1.600 XI03
antimnse -1.731 -1.851 -1.960 -2.059 -2.149
antimnse 0.1546687E+02-0.3634832E+03 0.6179569E-03-0.8646492E+05-0.5756999E+01
aragonit 100.09 4 1.000 2 1.000 3-2.000 5 1.00023
aragonit -37.964 -27.977 -19.694 -14.387 -10.717 -8.044 -6.021 -4.443 HP11
aragonit -3.185 -2.163 -1.320 -0.616 -0.021
aragonit 0.2590807E+02-0.1556040E+05-0.3087929E-03 0.5160012E+04-0.4707412E+01
arsenoli 197.84 3 3.000 2-6.000 5 2.00019
arsenoli 6.167 4.832 3.689 2.918 2.347 1.895 1.518 1.192 Bess05
arsenoli 0.902 0.637 0.391 0.159 -0.062
arsenoli-0.6715759E+01 0.2159469E+04-0.1918781E-02-0.4349128E+04 0.2530256E+01
artinite 196.69 4 6.000 2-4.000 5 1.000 3 2.00022
artinite -67.716 -44.375 -24.660 -11.783 -2.725 3.982 9.139 13.219 Shock07
artinite 16.519 19.237 21.509 23.430 25.072
artinite 0.3802470E+02-0.3500767E+05-0.2139579E-02 0.1293340E+06 0.4388327E+01
arsenic 74.92 3 1.500 1-3.000 5 1.00019
arsenic -6.532 -5.997 -5.569 -5.302 -5.122 -4.995 -4.901 -4.832 Bess05
arsenic -4.780 -4.741 -4.712 -4.691 -4.676
arsenic -0.6432733E+01-0.5001034E+03-0.3836145E-03-0.3543598E+05 0.8450930E+00
Au(C) 196.97 1 1.00040
Au(C) -57.191 -44.315 -33.526 -26.524 -21.619 -17.993 -15.208 -13.002 Shock07
Au(C) -11.214 -9.736 -8.494 -7.437 -6.527
Au(C) 0.1043732E+02-0.1926540E+05-0.5897898E-04-0.2444410E+04-0.1198972E+01
azurite 344.67 5 -1.500 1-3.000 5 3.00014 4.000 2 2.000 3
azurite -30.256 -15.065 -2.132 6.350 12.307 16.687 20.010 22.587 Shock07
azurite 24.618 26.234 27.527 28.564 29.393
azurite -0.8173267E+01-0.2090645E+05-0.8141576E-02 0.6193733E+05 0.2011308E+02
berndtit 182.81 4 -1.000 1 2.000 4-2.000 5 1.00038
berndtit -10.926 -7.410 -4.452 -2.525 -1.173 -0.173 0.595 1.202 Shock07
berndtit 1.693 2.097 2.436 2.722 2.967
berndtit 0.5798961E+01-0.5249006E+04-0.2437218E-03 0.9329758E+04 0.3427308E+00
bioti-Mn 509.16 7 -7.000 5-15.00 6 1.000 9 3.00028 1.00013 3.0002112.000 2
bioti-Mn -36.850 -27.704 -20.087 -15.197 -11.814 -9.348 -7.479 -6.019 HP11
bioti-Mn -4.851 -3.896 -3.104 -2.437 -1.868
bioti-Mn 0.3457607E+02-0.1547351E+05 0.7353323E-03 0.1247964E+06-0.8547700E+01
bixbyite 157.87 4 -1.000 1 3.000 2-4.000 5 2.00028
bixbyite -4.436 -1.894 0.072 1.228 1.954 2.427 2.741 2.950 HP11
bixbyite 3.086 3.170 3.217 3.235 3.232
bixbyite 0.2621994E+02-0.4491593E+04-0.4143917E-03-0.3412622E+05-0.6095750E+01
boehmite 59.99 3 -3.000 6 1.00013 2.000 2
boehmite -14.959 -10.981 -7.472 -5.069 -3.302 -1.938 -0.846 0.052 Shock07
boehmite 0.805 1.449 2.006 2.493 2.924
boehmite-0.1854239E+02-0.4935975E+04-0.5891423E-03 0.2333748E+05 0.8103601E+01
bornite 501.82 5 -0.500 1 4.000 4-7.000 5 1.00010 5.00014
bornite -191.164-147.174-110.359 -86.686 -70.241 -58.168 -48.949 -41.692 MR2002
bornite -35.842 -31.033 -27.014 -23.611 -20.694
bornite 0.1217853E+03-0.7192500E+05 0.3611227E-02 0.4126661E+06-0.3129551E+02
brucite 58.32 3 2.000 2-2.000 5 1.00022
brucite -29.645 -21.476 -14.772 -10.532 -7.640 -5.560 -4.006 -2.810 HP11
brucite -1.868 -1.111 -0.494 0.016 0.442
brucite 0.3806593E+02-0.1358102E+05 0.3568820E-03 0.3019033E+05-0.9135822E+01
calcite 100.09 4 1.000 2 1.000 3-2.000 5 1.00023
calcite -38.124 -28.086 -19.667 -14.205 -10.382 -7.563 -5.401 -3.694 HP11
calcite -2.313 -1.176 -0.224 0.583 1.275
calcite 0.1655861E+02-0.1531600E+05-0.1810188E-03 0.3211634E+05-0.1462900E+01
calcium 40.08 3 1.000 1-2.000 5 1.00023
calcium 50.557 40.441 31.917 26.351 22.425 19.503 17.240 15.433 RG97
calcium 13.954 12.718 11.668 10.764 9.975
calcium -0.3001859E+01 0.1529038E+05-0.7037689E-03-0.3250059E+05 0.1151828E+01
CaPxTsch 218.12 6 6.000 2-2.000 5-10.00 6 2.00013 1.00021 1.00023
CaPxTsch -46.889 -37.224 -28.904 -23.360 -19.385 -16.386 -14.039 -12.147 HP11 formerly Ca-Al.PX
CaPxTsch -10.588 -9.279 -8.164 -7.201 -6.362 px-Ca-tschermaks CaAl2SiO6, 63.560
CaPxTsch-0.1726074E+02-0.1409927E+05-0.5446942E-03 0.1110927E+06 0.6697954E+01
CaPxEsko 199.19 6 -1.000 5-11.00 6 1.00013 2.00021 0.50023 6.000 2
CaPxEsko -1.064 -1.847 -2.295 -2.448 -2.466 -2.417 -2.335 -2.237 HP11
CaPxEsko -2.130 -2.021 -1.913 -1.806 -1.703 px-Ca-Eskola Ca0.5AlSi2O6, 60.500
CaPxEsko-0.2716877E+02 0.1745514E+04-0.4465657E-03 0.8319543E+05 0.7859366E+01
carnegLO 142.05 6 -1.000 5-7.000 6 1.000 8 1.00013 1.00021 4.000 2
carnegLO -20.597 -16.016 -11.773 -8.748 -6.461 -4.660 -3.200 -1.991 HP11
carnegLO -0.973 -0.105 0.642 1.291 1.858
carnegLO-0.5480747E+02-0.4774821E+04-0.2788317E-02 0.9741568E+05 0.2019078E+02
carnegHI 142.05 6 -1.000 5-7.000 6 1.000 8 1.00013 1.00021 4.000 2
carnegHI -19.047 -15.081 -11.609 -9.256 -7.545 -6.241 -5.209 -4.372 HP11
carnegHI -3.679 -3.095 -2.596 -2.165 -1.790
carnegHI-0.1739186E+02-0.5336421E+04-0.8197606E-03 0.4869752E+05 0.6441864E+01
carph-Mg 298.47 6 -2.000 5-14.00 6 1.00022 2.00013 2.00021 10.00 2
carph-Mg -43.206 -31.851 -22.361 -16.245 -12.000 -8.898 -6.543 -4.703 HP11
carph-Mg -3.232 -2.035 -1.045 -0.216 0.484
carph-Mg 0.3134639E+02-0.1837908E+05-0.2584195E-03 0.1130114E+06-0.5699479E+01
carph-Fe 330.07 6 -2.000 5-14.00 6 1.00010 2.00013 2.00021 10.00 2
carph-Fe -24.654 -17.124 -10.888 -6.918 -4.200 -2.243 -0.782 0.340 HP11
carph-Fe 1.221 1.924 2.494 2.960 3.344
carph-Fe 0.3626972E+02-0.1293824E+05-0.1648704E-03 0.1089643E+06-0.7559394E+01
cassiter 150.69 4 -1.000 1 2.000 2-2.000 5 1.00038
cassiter -8.064 -5.115 -2.653 -1.074 0.014 0.802 1.393 1.850 Shock07
cassiter 2.209 2.498 2.732 2.925 3.084
cassiter 0.1412595E+02-0.5070782E+04-0.1608999E-03 0.5655145E+05-0.2332111E+01
celadoni 396.75 7 -3.000 5-19.00 6 1.000 9 1.00022 1.00013 4.00021 12.00 2
celadoni -20.258 -15.629 -11.432 -8.511 -6.347 -4.670 -3.327 -2.224 HP11
celadoni -1.301 -0.514 0.165 0.756 1.277
celadoni-0.2128971E+02-0.6924048E+04-0.8007461E-03 0.2090735E+06 0.8948233E+01
celad-Fe 428.28 7 -3.000 5-19.00 6 1.000 9 1.00010 1.00013 4.00021 12.00 2
celad-Fe -1.069 -0.526 0.155 0.730 1.209 1.610 1.951 2.243 HP11
celad-Fe 2.496 2.717 2.911 3.083 3.236
celad-Fe-0.1318709E+02-0.1147794E+04-0.6542276E-03 0.1813661E+06 0.5707394E+01
celestit 183.68 5 -4.000 1-2.000 5 1.00030 4.000 2 1.000 4
celestit -17.441 -11.139 -5.798 -2.301 0.162 1.986 3.388 4.495 Shock07
celestit 5.388 6.121 6.732 7.245 7.681
celestit 0.8359144E+01-0.9420390E+04-0.9474133E-03 0.4809487E+05 0.2237862E+01
cerussit 267.20 4 1.000 2 1.000 3 1.00016-2.000 5
cerussit -2.459 0.336 2.758 4.368 5.505 6.339 6.966 7.444 Shock07
cerussit 7.810 8.090 8.302 8.458 8.569
cerussit-0.1167620E+02-0.3329782E+04-0.3142001E-02 0.1194034E+05 0.8562692E+01
chalcoci 159.15 3 1.000 4-2.000 5 2.00014
chalcoci -65.464 -50.333 -37.806 -29.723 -24.086 -19.942 -16.769 -14.261 MR2002
chalcoci -12.231 -10.555 -9.150 -7.955 -6.927
chalcoci 0.1002548E+02-0.2132904E+05-0.2226902E-03-0.2026113E+06-0.6483333E+00
chalcopy 183.51 5 -0.500 1 2.000 4-3.000 5 1.00010 1.00014
chalcopy -55.260 -42.163 -31.213 -24.133 -19.196 -15.571 -12.838 -10.753 Shock07
chalcopy -9.099 -7.761 -6.660 -5.742 -4.969
chalcopy 0.2088020E+02-0.2108414E+05-0.1952227E-02 0.1784969E+06-0.2765711E+01
chlrargy 143.32 1 1.00039
chlrargy -30.025 -22.438 -16.112 -12.037 -9.205 -7.132 -5.554 -4.318 Shock07 CHLORARGYRITE
chlrargy -3.327 -2.518 -1.846 -1.282 -0.803
chlrargy 0.1586618E+02-0.1178911E+05-0.2179338E-03 0.2135447E+05-0.2637208E+01
