key,author,year,citation,note,URL
Kel60,"K. K. Kelley",1960,"U. S. Bureau of Mines Bull. 584","gases Cp",https://www.worldcat.org/oclc/693388901
Kel60.2,"K. K. Kelley",1960,"U. S. Bureau of Mines Bull. 584","iron Cp",https://www.worldcat.org/oclc/693388901
Kel60.3,"K. K. Kelley",1960,"U. S. Bureau of Mines Bull. 584","gypsum Cp",https://www.worldcat.org/oclc/693388901
Pan70,"L. B. Pankratz",1970,"U. S. Bureau of Mines Report of Investigations 7430",chlorargyrite,https://www.worldcat.org/oclc/14154245
PK70,"L. B. Pankratz and E. G. King",1970,"U. S. Bureau of Mines Report of Investigations 7435","bornite and chalcopyrite",https://www.worldcat.org/oclc/14154292
NRK74,"Naumov, G. B., Ryzhenko, B. N., & Khodakovsky, I. L.",1974,"Handbook of Thermodynamic Data (U.S. Geol. Surv.)","beta-Nb<sub>2</sub>O<sub>5</sub> and CoSO<sub>4</sub>",https://www.worldcat.org/oclc/8139446
NRK74.1,"Naumov, G. B., Ryzhenko, B. N., & Khodakovsky, I. L.",1974,"Handbook of Thermodynamic Data (U.S. Geol. Surv.)","GeS<sub>2</sub> [Cp coefficients from @PMW87]",https://www.worldcat.org/oclc/8139446
RH72,"R. A. Robie and B. S. Hemingway",1972,"Am. Mineral. 57, 1768-1781","nesquehonite Cp",https://pubs.geoscienceworld.org/msa/ammin/article-pdf/57/11-12/1768/4256711/am-1972-1768.pdf
BKK77,"I. Barin, O. Knacke and O. Kubaschewski",1977,"Thermochemical Properties of Inorganic Substances: Supplement",spherocobaltite,https://www.worldcat.org/oclc/695258
BKK77.1,"I. Barin, O. Knacke and O. Kubaschewski",1977,"Thermochemical Properties of Inorganic Substances: Supplement","willemite Cp",https://www.worldcat.org/oclc/695258
BKK77.2,"I. Barin, O. Knacke and O. Kubaschewski",1977,"Thermochemical Properties of Inorganic Substances: Supplement","Ga<sub>2</sub>S<sub>3</sub> and In<sub>2</sub>(SO<sub>4</sub>)<sub>3</sub>",https://www.worldcat.org/oclc/695258
HDNB78,"H. C. Helgeson, J. M. Delany et al.",1978,"Am. J. Sci. 278A, 1-229",minerals,https://www.worldcat.org/oclc/13594862
HDNB78.2,"H. C. Helgeson, J. M. Delany et al.",1978,"Am. J. Sci. 278A, 1-229","celestite V and Cp parameters",https://www.worldcat.org/oclc/13594862
RHF78,"R. A. Robie, B. S. Hemingway and J. R. Fisher",1978,"U. S. Geological Survey Bull. 1452",chlorargyrite,https://doi.org/10.3133/b1452
RHF78.2,"R. A. Robie, B. S. Hemingway and J. R. Fisher",1978,"U. S. Geological Survey Bull. 1452",iron,https://doi.org/10.3133/b1452
RHF78.3,"R. A. Robie, B. S. Hemingway and J. R. Fisher",1978,"U. S. Geological Survey Bull. 1452","gibbsite GHS",https://doi.org/10.3133/b1452
RHF78.4,"R. A. Robie, B. S. Hemingway and J. R. Fisher",1978,"U. S. Geological Survey Bull. 1452","rutile and titanite",https://doi.org/10.3133/b1452
Den81,"K. Denbigh",1981,"The Principles of Chemical Equilibrium","hydrogen ion convention",https://doi.org/10.1017/CBO9781139167604
Hem82,"B. S. Hemingway",1982,"U. S. Geological Survey Open-File Report 82-619","Cp values of rutherfordine used to obtain parameters of Maier-Kelley equation",https://doi.org/10.3133/ofr82619
Pan82,"L. B. Pankratz",1987,"Thermodynamic Properties of Elements and Oxides (U.S. Bureau of Mines Bull. 672)","gallium, Ga<sub>2</sub>O<sub>3</sub>, indium, In<sub>2</sub>O<sub>3</sub>",https://www.worldcat.org/oclc/8476714
PB82,"L. N. Plummer and E. Busenberg",1982,"Geochim. Cosmochim. Acta 46, 1011-1040","aragonite and calcite",https://doi.org/10.1016/0016-7037(82)90056-4
WEP+82,"D. D. Wagman, W. H. Evans et al.",1982,"J. Phys. Chem. Ref. Data 11, Suppl. 2, 1-392","gases GHS",https://srd.nist.gov/JPCRD/jpcrdS2Vol11.pdf
WEP+82.1,"D. D. Wagman, W. H. Evans et al.",1982,"J. Phys. Chem. Ref. Data 11, Suppl. 2, 1-392","Mn(OH)<sub>2</sub> (amorphous) and MgSO<sub>4</sub>",https://srd.nist.gov/JPCRD/jpcrdS2Vol11.pdf
BH83,"T. S. Bowers and H. C. Helgeson",1983,"Geochim. Cosmochim. Acta 47, 1247-1275",rutile,https://doi.org/10.1016/0016-7037(83)90066-2
HGK84,"L. Haar and J. S. Gallagher and G. S. Kell",1984,"NBS/NRC Steam Tables",thermodynamic properties of H<sub>2</sub>O outside of the critical region,https://www.worldcat.org/oclc/858456124
Hel85,"H. C. Helgeson",1985,"Am. J. Sci. 285, 845-855","ferrosilite and siderite",https://doi.org/10.2475/ajs.285.9.845
JH85,"K. J. Jackson and H. C. Helgeson",1985,"Econ. Geol. 80, 1365-1378","Sn minerals",https://doi.org/10.2113/gsecongeo.80.5.1365
PMW87,"L. B. Pankratz, A. D. Mah and S. W. Watson",1987,"Thermodynamic Properties of Sulfides (U.S. Bureau of Mines Bull. 689)","cattierite, linnaeite, and Co-pentlandite",https://www.worldcat.org/oclc/16131757
PMW87.1,"L. B. Pankratz, A. D. Mah and S. W. Watson",1987,"Thermodynamic Properties of Sulfides (U.S. Bureau of Mines Bull. 689)","GaS, InS, and In<sub>2</sub>S<sub>3</sub>",https://www.worldcat.org/oclc/16131757
RA87,"E. J. Reardon and D. K. Armstrong",1987,"Geochim. Cosmochim. Acta 51, 63-72","celestite GHS",https://doi.org/10.1016/0016-7037(87)90007-X
RS87,"J. R. Ruaya and T. M. Seward",1987,"Geochim. Cosmochim. Acta 51, 121-130",HCl,https://doi.org/10.1016/0016-7037(87)90013-5
Ber88,"R. G. Berman",1988,"J. Petrol. 29, 445-522",minerals,https://doi.org/10.1093/petrology/29.2.445
OH88,"E. H. Oelkers and H. C. Helgeson",1988,"J. Phys. Chem. 92, 1631-1639",KCl,https://doi.org/10.1016/0016-7037(88)90181-0
SH88,"E. L. Shock and H. C. Helgeson",1988,"Geochim. Cosmochim. Acta 52, 2009-2036","ionic species",https://doi.org/10.1016/0016-7037(88)90181-0
SH88.1,"E. L. Shock and H. C. Helgeson",1988,"Geochim. Cosmochim. Acta 52, 2009-2036","values of GHS",https://doi.org/10.1016/0016-7037(88)90181-0
SH88.2,"E. L. Shock and H. C. Helgeson",1988,"Geochim. Cosmochim. Acta 52, 2009-2036",H<sub>2</sub>AsO<sub>3</sub><sup>-</sup>,https://doi.org/10.1016/0016-7037(88)90181-0
SH88.3,"E. L. Shock and H. C. Helgeson",1988,"Geochim. Cosmochim. Acta 52, 2009-2036",Ag<sup>+</sup>,https://doi.org/10.1016/0016-7037(88)90181-0
SH88.4,"E. L. Shock and H. C. Helgeson",1988,"Geochim. Cosmochim. Acta 52, 2009-2036","K<sup>+</sup>, Na<sup>+</sup>, Ca<sup>+2</sup>, Mg<sup>+2</sup>, Cl<sup>-</sup>, and OH<sup>-</sup>",https://doi.org/10.1016/0016-7037(88)90181-0
SH88.5,"E. L. Shock and H. C. Helgeson",1988,"Geochim. Cosmochim. Acta 52, 2009-2036","values of GHS; corrected H for In<sup>+3</sup> [@OBIGT25]",https://doi.org/10.1016/0016-7037(88)90181-0
SHS89,"E. L. Shock, H. C. Helgeson and D. A. Sverjensky",1989,"Geochim. Cosmochim. Acta 53, 2157-2183","inorganic neutral species",https://doi.org/10.1016/0016-7037(89)90341-4
SHS89.1,"E. L. Shock, H. C. Helgeson and D. A. Sverjensky",1989,"Geochim. Cosmochim. Acta 53, 2157-2183",SiO<sub>2</sub>,https://doi.org/10.1016/0016-7037(89)90341-4
Ber90,"R. G. Berman",1990,"Am. Mineral. 75, 328-344",annite,http://ammin.geoscienceworld.org/content/75/3-4/328
Ber90.1,"R. G. Berman",1990,"Am. Mineral. 75, 328-344","almandine and ilmenite: modified H and/or S",http://ammin.geoscienceworld.org/content/75/3-4/328
Eva90,"B. W. Evans",1990,"Lithos 25, 3-23","glaucophane and pumpellyite",https://doi.org/10.1016/0024-4937(90)90003-J
Pol90,"D. A. Polya",1990,"Trans. Inst. Min. Metall. 99, B120-B124","ferberite G, S and Cp (Cp coefficients multiplied by 4.184 to convert to J, as listed in @WS00, but who give a 2nd term that is off by a factor of 10). Cp at 25 &deg;C is from @LW74.",
OH90,"E. H. Oelkers and H. C. Helgeson",1990,"Geochim. Cosmochim. Acta 54, 727-738","Debye-Hückel extended term parameter (<i>b</i><sub>&gamma;</sub>)",https://doi.org/10.1016/0016-7037(90)90368-U
SH90,"E. L. Shock and H. C. Helgeson",1990,"Geochim. Cosmochim. Acta 54, 915-945","organic species",https://doi.org/10.1016/0016-7037(90)90429-O
