// // This thermodynamic database in ORCHESTRA format was created by converting the PHREEQC database: M:\phreeqcdatabases\psi.dat) // This version provides temperature depenent expressions for reaction "constants". // Hans Meeussen, meeussen@nrg.eu // Thu Sep 23 16:46:46 CEST 2021 // //# PSI/Nagra Thermochemical Database Version 12/07 LAST MOD. 11-JUN-2015 //# PSINA_110615_DAV_s.dat //# //# The documentation for this database is available on http://www.psi.ch/les/database. //# //# Change history ----------------------------------------------------------------------------------- //# PSINA_120110_DAV_s.dat //# 12-JAN-2010 : Added Becquerelite and Compreignacite to PSINA_060110_DAV_s.dat //# PSINA_050710_DAV_s.dat //# 05-JULY-2010: Added CmSCN+2 to PSINA_120110_DAV_s.dat //# 05-JULY-2010: Added NpO2SCN to PSINA_120110_DAV_s.dat //# PSINA_050710_rev_DAV_s.dat //# 14-FEB-2011 : Sn: Changed incorrect formula (for conversion from mass to mole units) and //# incorrect elemental gfw in PSINA_050710_DAV.dat and PSINA_050710_DAV_s.dat //# 14-FEB-2011 : Added NpSiO(OH)3+2 to PSINA_050710_DAV_s.dat //# 14-FEB-2011 : Added USiO4(s) to PSINA_050710_DAV_s.dat //# 20-FEB-2011 : corrected log_k for UO2(am,hyd) (from -1.5 to 1.5) in PSINA_050710_DAV.dat //# and PSINA_050710_DAV_s.dat //# PSINA_290714_DAV_s.dat //# 29-JUL-2014 : Added I(+5) to the SOLUTION_MASTER_SPECIES //# corrected log_k for I2 (wrong sign) //# corrected log_k for IO3- (from -122.0400 to -101.0900) //# changed some comments //# PSINA_110615_DAV_s.dat //# 11-JUN-2015: Changed references to PSI reports and added comment concerning documentation, //# deleted warning concerning use of database at temperatures other than 25�C //#--------------------------------------------------------------------------------------------------- //# //# ACTIVITY COEFFICIENTS: //# //# This version of the database uses the Davies equation for the calculation of activity coefficients. //# -gamma 0.00 0.00 for neutral species ensures that the activity coefficients //# are equal to one. //# //# TEMPERATURE: //# //# This version of the database only contains logK-data for 25�C //# //# DOCUMENTATION: //# //# NAGRA NTB 91-17: Pearson F.J., Berner U. (1992): Nagra Thermochemical Data Base I. Core Data, //# Nagra NTB 91-17. //# available for download at http://www.nagra.ch/de/downloadcenter.htm //# NAGRA NTB 91-18: Pearson F.J., Berner U., Hummel W. (1992): Nagra Thermochemical Data Base //# II. Supplemental Data, Nagra NTB 91-18. //# available for download