chlrt-Mn 708.97 6 18.000 2-10.00 5-18.00 6 2.00013 3.00021 5.00028
chlrt-Mn -70.787 -49.400 -31.557 -20.085 -12.146 -6.362 -1.986 1.423 HP11
chlrt-Mn 4.139 6.344 8.161 9.677 10.956
chlrt-Mn 0.8073401E+02-0.3542178E+05-0.1374981E-03 0.2649375E+06-0.1440941E+02
chltNoAl 554.22 5 18.00 2 6.00022 4.0021-12.00 5-16.00 6
chltNoAl-144.348-107.757 -77.226 -57.555 -43.891 -33.892 -26.287 -20.331 HP11
chltNoAl -15.556 -11.655 -8.419 -5.699 -3.387 chlorite-Al-free Mg6Si4O18H8, 215.700
chltNoAl 0.8968896E+02-0.5808474E+05-0.3065550E-03 0.2220318E+06-0.1682249E+02
chondrod 339.71 5 10.000 2 2.00021 5.00022-10.00 5-8.000 6
chondrod-115.440 -88.941 -66.816 -52.534 -42.590 -35.293 -29.726 -25.352 HP11
chondrod -21.833 -18.949 -16.547 -14.521 -12.793
chondrod 0.4299146E+02-0.4108881E+05-0.3263282E-03 0.8146867E+05-0.8663847E+01
chrysoti 277.11 5 9.000 2-6.000 5-8.000 6 2.00021 3.00022
chrysoti -71.755 -53.615 -38.587 -28.981 -22.361 -17.552 -13.921 -11.098 HP11
chrysoti -8.850 -7.027 -5.523 -4.268 -3.207
chrysoti 0.6065890E+02-0.2950698E+05 0.3700806E-03 0.1014743E+06-0.1402295E+02
cinnabar 232.65 3 -1.000 1 1.000 4 1.00041
cinnabar -7.801 -4.468 -1.664 0.160 1.439 2.383 3.106 3.677 HP11
cinnabar 4.137 4.515 4.830 5.096 5.323
cinnabar 0.8518595E+01-0.5031365E+04-0.2701220E-03 0.1414428E+05 0.1928356E+00
cinn-met 232.65 3 -1.000 1 1.000 4 1.00041
cinn-met -7.432 -4.240 -1.554 0.194 1.419 2.322 3.015 3.561 HP11
cinn-met 4.001 4.363 4.664 4.918 5.135
cinn-met 0.8571846E+01-0.4858317E+04-0.2441764E-03 0.1759308E+05 0.6706874E-01
claudeti 197.84 3 3.000 2-6.000 5 2.00019
claudeti 6.101 4.717 3.537 2.747 2.171 1.723 1.358 1.050 Bess05
claudeti 0.783 0.545 0.330 0.132 -0.052
claudeti-0.2874855E+01 0.2032134E+04-0.1133338E-02 0.6136979E+04 0.9816229E+00
clinochl 555.80 6 18.000 2-10.00 5-18.00 6 2.00013 3.00021 5.00022
clinochl-166.338-125.087 -90.622 -68.378 -52.900 -41.551 -32.904 -26.117 HP11
clinochl -20.665 -16.203 -12.492 -9.366 -6.704
clinochl 0.8914003E+02-0.6498729E+05-0.4013666E-03 0.2341171E+06-0.1617486E+02
clinoens 200.80 5 6.000 2-4.000 5-8.000 6 2.00021 2.00022
clinoens -32.647 -26.126 -20.379 -16.461 -13.595 -11.394 -9.642 -8.209 HP11 *BE88 stoch has been doubled
clinoens -7.010 -5.991 -5.111 -4.343 -3.665
clinoens-0.2702254E+02-0.9084262E+04-0.5463510E-03 0.1212206E+06 0.9555123E+01
clinoenP 200.78 5 6.000 2-4.000 5-8.000 6 2.00021 2.00022 High P polymorph
clinoenP -31.163 -25.028 -19.779 -16.305 -13.831 -11.977 -10.535 -9.382
clinoenP -8.438 -7.652 -6.987 -6.418 -5.927
clinoenP-0.9992446E+01-0.9016917E+04-0.5578148E-03 0.5886748E+05 0.3466010E+01
clinohum 621.16 5 18.000 2-18.00 5-16.00 6 9.00022 4.00021
clinohum-205.520-159.574-120.937 -95.807 -78.183 -65.158 -55.154 -47.237 HP11
clinohum -40.825 -35.531 -31.091 -27.318 -24.075
clinohum 0.4290024E+02-0.7057175E+05-0.5072899E-03 0.2516257E+06-0.5819820E+01
cobalt 58.93 3 1.000 1-2.000 5 1.00026
cobalt -14.601 -11.395 -8.686 -6.911 -5.655 -4.718 -3.990 -3.409 RG97
cobalt -2.933 -2.536 -2.200 -1.911 -1.661
cobalt -0.1881922E+01-0.4561606E+04-0.8716192E-04-0.7796758E+04 0.1088829E+01
coesite 60.08 3 2.000 2-4.000 6 1.00021
coesite 13.343 9.945 7.214 5.522 4.388 3.587 2.999 2.553 HP11
coesite 2.208 1.935 1.716 1.538 1.392
coesite -0.1857583E+02 0.5568592E+04-0.2853287E-03 0.3265994E+05 0.5237280E+01
copper 63.55 3 0.500 1-1.000 5 1.00014
copper -27.821 -21.360 -15.928 -12.390 -9.903 -8.060 -6.641 -5.516 HP11
copper -4.602 -3.846 -3.211 -2.670 -2.205
copper 0.2377863E+01-0.9497440E+04-0.2618143E-03-0.2142742E+04 0.7104314E+00
cordieri 584.96 6 18.000 2-4.000 5-32.00 6 4.00013 5.00021 2.00022
cordieri -52.628 -43.982 -35.602 -29.397 -24.557 -20.639 -17.378 -14.607 HP11
cordieri -12.213 -10.116 -8.259 -6.599 -5.105
cordieri-0.1302457E+03-0.9534179E+04-0.2488371E-02 0.4301001E+06 0.4263560E+02
cordie-H 602.98 6 19.000 2-4.000 5-32.00 6 4.00013 5.00021 2.00022
cordie-H -54.470 -44.297 -34.631 -27.590 -22.165 -17.813 -14.220 -11.184 HP11
cordie-H -8.574 -6.298 -4.290 -2.500 -0.893
cordie-H-0.1213599E+03-0.1206723E+05-0.2277295E-02 0.4535320E+06 0.4160161E+02
cordi-Fe 648.04 6 18.000 2-4.000 5-32.00 6 4.00013 5.00021 2.00010
cordi-Fe -15.380 -14.414 -12.609 -10.768 -9.050 -7.484 -6.066 -4.779 HP11
cordi-Fe -3.608 -2.540 -1.560 -0.660 0.172
cordi-Fe-0.1169523E+03 0.1390134E+04-0.2218147E-02 0.3931181E+06 0.3764448E+02
cordi-Mn 646.22 6 18.000 2-4.000 5-32.00 6 4.00013 5.00021 2.00028
cordi-Mn -16.965 -15.801 -13.662 -11.488 -9.461 -7.612 -5.936 -4.414 HP11
cordi-Mn -3.029 -1.762 -0.600 0.470 1.459
cordi-Mn-0.1361908E+03 0.1690793E+04-0.2445035E-02 0.4464060E+06 0.4415634E+02
coruMgSi 100.39 5 3.000 2-2.000 5-4.000 6 1.00021 1.00022
coruMgSi -3.515 -2.743 -1.935 -1.306 -0.801 -0.383 -0.031 0.271 HP11
coruMgSi 0.535 0.767 0.973 1.157 1.324
coruMgSi-0.1468124E+02-0.9058205E+03-0.3761727E-03 0.8294909E+05 0.5408661E+01
corundum 101.96 3 3.000 2-6.000 6 2.00013
corundum -28.592 -22.443 -17.035 -13.356 -10.670 -8.610 -6.974 -5.636 HP11
corundum -4.520 -3.572 -2.755 -2.043 -1.416
corundum-0.2275496E+02-0.8552012E+04-0.5743353E-03 0.1062371E+06 0.8819230E+01
cristo-a 60.08 3 2.000 2-4.000 6 1.00021
cristo-a 13.233 9.826 7.246 5.751 4.818 4.206 3.793 3.509 HP11
cristo-a 3.313 3.178 3.087 3.027 2.992
cristo-a-0.2970351E+02 0.5509474E+04-0.3707155E-03 0.1402357E+06 0.9291247E+01
cristo-b 60.08 3 2.000 2-4.000 6 1.00021
cristo-b 13.600 10.128 7.493 5.963 5.004 4.374 3.946 3.651 HP11
cristo-b 3.445 3.302 3.204 3.139 3.099
cristo-b-0.2945006E+02 0.5586755E+04-0.3592757E-03 0.1420328E+06 0.9222851E+01
covellit 95.61 4 -0.500 1 1.000 4-1.000 5 1.00014
covellit -31.685 -24.023 -17.593 -13.416 -10.486 -8.320 -6.655 -5.336 Sack00
covellit -4.268 -3.385 -2.644 -2.014 -1.472
covellit 0.7034328E+01-0.1142133E+05-0.1798719E-03 0.2119568E+04-0.1544842E+00
cummingt 780.87 5 -14.00 5-32.00 6 7.00022 8.0002124.000 2
cummingt-109.954 -87.206 -67.224 -53.659 -43.787 -36.245 -30.275 -25.419 HP11
cummingt -21.385 -17.975 -15.053 -12.519 -10.300
cummingt-0.8322235E+02-0.3227813E+05-0.2999190E-02 0.4506605E+06 0.3126139E+02
cuprite 143.08 3 1.000 2-2.000 5 2.00014
cuprite -41.495 -31.160 -22.627 -17.184 -13.435 -10.713 -8.657 -7.058 HP11
cuprite -5.785 -4.751 -3.899 -3.187 -2.586
cuprite 0.2993972E+02-0.1623992E+05 0.5545105E-04-0.1152261E+05-0.6810725E+01
cymriteK 296.34 6 -1.000 5-15.00 6 1.000 9 1.00013 3.00021 9.0002
cymriteK 2.986 2.422 2.250 2.333 2.513 2.728 2.953 3.174 HP11
cymriteK 3.388 3.592 3.784 3.965 4.135
cymriteK-0.2842236E+02 0.1318293E+04-0.6806839E-03 0.1540700E+06 0.1028781E+02
daphnite 713.51 6 18.000 2-10.00 5-18.00 6 2.00013 3.00021 5.00010
daphnite -74.544 -52.208 -33.818 -22.171 -14.229 -8.528 -4.279 -1.021 HP11
daphnite 1.534 3.574 5.228 6.583 7.706
daphnite 0.1153046E+03-0.3822102E+05 0.4303321E-03 0.2281563E+06-0.2600577E+02
deerite 2152.33 6 -3.000 1-36.00 5-48.00 618.0001012.00021 50.00 2
deerite -78.185 -51.380 -30.047 -17.113 -8.709 -2.996 1.010 3.876 HP11
deerite 5.949 7.457 8.549 9.330 9.875
deerite 0.2584631E+03-0.5133923E+05 0.1041212E-02 0.3088993E+06-0.6799164E+02
diamond 12.01 3 2.000 1 1.000 3-2.000 2
diamond -10.486 -7.369 -4.729 -2.994 -1.765 -0.848 -0.136 0.433 HP11
diamond 0.897 1.283 1.609 1.888 2.128