HRA91,"B. S. Hemingway et al.",1991,"Am. Mineral. 76, 445-457",boehmite,https://pubs.usgs.gov/publication/70016664
SHD91,"D. A. Sverjensky, J. J. Hemley and W. M. D'Angelo",1991,"Geochim. Cosmochim. Acta 55, 989-1004","G and H revisions for K- and Al-bearing silicates",https://doi.org/10.1016/0016-7037(89)90341-4
SHD91.1,"D. A. Sverjensky, J. J. Hemley and W. M. D'Angelo",1991,"Geochim. Cosmochim. Acta 55, 989-1004","phlogopite: H and S modified by @Ber90, followed by G and H revision for K-bearing silicates [after @SHD91]",https://doi.org/10.1016/0016-7037(89)90341-4
SHD91.2,"D. A. Sverjensky, J. J. Hemley and W. M. D'Angelo",1991,"Geochim. Cosmochim. Acta 55, 989-1004","annite: G and H revision for K-bearing silicates [after @SHD91]",https://doi.org/10.1016/0016-7037(89)90341-4
JUN92,"C. de Capitani",1992,"JUN92.bs database supplied with Theriak/Domino software","data as listed in `JUN92.bs` data file",http://titan.minpet.unibas.ch/minpet/theriak/theruser.html
JOH92,"J. W. Johnson and E. H. Oelkers and H. C. Helgeson",1992,"Comp. Geosci. 18, 899-947","thermodynamic and electrostatic properties of H<sub>2</sub>O calculated using HO92D.f source file from SUPCRT92 modified for use in CHNOSZ",https://doi.org/10.1016/0098-3004(92)90029-Q
Joh92,"J. W. Johnson",1992,"Personal calculation","steam: &quot;Parameters given provide smooth metastable extrapolation of one-bar steam properties predicted by the @HGK84 equation of state to temperatures < the saturation temperature (99.632 C).&quot;",
SPRONS92.1,"H. C. Helgeson et al.",1992,"sprons92.dat computer data file","titanite: @BH83 + &quot;Gibbs free energies and enthalpies were corrected to be consistent with updated values of Gibbs free energies of Ca<sup>2+</sup> and CO<sub>3</sub><sup>2-</sup> [@SH88] together with the solubilities of calcite and aragonite reported by @PB82 &quot;",
SPRONS92.2,"H. C. Helgeson et al.",1992,"sprons92.dat computer data file","Ca-bearing minerals; &quot;Gibbs free energies and enthalpies were corrected to be consistent with updated values of Gibbs free energies of Ca<sup>2+</sup> and CO<sub>3</sub><sup>2-</sup> [@SH88] together with the solubilities of calcite and aragonite reported by @PB82 &quot;",
Sho92.1,"E. L. Shock",1992,"Geochim. Cosmochim. Acta 56, 3481-3491","diketopiperazine GHS",https://doi.org/10.1016/0016-7037(92)90392-V
VGT92,"O. Vidal, B. Goffé and T. Theye",1992,"J. Metamorphic Geol. 10, 603-614",sudoite,https://doi.org/10.1111/j.1525-1314.1992.tb00109.x
ZS92,"C. Zhu and D. A. Sverjensky",1982,"Geochim. Cosmochim. Acta 56, 3435-3467","F,Cl,OH biotite and apatite endmembers. GHS and V were taken from Table 6 of @ZS92; heat capacity and volume parameters from `berman.dat`.",https://doi.org/10.1016/0016-7037(92)90390-5
Sho93,"E. L. Shock",1993,"Geochim. Cosmochim. Acta 57, 3341-3349","ethylacetate and acetamide",https://doi.org/10.1016/0016-7037(93)90542-5
Sho93.1,"E. L. Shock",1993,"Geochim. Cosmochim. Acta 57, 3341-3349","carbon monoxide and ethylene",https://doi.org/10.1016/0016-7037(93)90542-5
SK93,"E. L. Shock and C. M. Koretsky",1993,"Geochim. Cosmochim. Acta 57, 4899-4922","metal acetate complexes",https://doi.org/10.1016/0016-7037(93)90128-J
SK93.1,"E. L. Shock and C. M. Koretsky",1993,"Geochim. Cosmochim. Acta 57, 4899-4922","Ag, Au, Cu(I) and Al acetate complexes",https://doi.org/10.1016/0016-7037(93)90128-J
SM93,"E. L. Shock and W. B. McKinnon",1993,"Icarus 106, 464-477","CO, HCN, urea",https://doi.org/10.1006/icar.1993.1185
SS93,"M. D. Schulte and E. L. Shock",1993,"Geochim. Cosmochim. Acta 57, 3835-3846",aldehydes,https://doi.org/10.1016/0016-7037(93)90337-V
HDM+94,"A. W. Hakin et al.",1994,"J. Chem. Soc., Faraday Trans. 90, 2027-2035","glutamic acid",https://doi.org/10.1039/FT9949002027
OC95,"P. A. G. O'Hare and L. A. Curtiss",1995,"J. Chem. Thermodynamics 27, 643-662",GeS,https://doi.org/10.1006/jcht.1995.0066
HSS95,"J. R. Haas, E. L. Shock and D. C. Sassani",1995,"Geochim. Cosmochim. Acta 59, 4329-4350","complexes of rare earth elements",https://doi.org/10.1016/0016-7037(95)00314-P
PH95,"V. A. Pokrovskii and H. C. Helgeson",1995,"Am. J. Sci. 295, 1255-1342","aluminum species",https://doi.org/10.2475/ajs.295.10.1255
PK95,"V. B. Parker and I. L. Khodakovskii",1995,"J. Phys. Chem. Ref. Data 24, 1699-1745",melanterite,https://doi.org/10.1063/1.555964
RH95,"R. A. Robie and B. S. Hemingway",1995,"U. S. Geological Survey Bull. 2131","aluminum, bixbyite, cassiterite, cattierite, chromite, cobalt, cobalt monoxide, guite, gypsum, hausmannite, huebnerite, linnaeite, manganese, manganosite, pyrolusite, willemite, wustite, zinc",https://doi.org/10.3133/b2131
RH95.1,"R. A. Robie and B. S. Hemingway",1995,"U. S. Geological Survey Bull. 2131","hydrogen fluoride and hydrogen chloride",https://doi.org/10.3133/b2131
RH95.2,"R. A. Robie and B. S. Hemingway",1995,"U. S. Geological Survey Bull. 2131","dawsonite: Cp coefficients corrected in @TKSS14; Cp value at 25 &deg;C from @BPAH07, citing @FSR76",https://doi.org/10.3133/b2131
RH95.3,"R. A. Robie and B. S. Hemingway",1995,"U. S. Geological Survey Bull. 2131","almandine, dickite, glaucophane, grunerite, halloysite, pyrope: GHS and Cp at 25 &deg;C",https://doi.org/10.3133/b2131
RH95.4,"R. A. Robie and B. S. Hemingway",1995,"U. S. Geological Survey Bull. 2131","fluorphlogopite (Al/Si disordered) (G and H not in SUPCRT92)",https://doi.org/10.3133/b2131
RH95.5,"R. A. Robie and B. S. Hemingway",1995,"U. S. Geological Survey Bull. 2131","larnite (G and H not in SUPCRT92); Cp from @Kel60",https://doi.org/10.3133/b2131
RH95.6,"R. A. Robie and B. S. Hemingway",1995,"U. S. Geological Survey Bull. 2131","bromellite (melting temperature and G and H not in SUPCRT92)",https://doi.org/10.3133/b2131
RH95.7,"R. A. Robie and B. S. Hemingway",1995,"U. S. Geological Survey Bull. 2131","phase transition temperature",https://doi.org/10.3133/b2131
RH95.8,"R. A. Robie and B. S. Hemingway",1995,"U. S. Geological Survey Bull. 2131","brucite V",https://doi.org/10.3133/b2131
RH95.9,"R. A. Robie and B. S. Hemingway",1995,"U. S. Geological Survey Bull. 2131","germanium, cadmium, and greenockite (CdS)",https://doi.org/10.3133/b2131
SK95,"E. L. Shock and C. M. Koretsky",1995,"Geochim. Cosmochim. Acta 59, 1497-1532","metal-organic acid complexes",https://doi.org/10.1016/0016-7037(95)00058-8
Sho95,"E. L. Shock",1995,"Am. J. Sci. 295, 496-580","carboxylic acids",https://doi.org/10.2475/ajs.295.5.496
DPS+96,"I. Diakonov, G. Pokrovski et al.",1996,"Geochim. Cosmochim. Acta 60, 197-211",NaAl(OH)<sub>4</sub>,https://doi.org/10.1016/0016-7037(95)00403-3
AH97b,"J. P. Amend and H. C. Helgeson",1997,"J. Chem. Soc., Faraday Trans. 93, 1927-1941","amino acids GHS",https://doi.org/10.1039/A608126F
DSM+97,"J. D. Dale, E. L. Shock et al.",1997,"Geochim. Cosmochim. Acta 61, 4017-4024",alkylphenols,https://doi.org/10.1016/S0016-7037(97)00212-3
DSM+97.1,"J. D. Dale, E. L. Shock et al.",1997,"Geochim. Cosmochim. Acta 61, 4017-4024","phenol, and cresol isomers",https://doi.org/10.1016/S0016-7037(97)00212-3
DSM+97.2,"J. D. Dale, E. L. Shock et al.",1997,"Geochim. Cosmochim. Acta 61, 4017-4024","dimethylphenol isomers",https://doi.org/10.1016/S0016-7037(97)00212-3
HP97,"P. C. Ho and D. A. Palmer",1997,"Geochim. Cosmochim. Acta 61, 3027-3040",KOH,https://doi.org/10.1016/S0016-7037(97)00146-4
MS97,"T. M. McCollom and E. L. Shock",1997,"Geochim. Cosmochim. Acta 61, 4375-4391","MgSO<sub>4</sub> and NaSO<sub>4</sub><sup>-</sup>",https://doi.org/10.1016/S0016-7037(97)00241-X
MS97.1,"T. M. McCollom and E. L. Shock",1997,"Geochim. Cosmochim. Acta 61, 4375-4391",sulfur,https://doi.org/10.1016/S0016-7037(97)00241-X