at http://www.nagra.ch/de/downloadcenter.htm //# NAGRA NTB 02-16: Hummel W., Berner U., Curti E., Pearson F.J., Thoenen T. (2002): Nagra/PSI //# Chemical Thermodynamic Database 01/01, Nagra NTB 02-16. //# available for download at http://www.nagra.ch/de/downloadcenter.htm //# PSI Report 14-04: Thoenen T., Hummel W., Berner U., Curti E. (2014): The PSI/Nagra Chemical //# Thermodynamic Database 12/07, PSI Report 14-04. //# available for download at http://www.psi.ch/les/database //# //#--------------------------------------------------------------------------------------------------- //# @entity(H, tot, 0) @entity(H[+0], tot, 0) @species(H2,0) @logKreaction(H2, 0, 1, H[+0]) @logKreaction((H[+0], "(-3.1054)", 2.0, H, 2.0, e-) @entity(H[+1], tot, 0) @logKreaction(H[+1], 0, 1, H) @logKreaction(H+, 0, 1, H[+1]) @entity(E, tot, 0) @entity(e-, diss, 0) @logKreaction(e-, 0, 1, E) @entity(O, tot, 0) @entity(O[+0], tot, 0) @species(O2,0) @logKreaction(O2, 0, 1, O[+0]) @logKreaction((O[+0], "(-85.9841)", 2.0, O, -4.0, H+, -4.0, e-) @entity(O[-2], tot, 0) @logKreaction(O[-2], 0, 1, O) @logKreaction(H2O, 0, 1, O[-2]) @entity(Al, tot, 0) @species(Al+3,3) @logKreaction(Al+3, 0, 1, Al) @entity(Am, tot, 0) @entity(Am[+3], tot, 0) @logKreaction(Am[+3], 0, 1, Am) @logKreaction(Am+3, 0, 1, Am[+3]) @entity(Am[+5], tot, 0) @species(AmO2+,1) @logKreaction(AmO2+, 0, 1, Am[+5]) @logKreaction((Am[+5], "(-59.7000)", 1.0, Am, 2.0, H2O, -4.0, H+, -2.0, e-) @entity(As, tot, 0) @entity(As[+3], tot, 0) @species(As[OH]3,0) @logKreaction(As[OH]3, 0, 1, As[+3]) @logKreaction((As[+3], "(28.4412)", 1.0, As, 4.0, H+, 2.0, e-, -1.0, H2O) @entity(As[+5], tot, 0) @logKreaction(As[+5], 0, 1, As) @logKreaction(HAsO4-2, 0, 1, As[+5]) @entity(B, tot, 0) @species(B[OH]3,0) @logKreaction(B[OH]3, 0, 1, B) @entity(Ba, tot, 0) @species(Ba+2,2) @logKreaction(Ba+2, 0, 1, Ba) @entity(Br, tot, 0) @species(Br-,-1) @logKreaction(Br-, 0, 1, Br) @entity(C, tot, 0) @entity(C[+4], tot, 0) @logKreaction(C[+4], 0, 1, C) @logKreaction(HCO3-, 0, 1, C[+4]) @entity(C[-4], tot, 0) @species(CH4,0) @logKreaction(CH4, 0, 1, C[-4]) @logKreaction((C[-4], "(27.8486)", 1.0, C, 9.0, H+, 8.0, e-, -3.0, H2O) @entity(Alkalinity, tot, 0) @species(HCO3-,-1) @logKreaction(HCO3-, 0, 1, Alkalinity) @entity(Ca, tot, 0) @species(Ca+2,2) @logKreaction(Ca+2, 0, 1, Ca) @entity(Cl, tot, 0) @species(Cl-,-1) @logKreaction(Cl-, 0, 1, Cl) @entity(Cm, tot, 0) @species(Cm+3,3) @logKreaction(Cm+3, 0, 1, Cm) @entity(Cs, tot, 0) @species(Cs+,1) @logKreaction(Cs+, 