diamond -0.1891932E-01-0.4357934E+04-0.2863826E-03-0.7532927E+04 0.1745691E+01
diaspore 59.99 3 2.000 2-3.000 6 1.00013
diaspore -17.073 -12.631 -8.950 -6.597 -4.976 -3.800 -2.915 -2.230 HP11
diaspore -1.687 -1.251 -0.894 -0.599 -0.354
diaspore 0.1194283E+02-0.7019433E+04-0.3287089E-03 0.1191735E+05-0.2226194E+01
diopside 216.55 6 6.000 2-4.000 5-8.000 6 2.00021 1.00022 1.00023 1.0 1
diopside -38.003 -30.398 -23.775 -19.312 -16.082 -13.624 -11.685 -10.111 HP11
diopside -8.806 -7.703 -6.759 -5.940 -5.222
diopside-0.2303013E+02-0.1086348E+05-0.6218088E-03 0.1162305E+06 0.8220581E+01
dolo-dis 184.41 5 2.000 2 2.000 3 1.00022 1.00023-4.000 5
dolo-dis -72.688 -53.151 -36.533 -25.599 -17.854 -12.081 -7.615 -4.060 Shock07
dolo-dis -1.167 1.230 3.245 4.959 6.433
dolo-dis 0.1820317E+01-0.2880184E+05-0.2018382E-02 0.1378519E+06 0.8545226E+01
dolo-ord 184.41 5 2.000 2 2.000 3 1.00022 1.00023-4.000 5
dolo-ord -73.707 -54.087 -37.846 -27.459 -20.291 -15.076 -11.132 -8.058 HP11
dolo-ord -5.607 -3.614 -1.968 -0.592 0.572
dolo-ord 0.5978318E+02-0.3094915E+05 0.4335215E-04 0.1717333E+05-0.1208046E+02
eastonit 418.85 7 -5.000 5-17.00 6 1.000 9 2.00022 3.00013 2.0002112.000 2
eastonit-106.015 -82.052 -61.839 -48.649 -39.371 -32.494 -27.195 -22.989 HP11
eastonit -19.571 -16.740 -14.358 -12.326 -10.572
eastonit 0.1980041E+02-0.3680963E+05-0.2677619E-04 0.1678977E+06-0.1711908E+01
eskolait 151.99 4 1.000 1 3.000 2-8.000 5 2.00025
eskolait -59.947 -49.511 -40.762 -35.077 -31.090 -28.141 -25.872 -24.075 HP11 Cr2O3
eskolait -22.617 -21.411 -20.399 -19.537 -18.796
eskolait-0.8976071E+01-0.1533644E+05-0.2805794E-03-0.2138238E+05 0.3200588E+00
fayalite 203.78 5 4.000 2-4.000 5-4.000 6 2.00010 1.00021 2.0 3
fayalite -11.104 -8.396 -6.079 -4.551 -3.470 -2.666 -2.047 -1.557 HP11
fayalite -1.161 -0.836 -0.565 -0.338 -0.144
fayalite-0.5292424E+00-0.4175156E+04-0.4737273E-03 0.4690042E+05 0.1229534E+01
iron 55.85 3 1.000 1-2.000 5 1.00010
iron -6.134 -4.659 -3.540 -2.894 -2.495 -2.238 -2.069 -1.958 HP11
iron -1.887 -1.843 -1.819 -1.810 -1.812
iron 0.1235163E+02-0.2462875E+04-0.8015038E-04-0.4934171E+05-0.3898330E+01
FeO(C) 71.85 3 1.000 2-2.000 5 1.00010
FeO(C) -10.145 -7.574 -5.474 -4.152 -3.253 -2.610 -2.132 -1.766 HP11
FeO(C) -1.480 -1.252 -1.068 -0.918 -0.795
FeO(C) 0.9879997E+01-0.4123752E+04-0.5955732E-04-0.8617151E+04-0.2456802E+01
ferroact 970.08 6 24.000 2-14.00 5-32.00 6 8.00021 5.00010 2.00023
ferroact -30.826 -24.456 -18.451 -14.137 -10.863 -8.279 -6.181 -4.438 HP11
ferroact -2.964 -1.701 -0.606 0.352 1.198
ferroact-0.5897077E+02-0.8891342E+04-0.2369292E-02 0.3894278E+06 0.2194117E+02
ferrosil 263.86 5 6.000 2-4.000 5-8.000 6 2.00010 2.00021 1.0 2
ferrosil 1.577 0.884 0.196 -0.333 -0.762 -1.124 -1.436 -1.711 HP11 *BE88 stoch has been doubled
ferrosil -1.957 -2.180 -2.384 -2.572 -2.747
ferrosil 0.1183531E+02 0.3616024E+03-0.1653981E-03-0.2902052E+04-0.4602748E+01
fluorite 78.08 3 -2.000 5 2.000 6 1.00023
fluorite -58.549 -44.778 -33.308 -25.914 -20.770 -16.997 -14.122 -11.865 Shock07
fluorite -10.052 -8.569 -7.337 -6.300 -5.420
fluorite 0.1710290E+02-0.2064293E+05-0.7010659E-03-0.3365048E+05-0.2355115E+01
forsteri 140.69 5 4.000 2-4.000 5-4.000 6 1.00021 2.00022 2.0 3
forsteri -44.113 -34.670 -26.724 -21.551 -17.918 -15.229 -13.162 -11.524 HP11
forsteri -10.196 -9.099 -8.179 -7.398 -6.726
forsteri 0.2750658E+01-0.1418007E+05-0.3351309E-03 0.2702809E+05 0.1989484E+00
galena 239.26 3 1.000 4-2.000 5 1.00016
galena -12.504 -9.392 -6.796 -5.120 -3.953 -3.096 -2.442 -1.928 HP11
galena -1.514 -1.176 -0.894 -0.658 -0.456
galena 0.4136555E+01-0.4649419E+04-0.1739017E-03-0.6679038E+04-0.3715589E+00
geikieli 120.18 5 3.000 2-2.000 5-4.000 6 1.00022 1.00024
geikieli -30.267 -23.969 -18.589 -15.032 -12.500 -10.602 -9.124 -7.940 HP11
geikieli -6.968 -6.156 -5.467 -4.875 -4.360
geikieli-0.5606399E+01-0.9376118E+04-0.2039903E-03 0.6142129E+05 0.2488208E+01
gedrite 784.00 6 -10.00 5-36.00 6 5.00022 4.00013 6.00021 24.00 2
gedrite -135.851-107.239 -82.288 -65.463 -53.284 -44.024 -36.723 -30.805 HP11
gedrite -25.904 -21.773 -18.242 -15.186 -12.516
gedrite -0.8342468E+02-0.4098322E+05-0.3165540E-02 0.4798615E+06 0.3256409E+02
glaucoph 783.56 7 -8.000 5-38.00 6 2.000 8 3.00022 2.00013 8.0002124.000 2
glaucoph -70.076 -55.968 -44.254 -36.748 -31.560 -27.782 -24.921 -22.689 HP11
glaucoph -20.906 -19.453 -18.252 -17.244 -16.389
glaucoph 0.3071074E+02-0.2287770E+05 0.4064055E-03 0.8707575E+05-0.1016608E+02
glauc-Fe 878.17 7 -8.000 5-38.00 6 2.000 8 3.00010 2.00013 8.0002124.000 2
glauc-Fe -14.482 -11.965 -10.242 -9.413 -9.032 -8.896 -8.902 -8.993 HP11
glauc-Fe -9.136 -9.310 -9.502 -9.705 -9.913
glauc-Fe 0.5644891E+02-0.6552115E+04 0.7607444E-03 0.4507645E+04-0.1989646E+02
goethite 88.85 4 2.000 2-2.000 5-0.500 1 1.00010
goethite -12.077 -7.880 -4.546 -2.520 -1.196 -0.286 0.360 0.831 HP11
goethite 1.179 1.440 1.638 1.787 1.899
goethite 0.3710460E+02-0.7585384E+04 0.3158086E-03 0.3095887E+03-0.9633622E+01
graphite 12.01 3 2.000 1 1.000 3-2.000 2
graphite -10.995 -7.802 -5.079 -3.278 -1.994 -1.029 -0.276 0.329 HP11
graphite 0.826 1.242 1.594 1.898 2.161
graphite-0.2213699E+01-0.4395985E+04-0.2910393E-03-0.3003169E+04 0.2458489E+01
grossula 450.45 6 12.000 2-6.000 5-18.00 6 2.00013 3.00021 3.00023
grossula -92.042 -72.901 -56.281 -45.110 -37.040 -30.910 -26.080 -22.164 HP11
grossula -18.918 -16.179 -13.834 -11.800 -10.019
grossula-0.4979770E+02-0.2737711E+05-0.1339647E-02 0.2621839E+06 0.1900596E+02
greenali 371.73 5 -6.000 5-8.000 6 3.00010 2.00021 9.000 2
greenali -18.801 -11.508 -5.546 -1.814 0.694 2.464 3.758 4.730 HP11
greenali 5.475 6.054 6.509 6.871 7.160
greenali 0.5611253E+02-0.1346088E+05 0.2005224E-03 0.1378861E+06-0.1268023E+02
gypsum 172.17 5 -4.000 1 6.000 2 1.000 4-2.000 5 1.00023
gypsum -18.357 -8.969 -1.037 4.097 7.639 10.186 12.066 13.474 MA07
gypsum 14.536 15.336 15.932 16.365 16.667
gypsum -0.3062666E+01-0.1336976E+05-0.7357077E-02 0.7158949E+05 0.1250232E+02
grunerit 1001.62 5 -14.00 5-32.00 6 7.00010 8.0002124.000 2
grunerit 9.976 7.881 6.403 5.592 5.097 4.767 4.531 4.351 HP11
grunerit 4.205 4.080 3.969 3.865 3.766
grunerit-0.2142180E+02 0.2500527E+04-0.2126645E-02 0.2619139E+06 0.8365040E+01
H2O(l) 18.01 1 1.000 2
H2O(l) -1.511 0.001 0.054 0.109 0.162 0.211 0.256 0.297 HP11
H2O(l) 0.334 0.369 0.400 0.429 0.455
H2O(l) -0.2315582E+03 0.2413531E+05-0.1309938E-01-0.2792639E+07 0.7454108E+02
halite 58.44 1 1.000 8
halite -32.036 -23.959 -17.210 -12.847 -9.805 -7.569 -5.861 -4.518 HP11
halite -3.437 -2.552 -1.815 -1.195 -0.666
halite 0.1106486E+02-0.1214245E+05-0.4486495E-03-0.3011720E+04-0.8920385E+00
hedenber 248.09 6 6.000 2-4.000 5-8.000 6 2.00021 1.00010 1.00023 1.0 1
hedenber -19.551 -15.825 -12.590 -10.419 -8.855 -7.672 -6.745 -5.998 HP11
hedenber -5.383 -4.867 -4.429 -4.053 -3.726
hedenber-0.1118313E+02-0.5428566E+04-0.5167027E-03 0.6403173E+05 0.3747707E+01
hematite 159.69 4 -1.000 1 3.000 2-4.000 5 2.00010
hematite -22.450 -15.928 -10.626 -7.314 -5.084 -3.504 -2.341 -1.460 HP11
hematite -0.777 -0.239 0.191 0.540 0.825
hematite 0.4087316E+02-0.1136320E+05 0.4400695E-03 0.3838115E+05-0.1041604E+02
heulandi 686.72 6 -2.000 5-34.00 6 1.00023 7.00021 2.00013 24.00 2