MS97.2,"T. M. McCollom and E. L. Shock",1997,"Geochim. Cosmochim. Acta 61, 4375-4391","HCl",https://doi.org/10.1016/S0016-7037(97)00241-X
PH97,"V. A. Pokrovskii and H. C. Helgeson",1997,"Chem. Geol. 137, 221-242",KAl<sub>2</sub>O,https://doi.org/10.1016/S0009-2541(96)00167-2
SSB97,"E. L. Shock, D. C. Sassani and H. Betz",1997,"Geochim. Cosmochim. Acta 61, 4245-4266","uranium species",https://doi.org/10.1016/S0016-7037(97)00240-8
SSWS97,"E. L. Shock, D. C. Sassani et al.",1997,"Geochim. Cosmochim. Acta 61, 907-950","aqueous ions and hydroxide complexes",https://doi.org/10.1016/S0016-7037(96)00339-0
SSWS97.1,"E. L. Shock, D. C. Sassani et al.",1997,"Geochim. Cosmochim. Acta 61, 907-950","zincite and litharge",https://doi.org/10.1016/S0016-7037(96)00339-0
SSWS97.2,"E. L. Shock, D. C. Sassani et al.",1997,"Geochim. Cosmochim. Acta 61, 907-950","Au<sup>+</sup>, Cu<sup>+</sup>, Sn<sup>+2</sup>, Th<sup>+4</sup>, and Zn<sup>+2</sup>",https://doi.org/10.1016/S0016-7037(96)00339-0
SSWS97.3,"E. L. Shock, D. C. Sassani et al.",1997,"Geochim. Cosmochim. Acta 61, 907-950","arsenate and arsenite species",https://doi.org/10.1016/S0016-7037(96)00339-0
SSWS97.4,"E. L. Shock, D. C. Sassani et al.",1997,"Geochim. Cosmochim. Acta 61, 907-950","Ag, Al, Ga, Nb, and Zn hydroxide complexes",https://doi.org/10.1016/S0016-7037(96)00339-0
SSWS97.6,"E. L. Shock, D. C. Sassani et al.",1997,"Geochim. Cosmochim. Acta 61, 907-950","Sn<sup>+2</sup> and Th<sup>+4</sup> GHS",https://doi.org/10.1016/S0016-7037(96)00339-0
SSH97,"D. A. Sverjensky, E. L. Shock and H. C. Helgeson",1997,"Geochim. Cosmochim. Acta 61, 1359-1412","metal complexes",https://doi.org/10.1016/S0016-7037(97)00009-4
SSH97.1,"D. A. Sverjensky, E. L. Shock and H. C. Helgeson",1997,"Geochim. Cosmochim. Acta 61, 1359-1412","Ag(HS)<sub>2</sub><sup>-</sup> and Au(HS)<sub>2</sub><sup>-</sup>",https://doi.org/10.1016/S0016-7037(97)00009-4
SSH97.2,"D. A. Sverjensky, E. L. Shock and H. C. Helgeson",1997,"Geochim. Cosmochim. Acta 61, 1359-1412",HSiO<sub>3</sub><sup>-</sup>,https://doi.org/10.1016/S0016-7037(97)00009-4
SSH97.3,"D. A. Sverjensky, E. L. Shock and H. C. Helgeson",1997,"Geochim. Cosmochim. Acta 61, 1359-1412","Ag, Au, Cd, Co, Cu, In, and Zn chloride complexes",https://doi.org/10.1016/S0016-7037(97)00009-4
SSH97.4,"D. A. Sverjensky, E. L. Shock and H. C. Helgeson",1997,"Geochim. Cosmochim. Acta 61, 1359-1412","Zn acetate complexes",https://doi.org/10.1016/S0016-7037(97)00009-4
SSH97.5,"D. A. Sverjensky, E. L. Shock and H. C. Helgeson",1997,"Geochim. Cosmochim. Acta 61, 1359-1412","NaHSiO<sub>3</sub>, CaHSiO<sub>3</sub><sup>+</sup>, and MgHSiO<sub>3</sub><sup>+</sup>",https://doi.org/10.1016/S0016-7037(97)00009-4
SSH97.6,"D. A. Sverjensky, E. L. Shock and H. C. Helgeson",1997,"Geochim. Cosmochim. Acta 61, 1359-1412","In fluoride complex",https://doi.org/10.1016/S0016-7037(97)00009-4
TSD97,"Y. Tardy, R. Schaul, J. Duplay",1997,"C. R. Acad. Sci. Paris 324, 969-976","humic acid, microflora, and plants",https://doi.org/10.1016/S1251-8050(97)83981-X
TZA97,"B. R. Tagirov, A. V. Zotov and N. N. Akinfiev",2007,"Geochim. Cosmochim. Acta 61, 4267-4280","aqueous HCl",https://doi.org/10.1016/S0016-7037(97)00274-3
ST97,"D. Shvedov and P. R. Tremaine",1997,"J. Solution Chem. 26, 1113-1143","dimethylammonium chloride HKF parameters",https://doi.org/10.1023/A:1022977006327
DRT98,"I. I. Diakonov et al.",1998,"Chem. Geol. 151, 327-347","REE hydroxides",https://doi.org/10.1016/S0009-2541(98)00088-6
HOKR98,"H. C. Helgeson, C. E. Owens et al.",1998,"Geochim. Cosmochim. Acta 62, 985-1081","organic molecules and groups",https://doi.org/10.1016/S0016-7037(97)00219-6
HOKR98.1,"H. C. Helgeson, C. E. Owens et al.",1998,"Geochim. Cosmochim. Acta 62, 985-1081","amino acids",https://doi.org/10.1016/S0016-7037(97)00219-6
PS98,"G. S. Pokrovski and J. Schott",1998,"Geochim. Cosmochim. Acta 62, 1631-1642","GeO<sub>2</sub> (hex) and (tetr) (augite)",https://doi.org/10.1016/S0016-7037(98)00081-7
PS98.1,"G. S. Pokrovski and J. Schott",1998,"Geochim. Cosmochim. Acta 62, 1631-1642","Ge hydroxide and oxyhydroxide complexes",https://doi.org/10.1016/S0016-7037(98)00081-7
RH98,"L. Richard and H. C. Helgeson",1998,"Geochim. Cosmochim. Acta 62, 3591-3636","organic molecules and groups",https://doi.org/10.1016/S0016-7037(97)00345-1
SLOP98.1,"E. L. Shock et al.",1998,"slop98.dat computer data file","zincite and litharge; &quot;These data were used in @SSWS97, but were not tabulated in the paper.&quot;",https://doi.org/10.5281/zenodo.2630820
SLOP98.2,"E. L. Shock et al.",1998,"slop98.dat computer data file","daphnite; &quot;G<sub>f</sub> and H<sub>f</sub> from @SS93a TMM&quot;",https://doi.org/10.5281/zenodo.2630820
SLOP98.8,"E. L. Shock et al.",1998,"slop98.dat computer data file","&quot;These data were used in @SK95, but were not tabulated in the paper.&quot;",https://doi.org/10.5281/zenodo.2630820
SLOP98.10,"E. L. Shock et al.",1998,"slop98.dat computer data file","&quot;Corrected values based on data from @HSS95 &quot;",https://doi.org/10.5281/zenodo.2630820
SLOP98.11,"E. L. Shock et al.",1998,"slop98.dat computer data file","&quot;Data and parameters as used by @MS97. &quot;",https://doi.org/10.5281/zenodo.2630820
SS98a,"D. C. Sassani and E. L. Shock",1998,"Geochim. Cosmochim. Acta 62, 2643-2671","platinum-group ions and complexes",https://doi.org/10.1016/S0016-7037(98)00049-0
SS98a.1,"D. C. Sassani and E. L. Shock",1998,"Geochim. Cosmochim. Acta 62, 2643-2671","platinum-group solids",https://doi.org/10.1016/S0016-7037(98)00049-0
SS98a.2,"D. C. Sassani and E. L. Shock",1998,"Geochim. Cosmochim. Acta 62, 2643-2671",Rh<sup>+3</sup>,https://doi.org/10.1016/S0016-7037(98)00049-0
SS98a.3,"D. C. Sassani and E. L. Shock",1998,"Geochim. Cosmochim. Acta 62, 2643-2671","Pd<sup>+2</sup> and Pt<sup>+2</sup> and their complexes",https://doi.org/10.1016/S0016-7037(98)00049-0
SUF+98,"H. Senoh et al.",1998,"J. Alloys Compd. 280, 114-124","Mn(OH)<sub>2</sub>: Cp coefficients from linear fit to values estimated by @SUF+98",https://doi.org/10.1016/S0925-8388(98)00739-7
SB99,"Y. V. Shvarov and E. N. Bastrakov",1999,"HCh: a software package for geochemical equilibrium modelling","Co(OH)<sub>2</sub>",https://pid.geoscience.gov.au/dataset/ga/25473
HS99,"J. R. Haas and E. L. Shock",1998,"Geochim. Cosmochim. Acta 63, 3429-3441","chloroethylene species",https://doi.org/10.1016/S0016-7037(99)00276-8
MS99,"W. M. Murphy and E. L. Shock",1999,"Rev. Mineral. Geochem. 38, 221-253","americium species",http://rimg.geoscienceworld.org/content/38/1/221
PSK99,"P. Prapaipong, E. L. Shock and C. M. Koretsky",1999,"Geochim. Cosmochim. Acta 63, 2547-2577","metal-dicarboxylate complexes",https://doi.org/10.1016/S0016-7037(99)00146-5
PSK99.1,"P. Prapaipong, E. L. Shock and C. M. Koretsky",1999,"Geochim. Cosmochim. Acta 63, 2547-2577","Al(Mal)<sup>+</sup> and Al(Oxal)<sup>+</sup>",https://doi.org/10.1016/S0016-7037(99)00146-5
SAJ00,"R. E. Stoffregen, C. N. Alpers and J. L. Jambor",2000,"Rev. Mineral. Geochem. 40, 453-479","jarosite, natroalunite, and natrojarosite",https://doi.org/10.2138/rmg.2000.40.9
TDDZ00,"B. R. Tagirov et al.",2000,"Chem. Geol. 162, 193-219",FeCl<sup>+2</sup>,https://doi.org/10.2138/rmg.2000.40.9
WS00,"S. A. Wood and I. M. Samson",2000,"Econ. Geol. 95, 143-182","scheelite and ferberite; GHS and V of scheelite and V of ferberite are from @RHF78.",https://doi.org/10.2113/gsecongeo.95.1.143
AP01,"J. P. Amend and A. V. Plyasunov",2001,"Geochim. Cosmochim. Acta 65, 3901-3917",carbohydrates,https://doi.org/10.1016/S0016-7037(01)00707-4