0, 1, Cs) @entity(Eu, tot, 0) @entity(Eu[+2], tot, 0) @species(Eu+2,2) @logKreaction(Eu+2, 0, 1, Eu[+2]) @logKreaction((Eu[+2], "(-5.9200)", 1.0, Eu, 1.0, e-) @entity(Eu[+3], tot, 0) @logKreaction(Eu[+3], 0, 1, Eu) @logKreaction(Eu+3, 0, 1, Eu[+3]) @entity(F, tot, 0) @species(F-,-1) @logKreaction(F-, 0, 1, F) @entity(Fe, tot, 0) @entity(Fe[+2], tot, 0) @logKreaction(Fe[+2], 0, 1, Fe) @logKreaction(Fe+2, 0, 1, Fe[+2]) @entity(Fe[+3], tot, 0) @species(Fe+3,3) @logKreaction(Fe+3, 0, 1, Fe[+3]) @logKreaction((Fe[+3], "(-13.0200)", 1.0, Fe, -1.0, e-) @entity(I, tot, 0) @entity(I[-1], tot, 0) @logKreaction(I[-1], 0, 1, I) @logKreaction(I-, 0, 1, I[-1]) @entity(I[+0], tot, 0) @species(I2,0) @logKreaction(I2, 0, 1, I[+0]) @logKreaction((I[+0], "(-20.9500)", 2.0, I, -2.0, e-) @entity(I[+5], tot, 0) @species(IO3-,-1) @logKreaction(IO3-, 0, 1, I[+5]) @logKreaction((I[+5], "(-101.0900) + 0.5 * ((-20.9500))", 3.0, H2O, -6.0, H+, -6.0, e-, 1.0, I) @entity(K, tot, 0) @species(K+,1) @logKreaction(K+, 0, 1, K) @entity(Li, tot, 0) @species(Li+,1) @logKreaction(Li+, 0, 1, Li) @entity(Mg, tot, 0) @species(Mg+2,2) @logKreaction(Mg+2, 0, 1, Mg) @entity(Mn, tot, 0) @species(Mn+2,2) @logKreaction(Mn+2, 0, 1, Mn) @entity(Mo, tot, 0) @species(MoO4-2,-2) @logKreaction(MoO4-2, 0, 1, Mo) @entity(N, tot, 0) @entity(N[-5], tot, 0) @species(HCN,0) @logKreaction(HCN, 0, 1, N[-5]) @logKreaction((N[-5], "(117.3360)", 13.0, H+, 1.0, CO3-2, 1.0, N, 10.0, e-, -6.0, H2O) @entity(N[-3], tot, 0) @species(NH4+,1) @logKreaction(NH4+, 0, 1, N[-3]) @logKreaction((N[-3], "(119.1344)", 1.0, N, 10.0, H+, 8.0, e-, -3.0, H2O) @entity(N[-1], tot, 0) @species(SCN-,-1) @logKreaction(SCN-, 0, 1, N[-1]) @logKreaction((N[-1], "(5.9410) + 1.0 * ((117.3360))", 1.0, HS-, 8.0, e-, 11.0, H+, 1.0, CO3-2, 1.0, N, -6.0, H2O) @entity(N[+0], tot, 0) @species(N2,0) @logKreaction(N2, 0, 1, N[+0]) @logKreaction((N[+0], "(207.2627)", 2.0, N, 12.0, H+, 10.0, e-, -6.0, H2O) @entity(N[+5], tot, 0) @logKreaction(N[+5], 0, 1, N) @logKreaction(NO3-, 0, 1, N[+5]) @entity(Na, tot, 0) @species(Na+,1) @logKreaction(Na+, 0, 1, Na) @entity(Nb, tot, 0) @species(NbO3-,-1) @logKreaction(NbO3-, 0, 1, Nb) @entity(Ni, tot, 0) @species(Ni+2,2) @logKreaction(Ni+2, 0, 1, Ni) @entity(Np, tot, 0) @entity(Np[+3], tot, 0) @species(Np+3,3) @logKreaction(Np+3, 0, 1, Np[+3]) @logKreaction((Np[+3], "(33.5000)", 1.0, Np, 4.0, H+, 3.0, e-, -2.0, H2O) @entity(Np[+4], tot, 0) @species(Np+4,4) @logKreaction(Np+4, 0, 1, Np[+4]) @logKreaction((Np[+4], "(29.8000)", 1.0, Np, 