heulandi 10.945 11.997 13.251 14.267 15.085 15.753 16.307 16.773 HP11
heulandi 17.170 17.513 17.811 18.072 18.303
heulandi 0.6358118E+01-0.3430775E+04-0.5319505E-03 0.4125294E+06 0.4692628E+01
hercynit 173.81 5 4.000 2-2.000 5-6.000 6 2.00013 1.00010
hercynit -39.865 -30.975 -23.390 -18.385 -14.828 -12.168 -10.101 -8.449 HP11
hercynit -7.097 -5.970 -5.017 -4.199 -3.492
hercynit-0.3887518E+01-0.1331808E+05-0.4046442E-03 0.8968965E+05 0.3153534E+01
hollandi 278.33 6 -1.000 5-15.00 6 1.000 9 1.00013 3.00021 8.000 2
hollandi 33.988 26.550 20.850 17.503 15.381 13.966 12.991 12.302 HP11
hollandi 11.809 11.454 11.197 11.012 10.882
hollandi-0.5863958E+02 0.1232192E+05-0.1079424E-02 0.2401375E+06 0.1977018E+02
huntite 353.05 5 4.000 2-8.000 5 4.000 3 1.00023 3.00022
huntite -139.960-101.749 -69.219 -47.797 -32.616 -21.297 -12.540 -5.572 HP11
huntite 0.096 4.787 8.726 12.072 14.943
huntite -0.3650996E+01-0.5587048E+05-0.4863064E-02 0.2565740E+06 0.2006324E+02
ilmenite 151.73 5 3.000 2-2.000 5-4.000 6 1.00010 1.00024
ilmenite -15.741 -12.515 -9.733 -7.874 -6.539 -5.529 -4.738 -4.099 HP11
ilmenite -3.572 -3.128 -2.750 -2.423 -2.138
ilmenite-0.6901777E+01-0.4651944E+04-0.2142524E-03 0.3618406E+05 0.2594685E+01
jadeite 202.14 6 6.000 2-1.000 5-11.00 6 1.000 8 1.00013 2.00021
jadeite -10.610 -8.590 -6.560 -5.013 -3.781 -2.768 -1.915 -1.184 HP11
jadeite -0.547 0.014 0.512 0.959 1.363
jadeite -0.3934478E+02-0.1795880E+04-0.9463662E-03 0.1107902E+06 0.1365728E+02
K2O(C) 94.20 3 1.000 2-2.000 5 2.000 9
K2O(C) 31.958 27.581 23.809 21.274 19.433 18.021 16.893 15.963 Shock07
K2O(C) 15.178 14.501 13.909 13.382 12.909
K2O(C) 0.1966527E+02 0.5951995E+04-0.8736367E-03 0.1590381E+04-0.3001807E+01
kalsilit 158.17 6 -1.000 5-7.000 6 1.000 9 1.00013 1.00021 4.000 2
kalsilit -20.661 -16.283 -12.463 -9.887 -8.021 -6.600 -5.479 -4.568 HP11
kalsilit -3.813 -3.176 -2.630 -2.157 -1.742
kalsilit-0.1257643E+02-0.6257973E+04-0.4063217E-03 0.7152456E+05 0.4938986E+01
kaolinit 258.16 4 9.000 2-14.00 6 2.00013 2.00021
kaolinit -12.149 -7.502 -3.023 0.288 2.874 4.976 6.735 8.242 HP11
kaolinit 9.556 10.718 11.759 12.700 13.558
kaolinit-0.4317070E+02-0.5541179E+04 0.2184595E-03 0.2341337E+06 0.1895703E+02
kosmochl 227.15 7 0.500 1-5.000 5-8.000 6 1.00025 1.000 8 2.00021 6.000 2
kosmochl -24.636 -20.806 -17.385 -15.018 -13.263 -11.901 -10.805 -9.902 HP11
kosmochl -9.142 -8.492 -7.928 -7.435 -6.999
kosmochl-0.3243732E+02-0.4695921E+04-0.7985315E-03 0.4717147E+05 0.9399713E+01
kyanite 162.05 4 5.000 2-10.00 6 2.00013 1.00021
kyanite -16.758 -13.673 -10.799 -8.742 -7.179 -5.940 -4.926 -4.078 HP11
kyanite -3.353 -2.726 -2.176 -1.688 -1.252
kyanite -0.2960253E+02-0.3958783E+04-0.5761287E-03 0.1276878E+06 0.1004581E+02
laumonti 470.49 6 -2.000 5-22.00 6 1.00023 2.00013 4.00021 16.00 2
laumonti -24.756 -16.165 -8.765 -3.863 -0.382 2.216 4.226 5.826 HP11
laumonti 7.128 8.207 9.115 9.889 10.555
laumonti 0.2060287E+02-0.1441815E+05-0.2769248E-03 0.2724776E+06 0.6920478E-02
lrnt-brd 172.24 5 4.000 2 2.00023-4.000 5-4.000 6 1.00021
lrnt-brd -40.117 -31.566 -24.421 -19.803 -16.584 -14.218 -12.411 -10.988 HP11
lrnt-brd -9.843 -8.903 -8.119 -7.457 -6.892 larnite-bredigite Ca2SiO4, 51.60
lrnt-brd 0.8828044E+01-0.1310061E+05-0.1793328E-03 0.1594776E+05-0.2073750E+01
lawsonit 314.24 6 10.000 2-2.000 5-14.00 6 2.00013 2.00021 1.00023
lawsonit -46.079 -34.101 -24.121 -17.713 -13.283 -10.062 -7.630 -5.741 HP11
lawsonit -4.241 -3.029 -2.036 -1.212 -0.523
lawsonit 0.3429259E+02-0.1946626E+05-0.6568622E-03 0.1129124E+06-0.6529082E+01
leucite 218.25 6 -1.000 5-11.00 6 1.000 9 1.00013 2.00021 6.000 2
leucite -8.393 -7.480 -6.522 -5.770 -5.158 -4.647 -4.210 -3.831 HP11
leucite -3.498 -3.202 -2.936 -2.696 -2.478 leucite KAlSi2O6, 88.260
leucite -0.2514552E+02-0.7123553E+03-0.4090477E-03 0.6534751E+05 0.7487980E+01
lime 56.08 3 1.000 2-2.000 5 1.00023
lime -14.959 -11.258 -8.174 -6.188 -4.809 -3.799 -3.031 -2.429 HP11
lime -1.947 -1.552 -1.225 -0.950 -0.716
lime 0.7855441E+01-0.5770105E+04-0.6756023E-04 0.1068342E+05-0.1439300E+01
litharge 223.20 3 1.000 2-2.000 5 1.00016
litharge 5.530 5.093 4.686 4.387 4.151 3.956 3.789 3.642 HP11
litharge 3.512 3.393 3.284 3.184 3.089
litharge 0.8923095E+01 0.3032044E+03-0.2357079E-03 0.9735629E+04-0.1798113E+01
lizardit 277.11 5 -6.000 5-8.000 6 3.00022 2.00021 9.000 2
lizardit -72.704 -54.264 -38.957 -29.151 -22.376 -17.443 -13.708 -10.796 HP11
lizardit -8.471 -6.579 -5.015 -3.704 -2.594
lizardit 0.5758325E+02-0.2977445E+05 0.3652718E-03 0.1011510E+06-0.1279895E+02
manganos 70.94 3 1.000 2-2.000 5 1.00028
manganos -8.607 -6.377 -4.568 -3.438 -2.675 -2.134 -1.734 -1.431 HP11
manganos -1.196 -1.010 -0.862 -0.743 -0.646
manganos 0.9768234E+01-0.3585100E+04-0.5055666E-04-0.1479310E+05-0.2493222E+01
magnesit 84.31 4 1.000 2 1.000 3-2.000 5 1.00022
magnesit -34.362 -24.998 -17.266 -12.337 -8.945 -6.486 -4.632 -3.192 HP11
magnesit -2.048 -1.121 -0.358 0.277 0.813
magnesit 0.3246087E+02-0.1492940E+05 0.6489451E-04 0.9947693E+04-0.6822021E+01
magnst-H 467.67 4 10.000 2-10.00 5 5.00022 4.000 3
magnst-H-168.302-116.179 -71.949 -42.923 -22.418 -7.175 4.584 13.916 Shock07
magnst-H 21.487 27.738 32.973 37.410 41.206
magnst-H 0.3660027E+02-0.7693626E+05-0.6184735E-02 0.3200521E+06 0.2076708E+02
magnetit 231.54 4 -1.000 1 4.000 2-6.000 5 3.00010 1.0 5
magnetit -35.490 -25.862 -18.130 -13.364 -10.199 -7.988 -6.384 -5.188 HP11
magnetit -4.278 -3.574 -3.022 -2.585 -2.236
magnetit 0.6722470E+02-0.1697520E+05 0.8005939E-03 0.1404495E+05-0.1866134E+02
majorite 401.55 5 12.00 2-8.000 5-16.0006 4.00022 4.00021
majorite -41.741 -33.526 -26.443 -21.726 -18.352 -15.815 -13.839 -12.256 HP11
majorite -10.960 -9.882 -8.971 -8.194 -7.524
majorite-0.1905683E+02-0.1204828E+05-0.1244491E-02 0.1166396E+06 0.6783288E+01
malachit 221.12 5 -1.000 1 3.000 2 2.00014 1.000 3-2.000 5
malachit -23.446 -12.759 -3.703 2.214 6.359 9.404 11.714 13.511 Shock07
malachit 14.931 16.068 16.985 17.729 18.332
malachit 0.3758914E+01-0.1519477E+05-0.4477586E-02 0.4632482E+05 0.9930552E+01
margarit 398.19 6 12.000 2-2.000 5-20.00 6 4.00013 2.00021 1.00023
margarit -73.240 -57.173 -43.402 -34.274 -27.765 -22.880 -19.075 -16.025 HP11
margarit -13.523 -11.433 -9.661 -8.139 -6.817
margarit-0.1292373E+02-0.2409145E+05-0.8253700E-03 0.2058684E+06 0.7442953E+01
meionite 934.72 7 25.000 2 1.000 3-8.000 5-42.00 6 6.00013 6.00021 4.00023
meionite-142.825-114.419 -89.244 -71.986 -59.310 -49.545 -41.752 -35.366 HP11
meionite -30.023 -25.477 -21.555 -18.134 -15.120
meionite-0.1471774E+03-0.3826509E+05-0.4223151E-02 0.5206379E+06 0.5176793E+02
mercury 200.59 1 1.00041
mercury -5.585 -3.432 -1.641 -0.487 -0.006 -0.006 -0.005 -0.005 Shock07
mercury -0.005 -0.005 -0.005 -0.005 -0.004
mercury 0.3202066E+03-0.2942697E+05 0.1967610E-01 0.2214355E+07-0.1042150E+03
merwinit 328.71 6 8.000 2-8.000 5-8.000 6 2.00021 1.00022 3.00023
merwinit -82.800 -65.174 -50.202 -40.357 -33.380 -28.172 -24.134 -20.910 HP11
merwinit -18.276 -16.084 -14.231 -12.645 -11.271
merwinit-0.9904476E+01-0.2607187E+05-0.7621296E-03 0.1051981E+06 0.5493685E+01
Mg-Al.PX 202.36 6 6.000 2-2.000 5-10.00 6 2.00013 1.00021 1.00022
Mg-Al.PX -41.420 -32.997 -25.804 -21.052 -17.673 -15.143 -13.177 -11.605 HP11