AS01,"J. P. Amend and E. L. Shock",2001,"FEMS Microbiol. Rev. 25, 175-243","NO and N<sub>2</sub>O",https://doi.org/10.1111/j.1574-6976.2001.tb00576.x
AS01.1,"J. P. Amend and E. L. Shock",2001,"FEMS Microbiol. Rev. 25, 175-243","selenium and molybdenite",https://doi.org/10.1111/j.1574-6976.2001.tb00576.x
AZ01,"N. N. Akinfiev and A. V. Zotov",2001,"Geochem. Int. 39, 990-1006","M<sup>+</sup>, MCl<sub>2</sub><sup>-</sup>, M(OH)<sub>2</sub><sup>-</sup>, MCl, and MOH (M = Au<sup>+</sup>, Ag<sup>+</sup>, or Cu<sup>+</sup>)",http://pleiades.online/cgi-perl/search.pl?type=abstract&name=geochem&number=10&year=1&page=990
MVT01,"L. Mercury, P. Vieillard. and Y. Tardy",2001,"Appl. Geochem. 16, 161-181","polymorphs of ice",https://doi.org/10.1016/S0883-2927(00)00025-1
PS01,"A. V. Plyasunov and E. L. Shock",2001,"Geochim. Cosmochim. Acta 65, 3879-3900","aqueous nonelectrolytes (organic species)",https://doi.org/10.1016/S0016-7037(01)00678-0
PS01.1,"A. V. Plyasunov and E. L. Shock",2001,"Geochim. Cosmochim. Acta 65, 3879-3900","aqueous nonelectrolytes (Ar, Xe, and CO<sub>2</sub>)",https://doi.org/10.1016/S0016-7037(01)00678-0
Ric01,"L. Richard",2001,"Geochim. Cosmochim. Acta 65, 3827-3877","organic sulfur compounds",https://doi.org/10.1016/S0016-7037(01)00761-X
Ste01,"A. Stefansson",2001,"Chem. Geol. 172, 225-250","aqueous H<sub>4</sub>SiO<sub>4</sub>",https://doi.org/10.1016/S0009-2541(00)00263-1
SSW01,"M. D. Schulte, E. L. Shock and R. H. Wood",2001,"Geochim. Cosmochim. Acta 65, 3919-3930","AsH<sub>3</sub>, CF<sub>4</sub>, CH<sub>3</sub>F, Cl<sub>2</sub>, ClO<sub>2</sub>, N<sub>2</sub>O, NF<sub>3</sub>, NO, PH<sub>3</sub>, and SF<sub>6</sub>",https://doi.org/10.1016/S0016-7037(01)00717-7
TS01,"B. Tagirov and J. Schott",2001,"Geochim. Cosmochim. Acta 65, 3965-3992","aqueous Al<sup>+3</sup> and complexes",https://doi.org/10.1016/S0016-7037(01)00705-0
TS01.1,"B. Tagirov and J. Schott",2001,"Geochim. Cosmochim. Acta 65, 3965-3992","aqueous Al species",https://doi.org/10.1016/S0016-7037(01)00705-0
VPT01,"O. Vidal, T. Parra and F. Trotet",2001,"Am. J. Sci. 301, 557-592","daphnite and Mg-amesite",https://doi.org/10.2475/ajs.301.6.557
GKL02,"R. N. Goldberg et al.",2002,"J. Phys. Chem. Ref. Data 31, 231-370","glycine, diglycine, and triglycine (+1 and -1 ions) GHS",https://doi.org/10.1063/1.1416902
AD03.1,"N. N. Akinfiev and L. W. Diamond",2003,"Geochim. Cosmochim. Acta 67, 613-629","dissolved gas species; parameters estimated from the experimental Henry's constant",https://doi.org/10.1016/S0016-7037(02)01141-9
AD03.2,"N. N. Akinfiev and L. W. Diamond",2003,"Geochim. Cosmochim. Acta 67, 613-629","dissolved gas species; parameters estimated from standard state properties at 25 &deg; C",https://doi.org/10.1016/S0016-7037(02)01141-9
KK03,"R. J. M. Konings and A. Kovács",2003,"Thermodynamic properties of the lanthanide(III) halides, in Handbook on the Physics and Chemistry of Rare Earths","REE chlorides and fluorides",https://doi.org/10.1016/S0168-1273(02)33003-4
MGN03,"J. Majzlan, K.-D. Grevel and A. Navrotsky",2003,"Am. Mineral. 88, 855-859","goethite, lepidocrocite, and maghemite GHS",https://doi.org/10.2138/am-2003-5-614
NA03,"D. K. Nordstrom and D. G. Archer",2003,"Arsenic thermodynamic data and environmental geochemistry. In Arsenic in Groundwater, eds. Welch and Stollenwerk, Kluwer","As oxide and sulfide minerals",
NA03.1,"D. K. Nordstrom and D. G. Archer",2003,"Arsenic thermodynamic data and environmental geochemistry. In Arsenic in Groundwater, eds. Welch and Stollenwerk, Kluwer","aqueous As oxides and sulfides",
MLS+03,"J. Majzlan, B. E. Lang et al.",2003,"Am. Mineral. 88, 846-854","goethite, lepidocrocite, and maghemite Cp",https://doi.org/10.2138/am-2003-5-613
AS04,"J. Apps and N. Spycher",2004,"Data qualification for thermodynamic data used to support THC calculations. Bechtel SAIC Company, LLC. ANL-NBS-HS-000043 REV 00 (DOC.20041118.0004)","aqueous SiO<sub>2</sub>",
Got04,"M. Gottschalk",2004,"Rev. Mineral. Geochem. 56, 83-124","zoisite, clinozoisite, and epidote",https://doi.org/10.2138/gsrmg.56.1.83
MK04,"L. R. Morse and R. J. M. Konings",2004,"Thermochemistry of binary rare earth oxides, in Binary Rare Earth Oxides",Y<sub>2</sub>O<sub>3</sub>,https://doi.org/10.1007/1-4020-2569-6_7
MSB+04,"J. Majzlan, R. Stevens et al.",2004,"Phys. Chem. Mineral. 31, 518-531","hydronium jarosite",https://doi.org/10.1007/s00269-004-0405-z
SR04,"M. D. Schulte and K. L. Rogers",2004,"Geochim. Cosmochim. Acta 68, 1087-1097","alkane thiols",https://doi.org/10.1016/j.gca.2003.06.001
VPV05,"O. Vidal, T. Parra and P. Viellard",2005,"Am. Mineral. 90, 347-358",Fe-amesite,https://doi.org/10.2138/am.2005.1554
ZZX+05,"Y. Zhu et al.",2005,"J. Hazard. Mater. A120, 37-44","barium arsenate and barium hydrogen arsenate: G",https://doi.org/10.1016/j.jhazmat.2004.12.025
OBIGT06,OBIGT,2006,"See CHNOSZ vignette OBIGT.Rmd for more information","non-zero entropy of the electron based on the hydrogen ion convention",https://chnosz.net
ARHB06,"C. Akilan et al.",2006,"ChemPhysChem 7, 2319-2330",MgSO<sub>4</sub>,https://doi.org/10.1002/cphc.200600342
AVZP06,"N. N. Akinfiev et al.",2006,"Geochem. Int. 44, 867-878",AgCl<sub>3</sub><sup>-2</sup>,https://doi.org/10.1134/S0016702906090035
BL06,"A. V. Bandura and S. N. Lvov",2006,"J. Phys. Chem. Ref. Data 35, 15-30",OH<sup>-</sup>,https://doi.org/10.1063/1.1928231
HPT06,"B. Hawrylak, R. Palepu and P. R. Tremaine",2006,"J. Chem. Thermodynamics 38, 988-1007","methyldiethanolamine and methyldiethanolammonium chloride HKF parameters",https://doi.org/10.1016/j.jct.2005.10.013
LH06a,"D. E. LaRowe and H. C. Helgeson",2006,"Geochim. Cosmochim. Acta 70, 4680-4724","nucleic acid bases, nucleosides, and nucleotides",https://doi.org/10.1016/j.gca.2006.04.010
LH06a.1,"D. E. LaRowe and H. C. Helgeson",2006,"Geochim. Cosmochim. Acta 70, 4680-4724","citric acid and citrate",https://doi.org/10.1016/j.gca.2006.04.010
LH06b,"D. E. LaRowe and H. C. Helgeson",2006,"Thermochim. Acta 448, 82-106","Mg-complexed adenosine nucleotides (ATP), NAD, and NADP",https://doi.org/10.1016/j.tca.2006.06.008
LH06b.1,"D. E. LaRowe and H. C. Helgeson",2006,"Thermochim. Acta 448, 82-106","pyridine and piperidine",https://doi.org/10.1016/j.tca.2006.06.008
DLH06,"J. M. Dick, D. E. LaRowe and H. C. Helgeson",2006,"Biogeosciences 3, 311-336","amino acid, protein, and organic groups",https://doi.org/10.5194/bg-3-311-2006
DLH06.1,"J. M. Dick, D. E. LaRowe and H. C. Helgeson",2006,"Biogeosciences 3, 311-336","amino acids HKF parameters",https://doi.org/10.5194/bg-3-311-2006
DLH06.2,"J. M. Dick, D. E. LaRowe and H. C. Helgeson",2006,"Biogeosciences 3, 311-336","Gly-X-Gly tripeptides Cp, V, and HKF c<sub>1</sub>, c<sub>2</sub>, &omega; parameters",https://doi.org/10.5194/bg-3-311-2006
DLH06.3,"J. M. Dick, D. E. LaRowe and H. C. Helgeson",2006,"Biogeosciences 3, 311-336","glycine, [Gly], and [UPBB] HKF parameters",https://doi.org/10.5194/bg-3-311-2006
DLH06.4,"J. M. Dick, D. E. LaRowe and H. C. Helgeson",2006,"Biogeosciences 3, 311-336","methionine HKF parameters",https://doi.org/10.5194/bg-3-311-2006
DLH06.5,"J. M. Dick, D. E. LaRowe and H. C. Helgeson",2006,"Biogeosciences 3, 311-336","triglycine Cp, V, and HKF c<sub>1</sub>, c<sub>2</sub>, &omega; parameters",https://doi.org/10.5194/bg-3-311-2006
LEB+06,"W. Liu et al.",2006,"Chem. Geol. 231, 326-349","FeCl<sub>2</sub><sup>+</sup>, FeCl<sub>3</sub>, FeCl<sub>4</sub><sup>-</sup>",https://doi.org/10.1016/j.chemgeo.2006.02.005
LMR06,"D. Langmuir et al.",2006,"Geochim. Cosmochim. Acta 70, 2942-2956","scorodite and amorphous ferric arsenate: G",https://doi.org/10.1016/j.gca.2006.03.006