4.0, H+, 2.0, e-, -2.0, H2O) @entity(Np[+5], tot, 0) @species(NpO2+,1) @logKreaction(NpO2+, 0, 1, Np[+5]) @logKreaction((Np[+5], "(19.5900)", 1.0, Np, 1.0, e-) @entity(Np[+6], tot, 0) @logKreaction(Np[+6], 0, 1, Np) @logKreaction(NpO2+2, 0, 1, Np[+6]) @entity(P, tot, 0) @species(HPO4-2,-2) @logKreaction(HPO4-2, 0, 1, P) @entity(Pd, tot, 0) @species(Pd+2,2) @logKreaction(Pd+2, 0, 1, Pd) @entity(Pu, tot, 0) @entity(Pu[+3], tot, 0) @species(Pu+3,3) @logKreaction(Pu+3, 0, 1, Pu[+3]) @logKreaction((Pu[+3], "(50.9700)", 1.0, Pu, 4.0, H+, 3.0, e-, -2.0, H2O) @entity(Pu[+4], tot, 0) @species(Pu+4,4) @logKreaction(Pu+4, 0, 1, Pu[+4]) @logKreaction((Pu[+4], "(33.2800)", 1.0, Pu, 4.0, H+, 2.0, e-, -2.0, H2O) @entity(Pu[+5], tot, 0) @species(PuO2+,1) @logKreaction(PuO2+, 0, 1, Pu[+5]) @logKreaction((Pu[+5], "(15.8200)", 1.0, Pu, 1.0, e-) @entity(Pu[+6], tot, 0) @logKreaction(Pu[+6], 0, 1, Pu) @logKreaction(PuO2+2, 0, 1, Pu[+6]) @entity(Ra, tot, 0) @species(Ra+2,2) @logKreaction(Ra+2, 0, 1, Ra) @entity(S, tot, 0) @entity(S[-2], tot, 0) @species(HS-,-1) @logKreaction(HS-, 0, 1, S[-2]) @logKreaction((S[-2], "(33.6900)", 1.0, S, 9.0, H+, 8.0, e-, -4.0, H2O) @entity(S[+2], tot, 0) @species(S2O3-2,-2) @logKreaction(S2O3-2, 0, 1, S[+2]) @logKreaction((S[+2], "(38.0140)", 2.0, S, 10.0, H+, 8.0, e-, -5.0, H2O) @entity(S[+4], tot, 0) @species(SO3-2,-2) @logKreaction(SO3-2, 0, 1, S[+4]) @logKreaction((S[+4], "(-3.3970)", 1.0, S, 2.0, H+, 2.0, e-, -1.0, H2O) @entity(S[+6], tot, 0) @logKreaction(S[+6], 0, 1, S) @logKreaction(SO4-2, 0, 1, S[+6]) @entity(Se, tot, 0) @entity(Se[+4], tot, 0) @logKreaction(Se[+4], 0, 1, Se) @logKreaction(SeO3-2, 0, 1, Se[+4]) @entity(Se[-2], tot, 0) @species(H2Se,0) @logKreaction(H2Se, 0, 1, Se[-2]) @logKreaction((Se[-2], "(57.4000)", 1.0, Se, 8.0, H+, 6.0, e-, -3.0, H2O) @entity(Se[+6], tot, 0) @species(HSeO4-,-1) @logKreaction(HSeO4-, 0, 1, Se[+6]) @logKreaction((Se[+6], "(-26.3000)", 1.0, Se, 1.0, H2O, -1.0, H+, -2.0, e-) @entity(Si, tot, 0) @species(Si[OH]4,0) @logKreaction(Si[OH]4, 0, 1, Si) @entity(Tn, tot, 0) @species(Tn+2,2) @logKreaction(Tn+2, 0, 1, Tn) @entity(Sn, tot, 0) @species(Sn[OH]4,0) @logKreaction(Sn[OH]4, 0, 1, Sn) @entity(Sr, tot, 0) @species(Sr+2,2) @logKreaction(Sr+2, 0, 1, Sr) @entity(Tc, tot, 0) @entity(Tc[+7], tot, 0) @logKreaction(Tc[+7], 0, 1, Tc) @logKreaction(TcO4-, 0, 1, Tc[+7]) @entity(Tc[+4], tot, 0) @species(TcO[OH]2,0) @logKreaction(TcO[OH]2, 0, 1, Tc[+4]) @logKreaction((Tc[+4], "(29.4000)", 1.0, Tc, 4.0, H+, 3.0, e-, -1.0, H2O) @entity(Th, tot, 