Mg-Al.PX -10.319 -9.248 -8.343 -7.568 -6.898 px-Mg-tschermaks MgAl2SiO6, 60.500
Mg-Al.PX-0.1072210E+02-0.1240369E+05-0.6484809E-03 0.7242956E+05 0.4155602E+01
microcli 278.33 6 8.000 2-1.000 5-15.00 6 1.000 9 1.00013 3.00021
microcli -0.653 -1.713 -2.197 -2.237 -2.087 -1.853 -1.583 -1.301 HP11
microcli -1.018 -0.742 -0.476 -0.221 0.023
microcli-0.5156492E+02 0.2940008E+04-0.9177633E-03 0.1411427E+06 0.1605900E+02
millerit 90.75 3 1.000 4-2.000 5 1.00027
millerit -27.578 -21.389 -16.159 -12.736 -10.321 -8.525 -7.139 -6.038 RO78
millerit -5.144 -4.405 -3.784 -3.257 -2.805
millerit-0.4212722E+01-0.8852895E+04-0.6675291E-03-0.3168224E+04 0.2651958E+01
minnesot 473.88 5 12.000 2-6.000 5-16.00 6 4.00021 3.00010
minnesot 8.657 7.587 7.195 7.265 7.513 7.829 8.165 8.500 HP11
minnesot 8.822 9.128 9.414 9.682 9.932
minnesot-0.4749501E+02 0.2506710E+04-0.1686198E-02 0.2557664E+06 0.1833548E+02
minns-Mg 379.26 5 12.000 2-6.000 5-16.00 6 4.00021 3.00022
minns-Mg -41.247 -32.022 -23.745 -18.016 -13.778 -10.494 -7.859 -5.689 HP11
minns-Mg -3.866 -2.307 -0.955 0.229 1.277
minns-Mg-0.4374795E+02-0.1295335E+05-0.1051326E-02 0.2771520E+06 0.1743523E+02
molybden 160.06 4 1.000 1-4.000 2 2.000 4 1.00017
molybden -56.705 -44.374 -33.824 -26.816 -21.796 -18.007 -15.036 -12.637 HP11
molybden -10.655 -8.987 -7.561 -6.327 -5.247
molybden-0.2361039E+02-0.1699115E+05-0.5555069E-03 0.6469008E+04 0.9693877E+01
monticel 156.47 6 4.000 2-4.000 5-4.000 6 1.00021 1.00022 1.00023
monticel -44.034 -34.634 -26.759 -21.656 -18.088 -15.458 -13.444 -11.853 HP11
monticel -10.568 -9.508 -8.621 -7.869 -7.223
monticel 0.9461226E+01-0.1445985E+05-0.4573084E-05 0.3342268E+05-0.2170701E+01
montroyd 216.59 3 -1.000 1 1.000 2 1.00041
montroyd 24.194 21.039 18.378 16.631 15.388 14.452 13.717 13.121 Bess05 HgO
montroyd 12.625 12.202 11.836 11.515 11.228
montroyd 0.8428303E+01 0.4546648E+04-0.6765272E-03 0.1500564E+05 0.2219098E+00
muscovit 398.31 6 12.000 2-1.000 5-21.00 6 1.000 9 3.00013 3.00021
muscovit -35.514 -27.620 -20.659 -15.926 -12.481 -9.850 -7.769 -6.077 HP11
muscovit -4.673 -3.486 -2.470 -1.589 -0.818
muscovit-0.2181372E+02-0.1178638E+05-0.8643367E-03 0.2247948E+06 0.9521484E+01
Na2O(C) 61.98 3 1.000 2-2.000 5 2.000 8
Na2O(C) 11.310 11.106 10.873 10.667 10.481 10.309 10.148 9.998 HP11
Na2O(C) 9.855 9.719 9.590 9.466 9.346
Na2O(C) 0.1925858E+02-0.3003077E+03-0.4566473E-03 0.2314160E+05-0.2855392E+01
nephelin 142.05 6 -1.000 5-7.000 6 1.000 8 1.00013 1.00021 4.000 2
nephelin -21.393 -16.888 -13.050 -10.521 -8.728 -7.389 -6.351 -5.522 HP11
nephelin -4.845 -4.282 -3.806 -3.399 -3.047 nepheline NaAlSiO4, 54.190
nephelin-0.1959759E+01-0.6825225E+04-0.1837380E-03 0.4890875E+05 0.1197543E+01
nesqueho 138.36 4 4.000 2 1.00022 1.000 3-2.000 5
nesqueho -36.296 -20.811 -7.651 0.904 6.851 11.173 14.407 16.877 Shock07
nesqueho 18.787 20.274 21.432 22.329 23.015
nesqueho 0.7469947E+01-0.2330531E+05-0.8720795E-02 0.2265356E+06 0.1392266E+02
nickel 58.69 3 1.000 1-2.000 5 1.00027
nickel -18.281 -14.417 -11.233 -9.201 -7.800 -6.781 -6.009 -5.408 HP11
nickel -4.928 -4.538 -4.215 -3.946 -3.718
nickel 0.5498926E+01-0.5771905E+04-0.1036387E-03-0.3404678E+05-0.1619337E+01
Ni-oxide 74.69 3 1.000 2-2.000 5 1.00027
Ni-oxide -15.261 -11.440 -8.221 -6.120 -4.641 -3.544 -2.699 -2.028 HP11
Ni-oxide -1.483 -1.032 -0.654 -0.332 -0.055
Ni-oxide 0.1634255E+01-0.5592295E+04-0.2314907E-03 0.1714621E+04 0.7723585E+00
orpiment 246.02 3 3.000 4 2.00019-6.000 5
orpiment -10.716 -8.699 -6.985 -5.859 -5.064 -4.477 -4.030 -3.682 Bess05
orpiment -3.407 -3.187 -3.012 -2.871 -2.759
orpiment-0.1245916E+02-0.2361073E+04-0.1347502E-02-0.2884293E+05 0.4198316E+01
orthoens 200.80 5 6.000 2-4.000 5-8.000 6 2.00021 2.00022 1.0 2
orthoens -32.517 -26.118 -20.648 -17.029 -14.454 -12.525 -11.025 -9.825 HP11 *BE 88 stoch has been doubled
orthoens -8.844 -8.027 -7.336 -6.745 -6.234
orthoens-0.1020106E+02-0.9393813E+04-0.5696683E-03 0.5757623E+05 0.3521302E+01
paragoni 382.20 6 12.000 2-1.000 5-21.00 6 1.000 8 3.00013 3.00021
paragoni -35.144 -27.345 -20.616 -16.135 -12.931 -10.523 -8.646 -7.141 HP11
paragoni -5.907 -4.877 -4.005 -3.256 -2.608
paragoni-0.6172373E+01-0.1203715E+05-0.5566435E-03 0.1617347E+06 0.3939388E+01
pargasit 835.86 8 -13.00 5-33.00 6 1.000 8 2.00023 4.00022 3.00013 6.00021 24.0 2
pargasit-177.814-139.716-106.788 -84.771 -68.945 -56.983 -47.601 -40.031 HP11
pargasit -33.786 -28.540 -24.068 -20.209 -16.844
pargasit-0.7333319E+02-0.5550643E+05-0.2881767E-02 0.5221411E+06 0.3098650E+02
periclas 40.30 3 1.000 2-2.000 5 1.00022
periclas -23.186 -17.858 -13.425 -10.572 -8.591 -7.139 -6.034 -5.166 HP11
periclas -4.469 -3.898 -3.423 -3.022 -2.680
periclas 0.9655085E+01-0.8225541E+04 0.5921685E-05 0.2348054E+04-0.2134090E+01
periclFe 71.85 3 1.000 2-2.000 5 1.00010
periclFe -7.909 -5.746 -3.957 -2.815 -2.031 -1.464 -1.039 -0.710 HP11
periclFe -0.450 -0.240 -0.070 0.071 0.189
periclFe 0.8208682E+01-0.3564338E+04-0.3851098E-04 0.1636825E+05-0.1752084E+01
perov-Al 101.96 3 3.000 2 2.00013-6.000 6
perov-Al -23.622 -18.481 -13.921 -10.793 -8.495 -6.723 -5.307 -4.146 HP11
perov-Al -3.173 -2.344 -1.627 -1.001 -0.448
perov-Al-0.2313764E+02-0.7027078E+04-0.5984256E-03 0.1035892E+06 0.8930377E+01
perov-Ca 116.16 5 3.000 2 1.00023 1.00021-2.000 5-4.000 6
perov-Ca -1.431 -1.121 -0.757 -0.454 -0.200 0.016 0.202 0.364 HP11
perov-Ca 0.507 0.633 0.747 0.849 0.941
perov-Ca-0.1005254E+02-0.2738721E+03-0.2928151E-03 0.5134060E+05 0.3657326E+01
perov-Fe 131.93 5 3.000 2 1.00010 1.00021-2.000 5-4.000 6
perov-Fe 20.216 16.133 12.883 10.881 9.543 8.596 7.898 7.367 HP11
perov-Fe 6.952 6.621 6.352 6.131 5.946
perov-Fe-0.1620510E+02 0.6213555E+04-0.4981133E-03 0.1056175E+06 0.5876540E+01
perov-Mg 100.39 5 3.000 2 1.00022 1.00021-2.000 5-4.000 6
perov-Mg 1.816 1.486 1.375 1.407 1.492 1.598 1.709 1.819 HP11
perov-Mg 1.924 2.024 2.119 2.207 2.290
perov-Mg-0.1406450E+02 0.5972241E+03-0.3963789E-03 0.9946437E+05 0.5203868E+01
phlogopi 417.26 7 12.000 2-7.000 5-15.00 6 1.000 9 1.00013 3.00021 3.00022
phlogopi -95.866 -74.247 -56.023 -44.141 -35.790 -29.604 -24.841 -21.063 HP11
phlogopi -17.995 -15.455 -13.319 -11.498 -9.927
phlogopi 0.2001695E+02-0.3333329E+05 0.5204224E-04 0.1539501E+06-0.2356059E+01
phlog-Na 401.12 7 12.000 2-7.000 5-15.00 6 1.000 8 1.00013 3.00021 3.00022
phlog-Na -94.250 -72.969 -55.029 -43.332 -35.112 -29.023 -24.335 -20.617 HP11
phlog-Na -17.597 -15.097 -12.994 -11.200 -9.653
phlog-Na 0.2137920E+02-0.3294599E+05 0.1619453E-03 0.1634687E+06-0.2834976E+01
picrochr 192.30 5 1.000 1 4.000 2-10.00 5 1.00022 2.00025
picrochr -87.754 -71.158 -57.294 -48.331 -42.077 -37.476 -33.957 -31.183 HP11
picrochr -28.945 -27.104 -25.566 -24.263 -23.148
picrochr 0.6346484E+01-0.2525441E+05-0.1540277E-03 0.1087232E+05-0.3828405E+01
prehnite 412.39 6 12.000 2-4.000 5-18.00 6 2.00013 3.00021 2.00023
prehnite -62.755 -49.168 -37.499 -29.751 -24.218 -20.061 -16.819 -14.217 HP11
prehnite -12.081 -10.296 -8.781 -7.480 -6.349
prehnite-0.1400380E+02-0.2033707E+05-0.7910916E-03 0.1859446E+06 0.7114221E+01
prehn-Fe 441.24 8 -0.500 1-6.000 5-15.00 6 2.00023 1.00013 1.00010 3.00021 12.00 2
prehn-Fe -58.277 -44.880 -33.581 -26.222 -21.062 -17.252 -14.330 -12.022 HP11