MNM+06,"J. Majzlan, A. Navrotsky et al.",2006,"Eur. J. Mineral. 18, 175-186","coquimbite, ferricopiapite, and rhomboclase",https://doi.org/10.1127/0935-1221/2006/0018-0175
PK06,"K. Popa and R. J. M. Konings",2006,"Thermochim. Acta 445, 49-52","REE phosphates (monazites) [different G than @MWBC16]",https://doi.org/10.1016/j.tca.2006.03.023
SGX+06,"A. V. Sharygin et al.",2006,"Geochim. Cosmochim. Acta 70, 5169-5182",KSO<sub>4</sub><sup>-</sup>,https://doi.org/10.1016/j.gca.2006.07.034
Dic07,"J. M. Dick",2007,"Ph.D. Dissertation, Univ. of California","glutathione, cystine, and cystine sidechain",
MA07,"L. Marini and M. Accornero",2007,"Environ. Geol. 52, 1343-1363","metal arsenate and arsenite complexes; linked to properties of arsenate and arsenite from @SSWS97",https://doi.org/10.1007/s00254-006-0578-5
SLOP07.1,"E. L. Shock et al.",2007,"slop07.dat computer data file","corrected charge of Pu(Oxal)<sup>+2</sup>",https://doi.org/10.5281/zenodo.2630820
SLOP07.2,"E. L. Shock et al.",2007,"slop07.dat computer data file","high temperature HKF parameters from @AP01",https://doi.org/10.5281/zenodo.2630820
ZW07,"S. P. Ziemer and E. M. Woolley",2007,"J. Chem. Thermodynamics 39, 645-666",glutamate,https://doi.org/10.1016/j.jct.2006.08.008
PPB+08,"E. Perfetti et al.",2008,"Geochim. Cosmochim. Acta 72, 713-731","arsenopyrite, loellingite, and westerveldite",https://doi.org/10.1016/j.gca.2007.11.017
PPB+08.1,"E. Perfetti et al.",2008,"Geochim. Cosmochim. Acta 72, 713-731","As(OH)<sub>3</sub> and AsO(OH)<sub>3</sub>",https://doi.org/10.1016/j.gca.2007.11.017
Ric08,"L. Richard",2008,"personal communication",alkenes,
Shv08,"Y. V. Shvarov",2008,"Geochem. Int. 46, 834-839","Co(OH)<sub>2</sub>",https://doi.org/10.1134/s0016702908080089
GM09,"K.-D. Grevel and J. Majzlan",2009,"Geochim. Cosmochim. Acta 73, 6805-6815","kieserite, starkeyite, hexahydrite, and epsomite",https://doi.org/10.1016/j.gca.2009.08.005
HRMNS09,"H. C. Helgeson, L. Richard et al.",2009,"Geochim. Cosmochim. Acta 73, 594-695","kerogens (C128, C292, C406, C415, C515) and pyrobitumen (C<sub>54</sub>H<sub>42</sub>)",https://doi.org/10.1016/j.gca.2008.03.004
LRB09,"K. H. Lemke, R. J. Rosenbauer and D. K. Bird",2009,"Astrobiology 9, 141-146","diglycine and diketopiperazine",https://doi.org/10.1089/ast.2008.0166
MWW09,"A. A. Migdisov, A. E. Williams-Jones and T. Wagner",2009,"Geochim. Cosmochim. Acta 73, 7087-7109","REE F<sup>-</sup> and Cl<sup>-</sup> complexes",https://doi.org/10.1016/j.gca.2009.08.023
JSW09,"K. T. Jacob et al.",2009,"J. Chem. Thermodynamics 41, 748-753",beta-Ta<sub>2</sub>O<sub>5</sub>,https://doi.org/10.1016/j.jct.2008.12.006
BZA10,"E. F. Bazarkina, A. V. Zotov and N. N. Akinfiev",2010,"Geol. Ore Deposits 52, 167-178","Cd chloride complexes",https://doi.org/10.1134/S1075701510020054
AML10,"M. Accornero, L. Marini and M. Lelli",2010,"Appl. Geochem. 25, 242-260","metal chromate complexes",https://doi.org/10.1016/j.apgeochem.2009.11.010
AML10.1,"M. Accornero, L. Marini and M. Lelli",2010,"Appl. Geochem. 25, 242-260","Np and Am chromate complexes",https://doi.org/10.1016/j.apgeochem.2009.11.010
AZ10,"N. N. Akinfiev and A. V. Zotov",2010,"Geochem. Int. 48, 714-720","MHS and M(HS)<sub>2</sub><sup>-</sup> (M = Au<sup>+</sup>, Ag<sup>+</sup>, or Cu<sup>+</sup>)",https://doi.org/10.1134/S0016702910070074
DS10,"J. Delgado Martin and A. Soler i Gil",2010,"Eur. J. Mineral. 22, 363-380","hedenbergite, andradite, ferro-actinolite, grunerite, and ilvaite",https://doi.org/10.1127/0935-1221/2010/0022-2021
MA10,"L. Marini and M. Accornero",2010,"Environ. Earth Sci. 59, 1601-1606","corrected values",https://doi.org/10.1007/s12665-009-0369-x
Sch10,"M. Schulte",2010,"Aquat. Geochem. 16, 621-637","organic sulfides",https://doi.org/10.1007/s10498-010-9102-3
LBT+11,"W. Liu et al.",2011,"Geochim. Cosmochim. Acta 75, 1227-1248","Co chloride complexes",https://doi.org/10.1016/j.gca.2010.12.002
MMO+11,"J. Málek, T. Mitsuhashi et al.",2011,"J. Chem. Thermodynamics 43, 405-409","GeS<sub>2</sub> (alpha)",https://doi.org/10.1016/j.jct.2010.10.011
RG11,"L. Richard and X. Gaona",2011,"Geochim. Cosmochim. Acta 75, 7304-7350","organic iodine compounds",https://doi.org/10.1016/j.gca.2011.07.030
LD12,"D. E. LaRowe and J. M. Dick",2012,"Geochim. Cosmochim. Acta 80, 70-91","4-hydroxyproline, 5-hydroxylysine, 4 dipeptides, and sidechain and backbone groups in proteins",https://doi.org/10.1016/j.gca.2011.11.041
LD12.1,"D. E. LaRowe and J. M. Dick",2012,"Geochim. Cosmochim. Acta 80, 70-91","updated and corrected parameters for cysteine, glycine, leucine, and methionine",https://doi.org/10.1016/j.gca.2011.11.041
LD12.2,"D. E. LaRowe and J. M. Dick",2012,"Geochim. Cosmochim. Acta 80, 70-91","methionine GHS",https://doi.org/10.1016/j.gca.2011.11.041
LD12.3,"D. E. LaRowe and J. M. Dick",2012,"Geochim. Cosmochim. Acta 80, 70-91","methionine sidechain GHS",https://doi.org/10.1016/j.gca.2011.11.041
DEH+13,"J. M. Dick, K. A. Evans et al.",2013,"Geochim. Cosmochim. Acta 122, 247-266","phenanthrene and methylphenanthrene isomers",https://doi.org/10.1016/j.gca.2013.08.020
LMW+13,"A. Loges, A. A. Migdisov et al.",2013,"Geochim. Cosmochim. Acta 123, 403-415","YF<sup>+2</sup> and YF<sub>2</sub><sup>+</sup>",https://doi.org/10.1016/j.gca.2013.07.031
SBS13,"A. Stefánsson, P. Benézéth and J. Schott",2013,"Geochim. Cosmochim. Acta 120, 600-611",NaCO<sub>3</sub><sup>-</sup>,https://doi.org/10.1016/j.gca.2013.04.023
TBZ+13,"B. R. Tagirov et al.",2013,"Geochim. Cosmochim. Acta 117, 348-373","Pd<sup>+2</sup> and complexes",https://doi.org/10.1016/j.gca.2013.03.047
AP14,"N. N. Akinfiev and A. V. Plyasunov",2014,"Geochim. Cosmochim. Acta 126, 338-351","B(OH)<sub>3</sub>, Si(OH)<sub>4</sub>, and As(OH)<sub>3</sub>",https://doi.org/10.1016/j.gca.2013.11.013
AT14,"N. N. Akinfiev and B. R. Tagirov",2014,"Geochem. Int. 52, 197-214","Zn<sup>+2</sup> and complexes",https://doi.org/10.1134/S0016702914030021
FDM+14,"S. Facq et al.",2014,"Geochim. Cosmochim. Acta 132, 375-390","CO<sub>2</sub>, HCO<sub>3</sub><sup>-</sup>, CO<sub>3</sub><sup>-2</sup>, CaCO<sub>3</sub>, Ca<sup>+2</sup>",https://doi.org/10.1016/j.gca.2014.01.030
FDM+14.1,"S. Facq et al.",2014,"Geochim. Cosmochim. Acta 132, 375-390","aragonite; source of data: `berman.dat`",https://doi.org/10.1016/j.gca.2014.01.030
Kit14,"N. Kitadai",2014,"J. Mol. Evol. 78, 171-187","glycine, diglycine, and triglycine (zwitterions and ions); diketopiperazine, [Gly] and [UPBB] groups",https://doi.org/10.1007/s00239-014-9616-1
KBK+14,"R. J. M. Konings et al.",2014,"J. Phys. Chem. Ref. Data 43, Article 013101","REE oxides",https://doi.org/10.1063/1.4825256
PAB+14,"G. S. Pokrovski, N. N. Akinfiev et al., 2014",2014,"Geol. Soc. Spec. Publ. 402, 9-70","corrected H of AuHS",https://doi.org/10.1144/SP402.4
SBS14,"A. Stefánsson, P. Benézéth and J. Schott",2014,"Geochim. Cosmochim. Acta 138, 21-31",Mg(HCO<sub>3</sub>)<sup>+</sup>,https://doi.org/10.1016/j.gca.2014.04.008
SHA14,"D. A. Sverjensky et al.",2014,"Geochim. Cosmochim. Acta 129, 125-145","SiO<sub>2</sub> and Si<sub>2</sub>O<sub>4</sub>",https://doi.org/10.1016/j.gca.2013.12.019
SHA14.1,"D. A. Sverjensky et al.",2014,"Geochim. Cosmochim. Acta 129, 125-145","revisions for AlO<sub>2</sub><sup>-</sup> and HAlO<sub>2</sub>",https://doi.org/10.1016/j.gca.2013.12.019
SHA14.2,"D. A. Sverjensky et al.",2014,"Geochim. Cosmochim. Acta 129, 125-145","BO(OH): Revised May 2013",https://doi.org/10.1016/j.gca.2013.12.019
SHA14.3,"D. A. Sverjensky et al.",2014,"Geochim. Cosmochim. Acta 129, 125-145","Fitted to @HP97 data with a<sub>1</sub> pred. from the sum of the ions and used to predict the volume",https://doi.org/10.1016/j.gca.2013.12.019