0) @species(Th+4,4) @logKreaction(Th+4, 0, 1, Th) @entity(U, tot, 0) @entity(U[+4], tot, 0) @species(U+4,4) @logKreaction(U+4, 0, 1, U[+4]) @logKreaction((U[+4], "(9.0380)", 1.0, U, 4.0, H+, 2.0, e-, -2.0, H2O) @entity(U[+5], tot, 0) @species(UO2+,1) @logKreaction(UO2+, 0, 1, U[+5]) @logKreaction((U[+5], "(1.4840)", 1.0, U, 1.0, e-) @entity(U[+6], tot, 0) @logKreaction(U[+6], 0, 1, U) @logKreaction(UO2+2, 0, 1, U[+6]) @entity(Zr, tot, 0) @species(Zr+4,4) @logKreaction(Zr+4, 0, 1, Zr) @species(H+,1) @entity(e-, diss, 0) @entity(H2O, liter, 55.6) @species(Al+3,3) @species(Am+3,3) @species(HAsO4-2,-2) @species(B[OH]3,0, 0.00, 0.00) @species(Ba+2,2) @species(Br-,-1) @species(HCO3-,-1) @species(Ca+2,2) @species(Cl-,-1) @species(Cm+3,3) @species(Cs+,1) @species(Eu+3,3) @species(F-,-1) @species(Fe+2,2) @species(I-,-1) @species(K+,1) @species(Li+,1) @species(Mg+2,2) @species(Mn+2,2) @species(MoO4-2,-2) @species(NO3-,-1) @species(Na+,1) @species(NbO3-,-1) @species(Ni+2,2) @species(NpO2+2,2) @species(HPO4-2,-2) @species(Pd+2,2) @species(PuO2+2,2) @species(Ra+2,2) @species(SO4-2,-2) @species(SeO3-2,-2) @species(Si[OH]4,0, 0.00, 0.00) @species(Tn+2,2) @species(Sn[OH]4,0, 0.00, 0.00) @species(Sr+2,2) @species(TcO4-,-1) @species(Th+4,4) @species(UO2+2,2) @species(Zr+4,4) @species(HSeO4-,-1) @species(H2Se,0, 0.00, 0.00) @species(SeCN-,-1) @logKreaction(SeCN-, "(57.3000)", 1.0, HCN, 1.0, SeO3-2, 5.0, H+, 4.0, e-, -3.0, H2O) @species(TcO[OH]2,0, 0.00, 0.00) @species(Eu+2,2) @species(U+4,4) @species(UO2+,1) @species(Np+3,3) @species(Np+4,4) @species(NpO2+,1) @species(Pu+3,3) @species(Pu+4,4) @species(PuO2+,1) @species(AmO2+,1) @species(H2,0, 0.00, 0.00) @species(O2,0, 0.00, 0.00) @species(As[OH]3,0, 0.00, 0.00) @species(CH4,0, 0.00, 0.00) @species(N2,0, 0.00, 0.00) @species(NH4+,1) @species(S2O3-2,-2) @species(SO3-2,-2) @species(HS-,-1) @species(Fe+3,3) @species(I2,0, 0.00, 0.00) @species(IO3-,-1) @species(HCN,0, 0.00, 0.00) @species(SCN-,-1) @species(OH-,-1) @logKreaction(OH-, "(-13.9995)", 1.0, H2O, -1.0, H+) @species(CO2,0, 0.00, 0.00) @logKreaction(CO2, "(6.3519)", 1.0, H+, -1.0, H2O, 1.0, HCO3-) @species(CO3-2,-2) @logKreaction(CO3-2, "(-10.3289)", -1.0, H+, 1.0, HCO3-) @species(H3PO4,0, 0.00, 0.00) @logKreaction(H3PO4, "(9.3520)", 1.0, HPO4-2, 2.0, H+) @species(H2PO4-,-1) @logKreaction(H2PO4-, "(7.2120)", 1.0, HPO4-2, 1.0, H+) @species(PO4-3,-3) @logKreaction(PO4-3, "(-12.3500)", 1.0, HPO4-2, -1.0, H+) @species(SiO[OH]3-,-1) @logKreaction(SiO[OH]3-, "(-9.8100)", 