prehn-Fe -10.156 -8.621 -7.336 -6.248 -5.317
prehn-Fe 0.1735606E+02-0.2118520E+05-0.2833646E-03 0.1521477E+06-0.2507517E+01
protoens 200.80 5 6.000 2-4.000 5-8.000 6 2.00021 2.00022
protoens -31.761 -25.561 -20.258 -16.749 -14.250 -12.377 -10.922 -9.757 HP11 *BE88 stoch has been doubled
protoens -8.804 -8.010 -7.339 -6.765 -6.268
protoens-0.1026474E+02-0.9111170E+04-0.5555929E-03 0.5853967E+05 0.3463382E+01
pseudowo 116.16 5 3.000 2-2.000 5-4.000 6 1.00021 1.00023
pseudowo -17.285 -13.936 -11.016 -9.046 -7.618 -6.530 -5.671 -4.973 HP11
pseudowo -4.394 -3.904 -3.484 -3.120 -2.801
pseudowo-0.1163576E+02-0.4723982E+04-0.3119422E-03 0.4816753E+05 0.3938763E+01
pyrite 119.97 4 -1.000 1 2.000 4-2.000 5 1.00010
pyrite -22.597 -16.397 -11.104 -7.604 -5.114 -3.247 -1.795 -0.631 HP11
pyrite 0.322 1.118 1.793 2.372 2.874
pyrite 0.2544150E+00-0.9113491E+04-0.3422973E-03 0.5014068E+05 0.2931351E+01
pyrope 403.13 6 12.000 2-6.000 5-18.00 6 2.00013 3.00021 3.00022
pyrope -73.388 -58.576 -45.612 -36.832 -30.448 -25.572 -21.711 -18.567 HP11
pyrope -15.951 -13.736 -11.833 -10.179 -8.726
pyrope -0.5264998E+02-0.2083551E+05-0.1386741E-02 0.2398006E+06 0.1893785E+02
pyrophan 150.81 5 3.000 2-2.000 5-4.000 6 1.00028 1.00024
pyrophan -17.192 -13.661 -10.600 -8.549 -7.072 -5.954 -5.076 -4.367 HP11
pyrophan -3.782 -3.290 -2.870 -2.508 -2.191
pyrophan-0.7722673E+01-0.5188529E+04-0.2692448E-03 0.5810431E+05 0.2974304E+01
pyrophyl 360.32 4 12.000 2-22.00 6 2.00013 4.00021
pyrophyl 16.356 12.032 8.664 6.642 5.326 4.421 3.774 3.298 HP11
pyrophyl 2.941 2.668 2.456 2.290 2.160
pyrophyl-0.2782633E+02 0.6638183E+04-0.4254872E-03 0.1519656E+06 0.8218085E+01
pyrrhoti 81.60 4 -0.113 1 1.000 4-1.774 5 0.88710
pyrrhoti -17.319 -13.227 -9.817 -7.623 -6.101 -4.987 -4.141 -3.479 HP11
pyrrhoti -2.948 -2.515 -2.157 -1.856 -1.600
pyrrhoti 0.8446601E+01-0.6429291E+04-0.7443361E-04 0.1587486E+05-0.1761259E+01
pyrr.875 80.93 4 -1.750 5-0.125 1 0.87510 1.000 4
pyrr.875 -16.477 -12.480 -9.156 -7.019 -5.537 -4.454 -3.630 -2.985 HP11
pyrr.875 -2.468 -2.046 -1.696 -1.401 -1.151
pyrr.875 0.8694166E+01-0.6224579E+04-0.3253473E-04 0.6198348E+04-0.1759541E+01
pyrxmngt 131.02 5 -2.000 5-4.000 6 1.00028 1.00021 3.000 2
pyrxmngt -0.626 -0.663 -0.531 -0.338 -0.134 0.064 0.249 0.422 HP11
pyrxmngt 0.582 0.729 0.866 0.992 1.110
pyrxmngt-0.1760617E+02 0.4484711E+03-0.3797324E-03 0.7095888E+05 0.5977508E+01
quartz-a 60.08 3 2.000 2-4.000 6 1.00021
quartz-a 12.596 9.352 6.796 5.249 4.238 3.542 3.045 2.681 HP11
quartz-a 2.408 2.200 2.041 1.917 1.821
quartz-a-0.2341967E+02 0.5483332E+04-0.3363116E-03 0.4881989E+05 0.6941192E+01
rankinit 288.41 5 -6.000 5-8.000 6 3.00023 2.00021 7.000 2
rankinit -58.686 -46.413 -35.924 -28.983 -24.036 -20.323 -17.430 -15.108 HP11
rankinit -13.202 -11.608 -10.254 -9.089 -8.076
rankinit-0.1385544E+02-0.1801858E+05-0.5120048E-03 0.1011216E+06 0.5908085E+01
realgar 427.93 4 2.000 1 4.000 4 4.00019-12.00 5
realgar -8.725 -5.822 -3.045 -0.960 0.705 2.092 3.279 4.318 Bess05
realgar 5.240 6.070 6.825 7.516 8.154
realgar -0.5170390E+02-0.9669868E+03 0.1234704E-05-0.9542044E+05 0.1911358E+02
rhodochr 114.95 4 1.000 2 1.000 3-2.000 5 1.00028
rhodochr -19.280 -13.082 -7.982 -4.744 -2.527 -0.926 0.274 1.201 HP11
rhodochr 1.934 2.523 3.005 3.403 3.736
rhodochr 0.2679969E+02-0.9959252E+04-0.2412244E-04 0.3319463E+04-0.5135058E+01
rhodonit 131.02 5 3.000 2-2.000 5-4.000 6 1.00021 1.00028
rhodonit -0.552 -0.616 -0.508 -0.329 -0.136 0.054 0.233 0.401 HP11
rhodonit 0.557 0.701 0.835 0.959 1.075
rhodonit-0.1753921E+02 0.4787973E+03-0.3700963E-03 0.7181597E+05 0.5934221E+01
riebecki 935.90 7 -1.000 1-12.00 5-32.00 6 2.000 8 5.00010 8.0002124.000 2
riebecki -9.131 -6.444 -4.997 -4.647 -4.800 -5.202 -5.726 -6.309 HP11
riebecki -6.914 -7.522 -8.121 -8.705 -9.269
riebecki 0.1182442E+03-0.9056411E+04 0.1774998E-02-0.6416865E+05-0.3912294E+02
ringw-Mg 140.69 5 4.000 2 -4.000 5-4.000 6 2.00022 1.00021
ringw-Mg -35.979 -28.083 -21.374 -16.960 -13.831 -11.495 -9.683 -8.236 HP11
ringw-Mg -7.054 -6.070 -5.239 -4.526 -3.910
ringw-Mg-0.3876982E+01-0.1165307E+05-0.3765616E-03 0.4678392E+05 0.2654583E+01
ringw-Fe 203.77 5 4.000 2 -4.000 5-4.000 6 2.00010 1.00021
ringw-Fe -9.485 -6.958 -4.735 -3.227 -2.133 -1.303 -0.653 -0.131 HP11
ringw-Fe 0.296 0.649 0.946 1.196 1.408
ringw-Fe-0.1184991E+02-0.3326871E+04-0.1150637E-02 0.3894041E+05 0.5426822E+01
romarchi 134.69 3 1.000 2-2.000 5 1.00038
romarchi -2.071 -1.001 -0.133 0.410 0.774 1.031 1.217 1.355 Shock07
romarchi 1.459 1.537 1.596 1.641 1.673
romarchi 0.4523767E+01-0.1610684E+04-0.3635640E-03-0.1191657E+05-0.3839150E+00
rutile 79.88 3 2.000 2-4.000 6 1.00024
rutile -3.217 -3.076 -2.854 -2.637 -2.437 -2.255 -2.091 -1.942 HP11
rutile -1.806 -1.682 -1.569 -1.465 -1.368
rutile -0.1597380E+02 0.3030452E+03-0.3020106E-03 0.2172288E+05 0.4682307E+01
S(O) 32.06 2 -1.000 1 1.000 4
S(O) 5.804 5.053 4.348 3.836 3.439 3.119 2.853 2.627 HP11 orthorhombic
S(O) 2.432 2.261 2.110 1.975 1.854
S(O) 0.1375045E+02 0.5550318E+03 0.2863538E-03 0.1995869E+04-0.4007303E+01
sanidine 278.33 6 8.000 2-1.000 5-15.00 6 1.000 9 1.00013 3.00021
sanidine 0.862 -0.502 -1.242 -1.449 -1.416 -1.269 -1.066 -0.836 HP11
sanidine -0.597 -0.357 -0.121 0.108 0.329
sanidine-0.5211300E+02 0.3441743E+04-0.9547880E-03 0.1363227E+06 0.1623903E+02
sapph221 689.26 6 -8.000 5-32.00 6 4.00022 8.00013 2.00021 20.00 2
sapph221-200.005-157.518-121.123 -96.991 -79.766 -66.825 -56.728 -48.620 HP11
sapph221 -41.958 -36.384 -31.648 -27.574 -24.029
sapph221-0.5098655E+02-0.6246184E+05-0.2111826E-02 0.4141942E+06 0.2281318E+02
sapFe221 815.38 6 -8.000 5-32.00 6 4.00010 8.00013 2.00021 20.00 2
sapFe221-136.027-106.133 -80.409 -63.293 -51.045 -41.826 -34.622 -28.830 HP11
sapFe221 -24.067 -20.077 -16.685 -13.763 -11.221
sapFe221-0.3266408E+02-0.4466331E+05-0.1541885E-02 0.4314262E+06 0.1699174E+02
sapph351 690.79 6 -6.000 5-34.00 6 3.0002210.00013 1.00021 20.00 2
sapph351-209.916-165.076-126.535-100.894 -82.537 -68.708 -57.892 -49.186 HP11
sapph351 -42.017 -36.007 -30.889 -26.478 -22.634
sapph351-0.6612690E+02-0.6557794E+05-0.2443657E-02 0.4905575E+06 0.2884314E+02
selenium 78.96 2 -1.000 1 1.00035
selenium 5.323 4.716 4.167 3.687 3.302 2.997 2.748 2.540 Shock07
selenium 2.362 2.207 2.071 1.950 1.842
selenium 0.2218832E+02-0.8080887E+01 0.1108355E-02-0.1650116E+04-0.6933087E+01
senarmon 291.50 3 3.000 2-6.000 5 2.00020
senarmon 14.394 11.576 9.169 7.564 6.403 5.515 4.805 4.217 Bess05
senarmon 3.719 3.286 2.904 2.561 2.249
senarmon 0.4050096E+00 0.4101449E+04-0.1167515E-02-0.2602897E+04 0.2465262E+00
siderite 115.86 4 1.000 2 1.000 3-2.000 5 1.00010
siderite -17.627 -11.680 -6.807 -3.728 -1.629 -0.121 1.005 1.870 HP11
siderite 2.551 3.097 3.541 3.906 4.210
siderite 0.2971640E+02-0.9688570E+04 0.8945980E-04 0.1153862E+04-0.6016504E+01
silliman 162.05 4 5.000 2-10.00 6 2.00013 1.00021
silliman -16.121 -13.298 -10.659 -8.763 -7.317 -6.167 -5.225 -4.433 HP11
silliman -3.756 -3.169 -2.653 -2.195 -1.785
silliman-0.3008803E+02-0.3481415E+04-0.5780268E-03 0.1102360E+06 0.9931963E+01
smithson 125.38 4 1.000 2-2.000 5 1.00011 1.000 3
smithson -4.956 -1.560 1.385 3.347 4.738 5.764 6.540 7.136 Shock07 ZnCO3
smithson 7.597 7.954 8.228 8.436 8.589