SHA14.4,"D. A. Sverjensky et al.",2014,"Geochim. Cosmochim. Acta 129, 125-145","BO<sub>2</sub><sup>-</sup>: revised a<sub>1</sub>-a<sub>4</sub> using delkappan for BO<sub>2</sub><sup>-</sup> instead of B(OH)<sub>4</sub><sup>-</sup> used by @SH88; @SSWS97",https://doi.org/10.1016/j.gca.2013.12.019
GHFW16,"A. P. Gysi et al.",2016,"Thermochim. Acta 627-629, 61-67","REE phosphates (xenotimes) [different S for DyPO<sub>4</sub> than @MWBC16]",https://doi.org/10.1016/j.tca.2016.01.016
Kit15,"N. Kitadai",2015,"Origins Life Evol. Biospheres 45, 377-409","charged amino acids",https://doi.org/10.1007/s11084-015-9428-3
Kit15.1,"N. Kitadai",2015,"Origins Life Evol. Biospheres 45, 377-409","charged amino acids GHS (Arg<sup>+</sup>, Arg<sup>-</sup>, Asp<sup>-</sup>, Glu<sup>-</sup>, His<sup>+</sup>, Lys<sup>+</sup>, Lys<sup>-</sup>, and Tyr<sup>-</sup>)",https://doi.org/10.1007/s11084-015-9428-3
NLM+15,"A. Navrotsky et al.",2015,"J. Chem. Thermodyn.","REE phosphates (xenotimes) [different G than @MWBC16]",https://doi.org/10.1016/j.jct.2015.04.008
PD15,"G. S. Pokrovski and J. Dubessy",2015,"Earth Planet. Sci. Lett. 411, 298-309","trisulfur radical ion",https://doi.org/10.1016/j.epsl.2014.11.035
LA16,"D. E. LaRowe and J. P. Amend",2016,"ISME J. 10, 1285-1295","fatty acids, saccharides, and other species",https://doi.org/10.1038/ismej.2015.227
MWBC16,"A. A. Migdisov et al.",2016,"Chem. Geol. 439, 13-42","data compilation for REE minerals with modifications for OBIGT",https://doi.org/10.1016/j.chemgeo.2016.06.005
SLOP16.1,"E. L. Shock et al.",2016,"slop16.dat computer data file","&quot;Enthalpy changed to be compatible with the equation &Delta;H=&Delta;G+T&Delta;S for the formation reaction from elements.&quot;",https://doi.org/10.5281/zenodo.2630820
SLOP16.2,"E. L. Shock et al.",2016,"slop16.dat computer data file","Zn(Ac)<sub>3</sub><sup>-</sup>: &quot;Enthalpy changed to be compatible with the equation &Delta;H=&Delta;G+T&Delta;S for the formation reaction from elements. See footnote h in table 2 of @SSH97.&quot;",https://doi.org/10.5281/zenodo.2630820
SLOP16.3,"E. L. Shock et al.",2016,"slop16.dat computer data file","formaldehyde: &quot;Entropy corrected to be compatible with the equation &Delta;H=&Delta;G+T&Delta;S for the formation reaction from elements. See footnote i in table 2 of @SS93.&quot;",https://doi.org/10.5281/zenodo.2630820
SLOP16.4,"E. L. Shock et al.",2016,"slop16.dat computer data file","adipic acid and n-dodecanoate: &quot;Gibbs free energy corrected to be compatible with the equation &Delta;G=&Delta;H-T&Delta;S for the formation reaction from elements. See footnote y in table 4 of @Sho95.&quot;",https://doi.org/10.5281/zenodo.2630820
SLOP16.5,"E. L. Shock et al.",2016,"slop16.dat computer data file","n-octanoate: &quot;Enthalpy corrected to be compatible with the equation &Delta;G=&Delta;H-T&Delta;S for the formation reaction from elements. See footnote ab in table 4 of @Sho95.&quot;",https://doi.org/10.5281/zenodo.2630820
SLOP16.6,"E. L. Shock et al.",2016,"slop16.dat computer data file","&quot;Enthalpy corrected to be compatible with the equation &Delta;G=&Delta;H-T&Delta;S for the formation reaction from elements.&quot;",https://doi.org/10.5281/zenodo.2630820
SLOP16.7,"E. L. Shock et al.",2016,"slop16.dat computer data file","hexanol, heptanol, and octanol: &quot;Minor differences in Gibbs energy, entropy, &omega;, a<sub>1</sub>, a<sub>2</sub>, a<sub>3</sub>, a<sub>4</sub> and c<sub>1</sub> values compared to @SH90.&quot;",https://doi.org/10.5281/zenodo.2630820
TBB15,"B. R. Tagirov et al.",2015,"Geochem. Int. 53, 327-340","Pt<sup>+2</sup> and complexes",https://doi.org/10.1134/S0016702915040084
CS16,"P. A. Canovas III and E. L. Shock",2016,"Geochim. Cosmochim. Acta 195, 293-322","citric acid cycle metabolites",https://doi.org/10.1016/j.gca.2016.08.028
CS16.1,"P. A. Canovas III and E. L. Shock",2016,"Geochim. Cosmochim. Acta 195, 293-322","citric acid species HKF a<sub>1</sub>--a<sub>4</sub> parameters",https://doi.org/10.1016/j.gca.2016.08.028
MWKH16,"G. D. Miron et al.",2016,"Geochim. Cosmochim. Acta 187, 41-78","aqueous NaCl, NaOH, KCl, KOH, and HCl based on new conductance experiments",https://doi.org/10.1016/j.gca.2016.04.026
MWKH16.1,"G. D. Miron et al.",2016,"Geochim. Cosmochim. Acta 187, 41-78","Al(OH)<sub>3</sub> and HSiO<sub>3</sub><sup>-</sup> derived from literature data",https://doi.org/10.1016/j.gca.2016.04.026
ZZL+16,"K. Zimmer et al.",2016,"Comp. Geosci. 90, 97-111","data listed in spronsbl.dat",https://doi.org/10.1016/j.cageo.2016.02.013
ZZL+16.1,"K. Zimmer et al.",2016,"Comp. Geosci. 90, 97-111","As(&alpha;): V listed in spronsbl.dat",https://doi.org/10.1016/j.cageo.2016.02.013
ZZL+16.2,"K. Zimmer et al.",2016,"Comp. Geosci. 90, 97-111","Cp parameters listed in spronsbl.dat",https://doi.org/10.1016/j.cageo.2016.02.013
ZZL+16.3,"K. Zimmer et al.",2016,"Comp. Geosci. 90, 97-111","dawsonite GHS",https://doi.org/10.1016/j.cageo.2016.02.013
Bla17,"P. Blanc",2017,"Thermoddem: Update for the 2017 version","monteponite, Cd(OH)<sub>2</sub>, CdSO<sub>4</sub>, otavite, and GaOOH",https://thermoddem.brgm.fr/page/brgm-reports
Bla17.1,"P. Blanc",2017,"Thermoddem: Update for the 2017 version","Ga hydroxide complexes",https://thermoddem.brgm.fr/page/brgm-reports
LCT17,"A. R. Lowe, J. S. Cox and P. R. Tremaine",2017,"J. Chem. Thermodynamics 112, 129-145","adenine HKF parameters",https://doi.org/10.1016/j.jct.2017.04.005
DEW17.01,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","(acetic acid, glycine, methanol, propanoic acid, propanol: parameters in DEW spreadsheet are the same as in @PS01)",http://www.dewcommunity.org
DEW17.02,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","(ethanol: parameters in DEW spreadsheet are different from @PS01; no comment provided)",http://www.dewcommunity.org
DEW17.03,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","(parameters in DEW spreadsheet are the same as in @FDM+14)",http://www.dewcommunity.org
DEW17.04,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","(Ar, Xe: parameters in DEW spreadsheet are the same as in @SHS89)",http://www.dewcommunity.org
DEW17.05,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","(Al<sup>+3</sup>: parameters in DEW spreadsheet are the same as in @SSWS97)",http://www.dewcommunity.org
DEW17.1,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","revised with new predicted a<sub>1</sub> for ions",http://www.dewcommunity.org
DEW17.2,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","revised with new predicted a<sub>1</sub> for cations",http://www.dewcommunity.org
DEW17.201,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","revised with new predicted a<sub>1</sub> for cations [corrected H for In<sup>+3</sup>; @OBIGT25]",http://www.dewcommunity.org
DEW17.3,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","revised with new predicted a<sub>1</sub> for complex species",http://www.dewcommunity.org
DEW17.4,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","revised with a<sub>1</sub> equal to the sum of the ions",http://www.dewcommunity.org
DEW17.5,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","BaCl<sup>+</sup>, CaCl<sup>+</sup>, CaCl<sup>2</sup>: with new V from the sum of a<sub>1</sub> values of ions",http://www.dewcommunity.org
DEW17.6,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","revised volume increased in order that a<sub>1</sub> of the complex is the sum of the a<sub>1</sub> values of the ions",http://www.dewcommunity.org