1.0, Si[OH]4, -1.0, H+) @species(SiO2[OH]2-2,-2) @logKreaction(SiO2[OH]2-2, "(-23.1400)", 1.0, Si[OH]4, -2.0, H+) @species(Al[OH]4-,-1) @logKreaction(Al[OH]4-, "(-22.8791)", 1.0, Al+3, 4.0, H2O, -4.0, H+) @species(NH3,0, 0.00, 0.00) @logKreaction(NH3, "(-9.2370)", 1.0, NH4+, -1.0, H+) @species(CN-,-1) @logKreaction(CN-, "(-9.2100)", 1.0, HCN, -1.0, H+) @species(AsO4-3,-3) @logKreaction(AsO4-3, "(-11.6030)", 1.0, HAsO4-2, -1.0, H+) @species(H3AsO4,0, 0.00, 0.00) @logKreaction(H3AsO4, "(9.0270)", 1.0, HAsO4-2, 2.0, H+) @species(SeO4-2,-2) @logKreaction(SeO4-2, "(-1.7500)", 1.0, HSeO4-, -1.0, H+) @species(HSeO3-,-1) @logKreaction(HSeO3-, "(8.3600)", 1.0, SeO3-2, 1.0, H+) @species(HSe-,-1) @logKreaction(HSe-, "(-3.8500)", 1.0, H2Se, -1.0, H+) @species(Se-2,-2) @logKreaction(Se-2, "(-14.9100)", 1.0, HSe-, -1.0, H+) @species(I3-,-1) @logKreaction(I3-, "(2.8700)", 1.0, I-, 1.0, I2) @species(HIO3,0, 0.00, 0.00) @logKreaction(HIO3, "(0.7880)", 1.0, H+, 1.0, IO3-) @species(AlF+2,2) @logKreaction(AlF+2, "(7.0800)", 1.0, Al+3, 1.0, F-) @species(AlF2+,1) @logKreaction(AlF2+, "(12.7300)", 1.0, Al+3, 2.0, F-) @species(AlF3,0, 0.00, 0.00) @logKreaction(AlF3, "(16.7800)", 1.0, Al+3, 3.0, F-) @species(AlF4-,-1) @logKreaction(AlF4-, "(19.2900)", 1.0, Al+3, 4.0, F-) @species(AlF5-2,-2) @logKreaction(AlF5-2, "(20.3000)", 1.0, Al+3, 5.0, F-) @species(AlF6-3,-3) @logKreaction(AlF6-3, "(20.3000)", 1.0, Al+3, 6.0, F-) @species(AlOH+2,2) @logKreaction(AlOH+2, "(-4.9572)", 1.0, Al+3, 1.0, H2O, -1.0, H+) @species(Al[OH]2+,1) @logKreaction(Al[OH]2+, "(-10.5940)", 1.0, Al+3, 2.0, H2O, -2.0, H+) @species(Al[OH]3,0, 0.00, 0.00) @logKreaction(Al[OH]3, "(-16.4324)", 1.0, Al+3, 3.0, H2O, -3.0, H+) @species(AlSO4+,1) @logKreaction(AlSO4+, "(3.9000)", 1.0, Al+3, 1.0, SO4-2) @species(Al[SO4]2-,-1) @logKreaction(Al[SO4]2-, "(5.9000)", 1.0, Al+3, 2.0, SO4-2) @species(As[OH]4-,-1) @logKreaction(As[OH]4-, "(-9.2320)", 1.0, As[OH]3, 1.0, H2O, -1.0, H+) @species(B[OH]4-,-1) @logKreaction(B[OH]4-, "(-9.2352)", 1.0, B[OH]3, 1.0, H2O, -1.0, H+) @species(BaCO3,0, 0.00, 0.00) @logKreaction(BaCO3, "(-7.6157)", 1.0, Ba+2, -1.0, H+, 1.0, HCO3-) @species(BaHCO3+,1) @logKreaction(BaHCO3+, "(0.9816)", 1.0, Ba+2, 1.0, HCO3-) @species(BaOH+,1) @logKreaction(BaOH+, "(-13.4700)", 1.0, Ba+2, 1.0, H2O, -1.0, H+) @species(BaSO4,0, 0.00, 0.00) @logKreaction(BaSO4, "(2.7000)", 1.0, Ba+2, 1.0, SO4-2) @species(CaCO3,0, 0.00, 0.00) @logKreaction(CaCO3, "(-7.1047)", 1.0, Ca+2, -1.0, H+, 1.0, HCO3-) @species(CaF+,1) @logKreaction(CaF+, "(0.9400)", 