smithson-0.1707431E+02-0.3915036E+04-0.3654326E-02 0.1440448E+04 0.1063788E+02
sodalite 969.19 6 -6.000 5-42.00 6 8.000 8 6.00013 6.00021 24.00 2
sodalite-196.170-152.200-114.547 -89.593 -71.794 -58.436 -48.032 -39.695 HP11
sodalite -32.863 -27.165 -22.342 -18.209 -14.632
sodalite-0.5736779E+02-0.6365728E+05-0.4329218E-02 0.3571430E+06 0.2908881E+02
spessart 495.03 6 12.00 2 2.00013 3.00028 3.00021 -6.00 5-18.00 6
spessart -38.304 -30.698 -23.867 -19.134 -15.630 -12.914 -10.737 -8.945 HP11
spessart -7.441 -6.157 -5.046 -4.075 -3.218
spessart-0.4458380E+02-0.1043466E+05-0.1277154E-02 0.2158036E+06 0.1585453E+02
sphaleri 97.44 3 1.000 4 1.00011-2.000 5
sphaleri -15.259 -11.666 -8.657 -6.706 -5.340 -4.331 -3.558 -2.946 Shock07
sphaleri -2.451 -2.043 -1.701 -1.410 -1.161
sphaleri 0.3312221E+01-0.5356056E+04-0.8871056E-04-0.2615517E+04-0.2226906E+00
sphene 196.04 6 5.000 2-2.000 5-8.000 6 1.00021 1.00023 1.00024
sphene -24.896 -20.317 -16.162 -13.252 -11.077 -9.377 -8.002 -6.861 HP11
sphene -5.895 -5.064 -4.340 -3.702 -3.134
sphene -0.3315682E+02-0.6091837E+04-0.6101170E-03 0.1372998E+06 0.1104509E+02
spinel 142.27 5 4.000 2-2.000 5-6.000 6 2.00013 1.00022
spinel -56.291 -43.998 -33.555 -26.687 -21.820 -18.187 -15.370 -13.121 HP11
spinel -11.284 -9.755 -8.463 -7.357 -6.400
spinel -0.5777858E+01-0.1816951E+05-0.5670939E-03 0.7322449E+05 0.3949598E+01
stibnite 339.68 3 3.000 4 2.00020-6.000 5
stibnite -3.614 -2.982 -2.471 -2.152 -1.938 -1.786 -1.675 -1.592 Bess05
stibnite -1.529 -1.480 -1.442 -1.413 -1.390
stibnite 0.4909807E+00-0.9360825E+03-0.1449358E-03-0.1064761E+05-0.3242460E+00
stilbite 704.72 6 -2.000 5-34.00 6 1.00023 7.00021 2.00013 25.00 2
stilbite 5.395 10.269 14.640 17.613 19.756 21.369 22.623 23.622 HP11
stilbite 24.436 25.109 25.674 26.154 26.564
stilbite 0.3515148E+02-0.9910434E+04-0.3461151E-03 0.4261762E+06-0.4880839E+00
stilp-Fe 1077.99 7 -10.50 5-38.00 6 0.500 9 5.00010 8.00021 2.00013 30.50 2
stilp-Fe -30.449 -17.016 -5.753 1.481 6.459 10.056 12.746 14.815 HP11
stilp-Fe 16.438 17.732 18.779 19.632 20.335
stilp-Fe 0.8138327E+02-0.2449630E+05-0.5779426E-03 0.4158590E+06-0.1381208E+02
stilp-Mg 920.29 7 -10.50 5-38.00 6 0.500 9 5.00022 8.00021 2.00013 30.50 2
stilp-Mg-115.972 -85.421 -59.336 -42.151 -29.981 -20.915 -13.905 -8.327 HP11
stilp-Mg -3.786 -0.021 3.148 5.849 8.177
stilp-Mg 0.3234974E+02-0.4836680E+05-0.1224529E-02 0.5596414E+06 0.3221226E+01
stishovi 60.08 3 2.000 2-4.000 6 1.00021
stishovi 19.521 15.110 11.655 9.575 8.224 7.300 6.643 6.165 HP11
stishovi 5.809 5.540 5.336 5.179 5.058
stishovi-0.3052223E+02 0.7406813E+04-0.4988588E-03 0.8389461E+05 0.9863086E+01
strontia 147.63 4 1.000 2-2.000 5 1.000 3 1.00030
strontia -41.319 -30.361 -21.071 -14.976 -10.669 -7.463 -4.986 -3.015 Shock07
strontia -1.411 -0.081 1.038 1.991 2.812
strontia 0.5273043E+01-0.1629017E+05-0.7271151E-03 0.6532093E+05 0.3042088E+01
sudoite 536.86 6 -4.000 5-24.00 6 2.00022 4.00013 3.00021 18.00 2
sudoite -97.817 -72.175 -51.225 -38.087 -29.225 -22.938 -18.313 -14.817 HP11
sudoite -12.118 -9.999 -8.316 -6.964 -5.871
sudoite 0.1439105E+03-0.4514911E+05 0.3451811E-03 0.2793725E+06-0.3780353E+02
sudoi-Fe 599.93 6 -4.000 5-24.00 6 2.00010 4.00013 3.00021 18.00 2
sudoi-Fe -59.499 -41.819 -27.726 -19.168 -13.600 -9.809 -7.147 -5.240 HP11
sudoi-Fe -3.857 -2.851 -2.119 -1.595 -1.227
sudoi-Fe 0.1612204E+03-0.3392012E+05 0.5905828E-03 0.2243168E+06-0.4431326E+02
sylvite 74.55 1 1.000 9
sylvite -30.687 -22.895 -16.388 -12.185 -9.256 -7.105 -5.464 -4.175 HP11
sylvite -3.139 -2.291 -1.586 -0.993 -0.489
sylvite 0.1147408E+02-0.1175212E+05-0.4494662E-03-0.1345250E+04-0.1048770E+01
talc 379.27 5 12.000 2-6.000 5-16.00 6 4.00021 3.00022
talc -46.452 -36.130 -26.931 -20.601 -15.941 -12.343 -9.468 -7.106 HP11
talc -5.127 -3.438 -1.978 -0.701 0.428
talc -0.4336392E+02-0.1459827E+05-0.1046913E-02 0.2792623E+06 0.1739604E+02
talc-Fe 473.89 5 12.000 2-6.000 5-16.00 6 4.00021 3.00010
talc-Fe 12.453 10.651 9.644 9.314 9.281 9.389 9.565 9.771 HP11
talc-Fe 9.990 10.209 10.423 10.629 10.825
talc-Fe -0.4734278E+02 0.3587930E+04-0.1689381E-02 0.2566228E+06 0.1833901E+02
talc-tsc 380.85 6 -4.000 5-18.00 6 2.00022 2.00013 3.00021 12.00 2
talc-tsc -55.025 -42.639 -31.452 -23.657 -17.860 -13.345 -9.710 -6.708 HP11
talc-tsc -4.178 -2.012 -0.132 1.517 2.977
talc-tsc-0.7366534E+02-0.1660610E+05-0.2120563E-02 0.3551609E+06 0.2868305E+02
talc-prl 360.31 4 -22.00 6 2.00013 4.00021 12.00 2
talc-prl 14.958 10.957 7.861 6.015 4.823 4.010 3.434 3.015 HP11
talc-prl 2.703 2.468 2.289 2.150 2.044
talc-prl-0.2755070E+02 0.6156210E+04-0.4179187E-03 0.1519355E+06 0.8194223E+01
tenorite 79.55 4 -0.500 1 1.000 2-1.000 5 1.00014
tenorite -10.264 -6.808 -3.880 -1.964 -0.614 0.387 1.157 1.767 HP11 CuO(C)
tenorite 2.260 2.667 3.008 3.296 3.543
tenorite 0.5964162E+01-0.5292344E+04-0.2759879E-03 0.3420450E+05 0.4930312E+00
tephroit 201.96 5 4.000 2-4.000 5-4.000 6 1.00021 2.00028 2.0 3
tephroit -13.496 -10.445 -7.843 -6.129 -4.915 -4.009 -3.309 -2.751 HP11
tephroit -2.297 -1.920 -1.604 -1.334 -1.102
tephroit-0.5532893E+00-0.4651037E+04-0.2339827E-03 0.3858180E+05 0.9265305E+00
tilleyit 488.58 6 9.000 2-10.00 5-8.000 6 5.00023 2.00021 2.000 3
tilleyit-136.197-103.679 -76.475 -58.875 -46.590 -37.554 -30.644 -25.202 HP11
tilleyit -20.813 -17.207 -14.197 -11.652 -9.475
tilleyit 0.4943408E+02-0.4995814E+05-0.5277793E-03 0.9202475E+05-0.7657727E+01
Tin 118.69 3 1.000 1-2.000 5 1.00038
Tin 2.939 2.447 1.993 1.578 1.232 0.959 0.738 0.553 Shock07
Tin 0.395 0.258 0.138 0.030 -0.067
Tin 0.2007638E+02-0.1048065E+03 0.1165318E-02-0.1179555E+05-0.6872831E+01
tremolit 812.37 6 24.000 2-14.00 5-32.00 6 8.00021 5.00022 2.00023
tremolit-123.588 -97.932 -75.418 -60.142 -49.023 -40.525 -33.791 -28.307 HP11
tremolit -23.743 -19.878 -16.557 -13.669 -11.134
tremolit-0.8709865E+02-0.3658194E+05-0.2413599E-02 0.4982804E+06 0.3286463E+02
tridym-a 60.08 3 2.000 2-4.000 6 1.00021
tridym-a 13.089 9.744 7.153 5.620 4.642 3.987 3.534 3.214 HP11
tridym-a 2.985 2.819 2.700 2.615 2.556
tridym-a-0.2949606E+02 0.5847973E+04-0.4225817E-03 0.6228345E+05 0.9051059E+01
troilite 87.91 3 1.000 4-2.000 5 1.00010
troilite -18.067 -13.812 -10.266 -7.980 -6.391 -5.227 -4.341 -3.645 HP11
troilite -3.088 -2.631 -2.252 -1.933 -1.662
troilite 0.7370650E+01-0.6571622E+04-0.1052088E-03 0.7765259E+04-0.1395167E+01
troil-lo 87.91 3 1.000 4-2.000 5 1.00010
troil-lo -18.273 -13.864 -10.187 -7.817 -6.168 -4.960 -4.040 -3.317 HP11
troil-lo -2.737 -2.263 -1.868 -1.536 -1.253
troil-lo 0.8193420E+01-0.6825417E+04-0.8742572E-04 0.1018122E+05-0.1480065E+01
tnt-CaSi 176.24 5 -2.000 5-8.000 6 5.000 2 1.00023 2.00021
tnt-CaSi 4.280 2.992 2.365 2.259 2.377 2.596 2.862 3.146 HP11
tnt-CaSi 3.433 3.717 3.992 4.258 4.512 titanite-CaSi CaSi2O5, 48.180
tnt-CaSi-0.4784617E+02 0.2965720E+04-0.8092007E-03 0.1992082E+06 0.1623779E+02
tschermk 815.54 7 -10.00 5-36.00 6 2.00023 3.00022 6.00021 4.0001324.000 2
tschermk-147.076-115.992 -88.764 -70.318 -56.908 -46.669 -38.564 -31.970 HP11
tschermk -26.487 -21.848 -17.867 -14.409 -11.376
tschermk-0.1029053E+03-0.4403296E+05-0.3179416E-02 0.5488138E+06 0.3972247E+02
ulvospin 223.57 5 4.000 2-4.000 5-4.000 6 2.00010 1.00024 1.0 5