DEW17.7,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","acetate: revised January 26th, 2016; new a<sub>1</sub> value from complexes and organics correlation",http://www.dewcommunity.org
DEW17.10,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","CaSO<sub>4</sub>: revised using exptl V and pred. a<sub>1</sub> from new correlation",http://www.dewcommunity.org
DEW17.11,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","diglycine: Jamie & Dimitri fit to exptl Cp(T) and pred. a<sub>1</sub>-a<sub>4</sub>; delGf and S from fitting logK dimerisation values from @LRB09",http://www.dewcommunity.org
DEW17.12,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","diketopiperazine: Jamie & Dimitri fit delGf and S from to logK dimerisation values from @LRB09;  pred. a<sub>1</sub>-a<sub>4</sub>",http://www.dewcommunity.org
DEW17.13,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","FeOH<sup>+</sup>, FeO, HFeO<sub>2</sub><sup>-</sup>: 31/1/17: V from estimate to have similar behavior to MgO,aq",http://www.dewcommunity.org
DEW17.14,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","29/11/16: Fit to @TDDZ00 with revised volume increased in order that a<sub>1</sub> of the complex a bit greater than the sum of the a<sub>1</sub> values of the ions",http://www.dewcommunity.org
DEW17.15,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","FeCl<sub>2</sub><sup>+</sup>, FeCl<sub>4</sub><sup>-</sup>: 29/11/16: Fit to @LEB+06 with revised volume increased in order that a<sub>1</sub> of the complex a bit greater than the sum of the a<sub>1</sub> values of the ions",http://www.dewcommunity.org
DEW17.16,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","FeCl<sub>3</sub>: 29/11/16: Fit to @LEB+06 with revised volume increased in order that a<sub>1</sub> of the complex is equal to the sum of the a<sub>1</sub> values of the ions",http://www.dewcommunity.org
DEW17.17,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","Revised 1/22/15 based on V at 25 C from @ZW07 and predicted a<sub>1</sub>, a<sub>2</sub>, and a<sub>4</sub>; c<sub>1</sub> and c<sub>2</sub> from fits to delCpr protonation of @ZW07; S from fitting temperature dependence of logK from @ZW07; omega predicted from S using ion correlation.",http://www.dewcommunity.org
DEW17.18,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","Revised 1/22/15 based on fitting Cp and V vs T data from @HDM+94 + revised correlation for a<sub>1</sub> from @SHA14; omega from delCPr above 100 &deg;C [@ZW07]; G, H, and S from @AH97b",http://www.dewcommunity.org
DEW17.19,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","Regression of @RS87 & @TZA97 with new full correlations",http://www.dewcommunity.org
DEW17.21,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","HSO<sub>3</sub><sup>-</sup>: revised using published estimated V and pred. a<sub>1</sub> from new correlation",http://www.dewcommunity.org
DEW17.22,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","isobutane: G, H, S, Cp, V from @SH90; a<sub>1</sub> estimated with @SHA14; c<sub>2</sub> estimated with a new hydrocarbon correlation.",http://www.dewcommunity.org
DEW17.23,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","May, 2017 Fitted to logKs from @OH88 + retrieved logKs from Hemley experiments at 1.0 kb using the HCl referred to above",http://www.dewcommunity.org
DEW17.25,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","Revised G, S and Cp to fit @Noy07 & @SGX+06 with a<sub>1</sub> of the complex equal to the sum of the a<sub>1</sub> values of the ions",http://www.dewcommunity.org
DEW17.26,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","Fit to @SBS14 & @SH77; plus revised V increased so that a<sub>1</sub> of the complex is the sum of the a<sub>1</sub> values of the ions",http://www.dewcommunity.org
DEW17.27,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","MgCO<sub>3</sub>: @SSH97 revised volume increased in order that a<sub>1</sub> of the complex is the sum of the a<sub>1</sub> values of the ions; and Cp revised using isocoulombic reln with CaCO<sub>3</sub>,aq; also omega is set to +0.3 as for all neutral metal complexes.",http://www.dewcommunity.org
DEW17.29,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","S, Cp, V, omega from fit to @ARHB06 and @FDM94",http://www.dewcommunity.org
DEW17.30,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","NaCO<sub>3</sub><sup>-</sup>: Fit to @SBS13 (80 to 200 C) & @GTS61 (at 25 C) to get G, S and Cp;  with a<sub>1</sub> pred. from the sum of the ions and used to predict the volume",http://www.dewcommunity.org
DEW17.32,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","NaOH: Fitted to @HP97 data with a<sub>1</sub> pred. from the sum of the ions and used to predict the volume",http://www.dewcommunity.org
DEW17.33,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","August 16th, 2013 fit to @BL06",http://www.dewcommunity.org
DEW17.34,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","propane: @SH90 with new a<sub>1</sub>-a<sub>4</sub> based on revised correlation to predict a<sub>1</sub> in Sverjensky et al. (2013)",http://www.dewcommunity.org
DEW17.35,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","propanoate: Revised a<sub>1</sub> from new delVn correlation for -1 ions",http://www.dewcommunity.org
DEW17.36,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","S<sub>3</sub><sup>-</sup>: Regression of data from @PD15; Feb. 2015",http://www.dewcommunity.org
DEW17.37,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","fit to Raman speciation and quartz solubility data",http://www.dewcommunity.org
DEW17.38,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","SO<sub>2</sub>: @SHS89 with revised a<sub>1</sub> predicted as a complex from delVn",http://www.dewcommunity.org
DEW17.39,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","toluene: @PS01 with new a<sub>1</sub> to a<sub>4</sub> predicted with revised a<sub>1</sub> consistent with @SHA14",http://www.dewcommunity.org
DEW17.40,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","urea: Revised Feb. 2015 by Dimitri: c<sub>1</sub>, c<sub>2</sub>, and omega from PS01 based on Stokes (1967) data; V from Cabani et al. (1981) with a<sub>1</sub>-a<sub>4</sub> predicted.",http://www.dewcommunity.org
DEW17.101,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","formate and lactate: revised with new predicted a<sub>1</sub> for ions",https://doi.org/10.1016/0016-7037(90)90429-O
BDat17.1,"D. A. Sverjensky et al.",2017,"berman.dat file in SUPCRT92b.zip on the DEW website","antigorite: &quot;Oct. 21, 2016: Revised volume coefficients consistent with @HDR06 and @YIY+14 &quot;",http://www.dewcommunity.org/resources.html
MWKL17,"G. D. Miron et al.",2017,"Am. J. Sci. 317, 755-806","aqueous species in the system Ca-Mg-Na-K-Al-Si-O-H-C-Cl",https://doi.org/10.2475/07.2017.01
MWKL17.1,"G. D. Miron et al.",2017,"Am. J. Sci. 317, 755-806","&Delta;G&deg;<sub>f</sub> values",https://doi.org/10.2475/07.2017.01
AKAE19,"M. R. Azadi et al.",2019,"Fluid Phase Equilib. 480, 25-40","metal glycinate complexes",https://doi.org/10.1016/j.fluid.2018.10.002
DEW19,"D. A. Sverjensky et al.",2019,"Deep Earth Water (DEW) spreadsheet","(values listed in DEW spreadsheet)",http://www.dewcommunity.org
DEW19.1,"D. A. Sverjensky et al.",2019,"Deep Earth Water (DEW) spreadsheet","(values from @HS19 listed in DEW spreadsheet)",http://www.dewcommunity.org
DEW19.2,"D. A. Sverjensky et al.",2019,"Deep Earth Water (DEW) spreadsheet","MgOH<sup>+</sup>: Revised by Dimitri, January, 2019; with minimum volume needed",http://www.dewcommunity.org
DEW19.3,"D. A. Sverjensky et al.",2019,"Deep Earth Water (DEW) spreadsheet","CaO: Fitted by Dimitri to high PT retrievals from Fang",http://www.dewcommunity.org