ulvospin -24.412 -18.618 -12.977 -8.785 -5.510 -2.862 -0.665 1.194 HP11
ulvospin 2.790 4.177 5.394 6.470 7.427
ulvospin-0.9558123E+02-0.5251339E+04-0.3641757E-02 0.2243709E+06 0.3529858E+02
valentit 291.50 3 3.000 2-6.000 5 2.00020
valentit 15.713 12.531 9.800 7.973 6.650 5.635 4.825 4.157 Bess05
valentit 3.591 3.103 2.673 2.289 1.942
valentit 0.3086408E+01 0.4506888E+04-0.9758438E-03-0.3521282E+04-0.8725268E+00
wadei-Si 334.53 5 -2.000 5-16.00 6 2.000 9 4.00021 9.000 2
wadei-Si 36.129 28.039 21.671 17.820 15.303 13.569 12.329 11.415 HP11
wadei-Si 10.727 10.199 9.790 9.468 9.213
wadei-Si-0.5683847E+02 0.1380342E+05-0.1284159E-02 0.1200478E+06 0.1847007E+02
wadsl-Mg 140.69 5 4.000 2 -4.000 5-4.000 6 2.00022 1.00021
wadsl-Mg -38.082 -29.796 -22.742 -18.094 -14.794 -12.326 -10.410 -8.877 HP11
wadsl-Mg -7.624 -6.579 -5.695 -4.937 -4.281
wadsl-Mg-0.5597721E+01-0.1220117E+05-0.4099849E-03 0.5436201E+05 0.3212567E+01
wadsl-Fe 203.77 5 4.000 2 -4.000 5-4.000 6 2.00010 1.00021
wadsl-Fe -9.122 -6.760 -4.734 -3.395 -2.447 -1.741 -1.198 -0.769 HP11
wadsl-Fe -0.422 -0.138 0.099 0.297 0.465
wadsl-Fe-0.2162087E+00-0.3668634E+04-0.4717860E-03 0.4773036E+05 0.1213459E+01
wairakit 434.41 6 -2.000 5-22.00 6 1.00023 2.00013 4.00021 14.00 2
wairakit -19.607 -15.024 -10.784 -7.780 -5.520 -3.746 -2.309 -1.116 HP11
wairakit -0.106 0.762 1.518 2.183 2.774
wairakit-0.2843996E+02-0.6671929E+04-0.7631881E-03 0.2428513E+06 0.1160115E+02
walstrom 116.16 5 3.000 2-2.000 5-4.000 6 1.00021 1.00023
walstrom -16.700 -13.425 -10.572 -8.647 -7.254 -6.193 -5.356 -4.676 HP11
walstrom -4.113 -3.637 -3.229 -2.875 -2.566
walstrom-0.1078285E+02-0.4648768E+04-0.3043590E-03 0.4897282E+05 0.3723990E+01
wollasto 116.16 5 3.000 2-2.000 5-4.000 6 1.00021 1.00023
wollasto -18.026 -14.474 -11.388 -9.312 -7.812 -6.673 -5.775 -5.047 HP11
wollasto -4.443 -3.935 -3.499 -3.122 -2.792
wollasto-0.1075250E+02-0.5053780E+04-0.3009225E-03 0.4809515E+05 0.3728373E+01
wurtzite 97.44 3 1.000 4 1.00011-2.000 5 1.0 9
wurtzite -12.959 -9.832 -7.214 -5.518 -4.332 -3.457 -2.786 -2.256 HP11
wurtzite -1.827 -1.474 -1.178 -0.927 -0.711
wurtzite 0.3835242E+01-0.4705790E+04-0.4618098E-04 0.5127202E+03-0.4053418E+00
zincite 81.38 3 1.000 2-2.000 5 1.00011
zincite -2.022 -1.116 -0.378 0.082 0.391 0.608 0.766 0.883 Shock07
zincite 0.972 1.040 1.092 1.132 1.163
zincite 0.5839663E+01-0.1550811E+04-0.1237841E-03 0.5943008E+04-0.1087185E+01
zoisite 454.36 6 13.000 2-4.000 5-21.00 6 3.00013 3.00021 2.00023
zoisite -76.964 -60.940 -46.797 -37.141 -30.073 -24.642 -20.318 -16.781 HP11
zoisite -13.825 -11.312 -9.145 -7.255 -5.590
zoisite -0.6789008E+02-0.2213509E+05-0.1772066E-02 0.2998073E+06 0.2518686E+02
clinozoi 454.36 6 13.000 2-4.000 5-21.00 6 3.00013 3.00021 2.00023
clinozoi -76.989 -60.948 -46.702 -36.915 -29.713 -24.152 -19.705 -16.052 HP11
clinozoi -12.988 -10.373 -8.111 -6.131 -4.381
clinozoi-0.7816222E+02-0.2178242E+05-0.1825320E-02 0.3217689E+06 0.2875662E+02
antig/16 283.50 5 9.188 2-6.000 5-8.500 6 2.12521 3.00022
antig/16****************************************************************
antig/16****************************************
antig/16
************************************************************************
CO2(F) 44.01 1 1.000 3
CO2(F) -0.517 1.567 2.688 3.324 3.653 3.766 3.719 3.620
CO2(F) 3.516 3.422 3.341 3.275 3.222
CO2(F) 0.3931900E+00
H2S(F) 34.08 1 1.000 4
H2S(F) -0.517 1.567 2.688 3.324 3.653 3.766 3.719 3.620
H2S(F) 3.516 3.422 3.341 3.275 3.222
H2S(F) -0.6972700E+00
HBr(F) 80.91 1 1.000 7
HBr(F) -0.517 1.567 2.688 3.324 3.653 3.766 3.719 3.620
HBr(F) 3.516 3.422 3.341 3.275 3.222
HBr(F) -0.3167500E+01
HCl(F) 36.46 1 1.000 5
HCl(F) -0.517 1.567 2.688 3.324 3.653 3.766 3.719 3.620
HCl(F) 3.516 3.422 3.341 3.275 3.222
HCl(F) 0.7810000E+00
HF(F) 20.01 1 1.000 6
HF(F) -0.517 1.567 2.688 3.324 3.653 3.766 3.719 3.620
HF(F) 3.516 3.422 3.341 3.275 3.222
HF(F) -0.1065500E+01
H2O(F) 18.02 1 1.000 2
H2O(F) -0.517 1.567 2.688 3.324 3.653 3.766 3.719 3.620
H2O(F) 3.516 3.422 3.341 3.275 3.222
H2O(F) -0.7618628E-01
GGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGG
GGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGG
GG GG
GG Gastherm Restore Version 4.0 GG
GG GG
GG By Robert Symonds (Michigan Technological Univerity) GG
GG GG
GG GG
GG Last Revised: April, 1990 GG
GG GG
GGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGG
GGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGGG
Gastherm.rst is a special version of Gastherm for restoring gases.
Because of this, it only contains a limited number of species.
A star * as 8th character of a name means that data is not very good
A non blank character ($) in the 16th column before itot will cause the
name to be skipped
========================================================================
Component Molecular Atomic
Species Weight Element Weight
************************************************************************
H2 2.0158 H 1.0079 1
H2O 18.0152 O 15.9994 2
CO2 44.0098 C 12.011 3
H2S(g) 34.0758 S 32.06 4
HCl 36.4609 Cl 35.453 5
HF 20.0063 F 18.9984 6
HBr 80.9119 Br 79.904 7
NaCl 58.4428 Na 22.9898 8
KCl 74.5513 K 39.0983 9
FeCl2 126.753 Fe 55.847 10
ZnCl2 136.286 Zn 65.38 11
Cd 112.4100 Cd 112.41 12
AlF3 83.9767 Al 26.9815 13
CuCl 98.999 Cu 63.546 14
BiCl3 315.3394 Bi 208.9804 15
PbCl2 278.1060 Pb 207.2 16
H2MoO4 161.9534 Mo 95.94 17
H2WO4 249.8634 W 183.85 18
AsCl3 181.2806 As 74.9216 19
SbCl3 228.109 Sb 121.75 20
SiF4 104.0791 Si 28.0855 21
MgCl2 95.2110 Mg 24.305 22
CaCl2 110.9860 Ca 40.08 23
TiF4 123.8736 Ti 47.88 24
CrCl4 193.8080 Cr 51.996 25
CoCl2:Co 129.8392 Co 58.9332 26
NiCl2 129.5960 Ni 58.69 27
MnCl2 125.8440 Mn 54.9380 28
VCl4 192.7535 V 50.9415 29
SrCl2 158.5260 Sr 87.62 30
GaCl3 176.0790 Ga 69.72 31
LiCl 42.3940 Li 6.941 32
RbCl 120.9208 Rb 85.4678 33
CsCl 168.3584 Cs 132.9054 34
H2Se 80.9758 Se 78.96 35
H2Te 129.6158 Te 127.60 36
N2 28.0134 N 14.0067 37
SnCl2 189.5960 Sn 118.69 38
AgCl 143.3210 Ag 107.868 39
Au 196.9665 Au 196.9665 40
Hg 200.59 Hg 200.59 41
Ir 192.22 Ir 192.22 42
O2 3 -2.000 1 2.000 2
O2 80.092 63.038 48.659 39.260 32.628 27.695 23.879 20.838 B672
O2 18.356 16.293 14.550 13.057 11.765
O2 0.4413789E+01 0.2484154E+05 0.3258344E-03 0.6035634E+04-0.3154572E+01
CH4 4 4.000 1-2.000 2 1.000 3
CH4 -19.891 -14.023 -8.967 -5.587 -3.155 -1.314 0.129 1.293 B677
CH4 2.251 3.054 3.737 4.324 4.833
CH4 -0.1286940E+02-0.7731752E+04-0.1100509E-02 0.4447266E+04 0.7754935E+01
CO 4 1.000 1 1.000 3-1.000 2
CO 5.017 3.573 2.377 1.616 1.094 0.718 0.436 0.218 B672
CO 0.046 -0.093 -0.207 -0.301 -0.380
CO -0.7767921E+01 0.2544542E+04-0.1146851E-03-0.2461906E+05 0.1843518E+01
COS 4 -1.000 2 1.000 3 1.000 4
COS 5.314 4.232 3.317 2.718 2.297 1.984 1.743 1.552 B689
COS 1.397 1.268 1.161 1.070 0.992
COS 0.4821159E+00 0.1616650E+04 0.8104396E-04-0.5714799E+04-0.2223597E+00
SO2 4 -3.000 1 2.000 2 1.000 4
SO2 33.379 26.044 19.813 15.705 12.784 10.594 8.888 7.521 B672
SO2 6.399 5.461 4.665 3.982 3.388
SO2 0.1027497E+02 0.1018102E+05 0.5087335E-03 0.1531703E+05-0.4593873E+01
S2 3 -2.000 1 2.000 4
S2 25.669 19.666 14.571 11.219 8.841 7.063 5.682 4.579 B672
S2 3.676 2.924 2.289 1.744 1.273
S2 0.4741110E+01 0.8512289E+04 0.4509498E-03-0.1517626E+04-0.3127909E+01