DEW19.4,"D. A. Sverjensky et al.",2019,"Deep Earth Water (DEW) spreadsheet","glycinate: @AH97b for the G, H, S, Cp, V",http://www.dewcommunity.org
DEW19.5,"D. A. Sverjensky et al.",2019,"Deep Earth Water (DEW) spreadsheet","(Ca<sup>+2</sup>: values listed in DEW spreadsheet)",http://www.dewcommunity.org
DEW19.6,"D. A. Sverjensky et al.",2019,"Deep Earth Water (DEW) spreadsheet","(Fe<sup>+2</sup>: HKF a<sub>1</sub>-a<sub>4</sub> parameters taken from @HS19, which are different from 2019 DEW spreadsheet)",http://www.dewcommunity.org
HS19,"F. Huang and D. A. Sverjensky",2019,"Geochim. Cosmochim. Acta 254, 192-230","ions and metal complexes",https://doi.org/10.1016/j.gca.2019.03.027
LA19,"D. E. LaRowe and J. P. Amend",2019,"Geomicrobiol. J. 36, 492-505","dimethylamine, trimethylamine, resorcinol, phloroglucinol, cyclohexane carboxylate, and cyclohexane carboxylic acid",https://doi.org/10.1080/01490451.2019.1573278
SPD+19,"B. St Clair et al.",2019,"ACS Earth Space Chem 3, 905-921","metal carbonate and bicarbonate complexes and FeSO<sub>4</sub>",https://doi.org/10.1021/acsearthspacechem.9b00016
AKK+20,"N. N. Akinfiev et al.",2020,"Geochim. Cosmochim. Acta 280, 102-115","Nb and Ta species",https://doi.org/10.1016/j.gca.2020.04.009
AKK+20.1,"N. N. Akinfiev et al.",2020,"Geochim. Cosmochim. Acta 280, 102-115","V of beta-Ta<sub>2</sub>O<sub>5</sub>",https://doi.org/10.1016/j.gca.2020.04.009
AKK+20.2,"N. N. Akinfiev et al.",2020,"Geochim. Cosmochim. Acta 280, 102-115","V of beta-Nb<sub>2</sub>O<sub>5</sub>",https://doi.org/10.1016/j.gca.2020.04.009
LS20,"J. A. M. Leong and E. L. Shock",2020,"Am. J. Sci. 320, 185-235","Fe-bearing serpentinization-relevant minerals",https://doi.org/10.2475/03.2020.01
LX20,"X. Liu and C. Xiao",2020,"Ore Geol. Rev. 117, 103289","huebnerite Cp",https://doi.org/10.1016/j.oregeorev.2019.103289
NEA20,"Grenthe et al.",2020,"Second Update on the Chemical Thermodynamics of Uranium, Neptunium, Plutonium, Americium and Technetium","uranium, uraninite (UO<sub>2</sub>), beta-UO<sub>2.25</sub>, UO<sub>2.25</sub>, alpha-UO<sub>2.3333</sub>, beta-UO<sub>2.3333</sub>, UO<sub>2.6667</sub>, gamma-UO<sub>3</sub>, rutherfordine (UO</sub>2</sub>CO<sub>3</sub>), beta-UO<sub>2</sub>(OH)<sub>2</sub>, and Na<sub>2</sub>U<sub>2</sub>O<sub>7</sub>",https://doi.org/10.1787/bf86a907-en
NEA20.1,"Grenthe et al.",2020,"Second Update on the Chemical Thermodynamics of Uranium, Neptunium, Plutonium, Americium and Technetium",UO<sub>3</sub>,https://doi.org/10.1787/bf86a907-en
LXW21,"X. Liu, C. Xiao and Y. Wang",2021,"Chem. Geol. 584, 120488",H<sub>2</sub>WO<sub>4</sub>,https://doi.org/10.1016/j.chemgeo.2021.120488
LXW21.1,"X. Liu, C. Xiao and Y. Wang",2021,"Chem. Geol. 584, 120488","scheelite Cp",https://doi.org/10.1016/j.chemgeo.2021.120488
WV22,"A. E. Williams-Jones and O. V. Vasyukova",2022,"Econ. Geol. 117, 513-528","data compilation for Co minerals",https://doi.org/10.5382/econgeo.4895
BS23,"G. Boyer and E. Shock",2023,"The Complicator (prototype) (v0.0.2)","In complexes; corrected H [@OBIGT25]",https://doi.org/10.5281/zenodo.8206644
AZ23,"N. N. Akinfiev and A. V. Zotov",2023,"Geol. Ore Deposits 65, 1-10","Cu<sup>+</sup> and CuO<sup>-</sup>",https://doi.org/10.1134/S1075701523010026
LYX23,"X. Liu, P. Yu and C. Xiao",2023,"Geosci. Front. 14, 101624","Sn<sup>+2</sup>, Th<sup>+4</sup>, and Sn chloride complexes",https://doi.org/10.1016/j.gsf.2023.101624
TTA+23,"N. D. Trofimov, B. R. Tagirov et al.",2023,"Chem. Geol. 625, 121413","Cu hydrosulfide and chloride complexes",https://doi.org/10.1016/j.chemgeo.2023.121413
HDR+24,"B. P. von der Heyden et al.",2024,"Can. J. Mineral. Petrol. 62, 77-93",carrollite,https://doi.org/10.3749/2300028
HET+24,"B. Hu, B. Etschmann et al.",2024,"Geochim. Cosmochim. Acta","Ta(OH)<sub>3</sub>F<sub>3</sub><sup>-</sup> and TaF<sub>7</sub><sup>-2</sup>",https://doi.org/10.1016/j.gca.2024.10.019
HB24,"D. L. Huston and E. Bastrakov",2024,"Aust. J. Earth Sci. 71, 1125-1155","data compilation for Cd, Ga, Ge, and In minerals and aqueous species",https://doi.org/10.1080/08120099.2024.2423772
HB24.1,"D. L. Huston and E. Bastrakov",2024,"Aust. J. Earth Sci. 71, 1125-1155","Ga sulfate complexes [algorithms based on @SSH97]",https://doi.org/10.1080/08120099.2024.2423772
HB24.2,"D. L. Huston and E. Bastrakov",2024,"Aust. J. Earth Sci. 71, 1125-1155","In sulfate complexes [algorithms based on @SSH97]; corrected H [@OBIGT25]",https://doi.org/10.1080/08120099.2024.2423772
KBJ24,"A. W. Knight, C. R. Bryan and C. F. Jové-Colón",2024,"Appl. Geochem. 169, 106032","Mg(OH)<sub>2</sub>-MgCl<sub>2</sub>-H<sub>2</sub>O phases",https://doi.org/10.1016/j.apgeochem.2024.106032
LBP24,"C. Laksar et al.",2024,"Geochim. Cosmochim. Acta","Pd(HS)<sub>4</sub><sup>-2</sup> and Pt(HS)<sub>4</sub><sup>-2</sup>",https://doi.org/10.1016/j.gca.2024.12.019
MBA+24,"A. Migdisov, E. Bastrakov et al.",2024,"Geochim. Cosmochim. Acta","uranyl carbonate, chloride, sulfate, and hydroxide complexes",https://doi.org/10.1016/j.gca.2024.04.023
RSS+24,"K. Robinson et al.",2024,"Geochim. Cosmochim. Acta 372, 62-80","alkylamines, benzylamines, and aminiums",https://doi.org/10.1016/j.gca.2024.03.013
RSS+24.1,"K. Robinson et al.",2024,"Geochim. Cosmochim. Acta 372, 62-80","corrected V for tripropylaminium",https://doi.org/10.1016/j.gca.2024.03.013
TAT+24,"B. R. Tagirov, N. N. Akinfiev et al.",2024,"Geochim. Cosmochim. Acta","Au-(hydro)sulfide species and SO<sub>4</sub><sup>-2</sup>-bearing species",https://doi.org/10.1016/j.gca.2024.08.022
TAZ24,"B. R. Tagirov, N. N. Akinfiev and A. V. Zotov",2024,"Geol. Ore Deposits 66, 581--597","Au hydroxide and chloride complexes",https://doi.org/10.1134/S1075701524600403
OBIGT25,OBIGT,2025,"OBIGT database in CHNOSZ","corrected H by -7335 cal/mol to maintain GHS consistency for In<sup>+3</sup> and derived species",https://chnosz.net
OBIGT.1,"J. M. Dick",2017,"OBIGT database in CHNOSZ","GHS (T<sub>r</sub>) of the polymorph that is stable at 298.15 K was combined with H<sub>tr</sub> and the Cp coefficients to calculate the metastable GHS (T<sub>r</sub>) of the polymorphs that are stable at higher temperatures.",https://chnosz.net
OBIGT.3,"J. M. Dick",2017,"OBIGT database in CHNOSZ","AuCl<sub>4</sub><sup>-</sup> renamed to AuCl<sub>4</sub><sup>-3</sup>",https://chnosz.net
OBIGT.4,"J. M. Dick",2017,"OBIGT database in CHNOSZ","charge of NpO<sub>2</sub>(Oxal), La(Succ)<sup>+</sup>, NH<sub>4</sub>(Succ)<sup>-</sup>, and NpO<sub>2</sub>(Succ) as listed by @PSK99",https://chnosz.net
OBIGT.5,"J. M. Dick",2017,"OBIGT database in CHNOSZ","incorrect values of HKF a<sub>1</sub>--a<sub>4</sub> parameters for [-CH<sub>2</sub>NH<sub>2</sub>] were printed in Table 6 of @DLH06; corrected values are used here.",https://chnosz.net
OBIGT.6,"J. M. Dick",2019,"OBIGT database in CHNOSZ","recalculated values of Cp (those in @AKAE19 appear to be calculated using wrong sign on &omega;) and enthalpy (using &Delta;G=&Delta;H-T&Delta;S and the entropies of the elements)",https://chnosz.net
OBIGT.7,"J. M. Dick",2019,"OBIGT database in CHNOSZ","Tl(Gly) and Tl(Gly)<sub>2</sub><sup>-</sup>: change Ti to Tl",https://chnosz.net
OBIGT.8,"J. M. Dick",2019,"OBIGT database in CHNOSZ","GHS recalculated by adding difference from SiO<sub>2</sub> [@SSH97] to updated values for SiO<sub>2</sub> [@AS04]",https://chnosz.net
OBIGT.9,"J. M. Dick",2021,"OBIGT database in CHNOSZ","diaminopimelic acid, putrescine and spermidine: parameters recalculated to account for a missing [-CH2NH2] group in the group additivity equations",https://chnosz.net