1.0, Ca+2, 1.0, F-) @species(CaHCO3+,1) @logKreaction(CaHCO3+, "(1.1057)", 1.0, Ca+2, 1.0, HCO3-) @species(CaOH+,1) @logKreaction(CaOH+, "(-12.7800)", 1.0, Ca+2, 1.0, H2O, -1.0, H+) @species(CaSO4,0, 0.00, 0.00) @logKreaction(CaSO4, "(2.3000)", 1.0, Ca+2, 1.0, SO4-2) @species(Fe[OH]2+,1) @logKreaction(Fe[OH]2+, "(-5.6700)", 2.0, H2O, -2.0, H+, 1.0, Fe+3) @species(Fe[OH]3,0, 0.00, 0.00) @logKreaction(Fe[OH]3, "(-12.5600)", 3.0, H2O, -3.0, H+, 1.0, Fe+3) @species(Fe[OH]4-,-1) @logKreaction(Fe[OH]4-, "(-21.6000)", 4.0, H2O, -4.0, H+, 1.0, Fe+3) @species(Fe[SO4]2-,-1) @logKreaction(Fe[SO4]2-, "(5.3800)", 2.0, SO4-2, 1.0, Fe+3) @species(Fe2[OH]2+4,4) @logKreaction(Fe2[OH]2+4, "(-2.9500)", 2.0, H2O, -2.0, H+, 2.0, Fe+3) @species(Fe3[OH]4+5,5) @logKreaction(Fe3[OH]4+5, "(-6.3000)", 4.0, H2O, -4.0, H+, 3.0, Fe+3) @species(FeCl+,1) @logKreaction(FeCl+, "(0.1400)", 1.0, Fe+2, 1.0, Cl-) @species(FeCl+2,2) @logKreaction(FeCl+2, "(1.4800)", 1.0, Cl-, 1.0, Fe+3) @species(FeCl2+,1) @logKreaction(FeCl2+, "(2.1300)", 2.0, Cl-, 1.0, Fe+3) @species(FeCl3,0, 0.00, 0.00) @logKreaction(FeCl3, "(1.1300)", 3.0, Cl-, 1.0, Fe+3) @species(FeCO3,0, 0.00, 0.00) @logKreaction(FeCO3, "(-5.9490)", 1.0, Fe+2, 1.0, HCO3-, -1.0, H+) @species(FeF+,1) @logKreaction(FeF+, "(1.0000)", 1.0, Fe+2, 1.0, F-) @species(FeF+2,2) @logKreaction(FeF+2, "(6.2000)", 1.0, F-, 1.0, Fe+3) @species(FeF2+,1) @logKreaction(FeF2+, "(10.8000)", 2.0, F-, 1.0, Fe+3) @species(FeF3,0, 0.00, 0.00) @logKreaction(FeF3, "(14.0000)", 3.0, F-, 1.0, Fe+3) @species(FeHCO3+,1) @logKreaction(FeHCO3+, "(2.0000)", 1.0, Fe+2, 1.0, HCO3-) @species(FeHSO4+,1) @logKreaction(FeHSO4+, "(3.0680)", 1.0, Fe+2, 1.0, H+, 1.0, SO4-2) @species(FeHSO4+2,2) @logKreaction(FeHSO4+2, "(4.4680)", 1.0, H+, 1.0, SO4-2, 1.0, Fe+3) @species(FeOH+,1) @logKreaction(FeOH+, "(-9.5000)", 1.0, Fe+2, 1.0, H2O, -1.0, H+) @species(FeOH+2,2) @logKreaction(FeOH+2, "(-2.1900)", 1.0, H2O, -1.0, H+, 1.0, Fe+3) @species(FeSO4+,1) @logKreaction(FeSO4+, "(4.0400)", 1.0, SO4-2, 1.0, Fe+3) @species(FeSO4,0, 0.00, 0.00) @logKreaction(FeSO4, "(2.2500)", 1.0, Fe+2, 1.0, SO4-2) @species(H2AsO4-,-1) @logKreaction(H2AsO4-, "(6.7640)", 1.0, HAsO4-2, 1.0, H+) @species(HF,0, 0.00, 0.00) @logKreaction(HF, "(3.1760)", 1.0, H+, 1.0, F-) @species(HF2-,-1) @logKreaction(HF2-, "(3.6200)", 1.0, H+, 2.0, F-) @species(HSO3-,-1) @logKreaction(HSO3-, "(7.2200)", 1.0, H+, 1.0, SO3-2) @species(HSO4-,-1) @logKreaction(HSO4-, "(1.9878)", 1.0, H+, 1.0, SO4-2) @species(KOH,0, 0.00, 0.00) @logKreaction(KOH, "(-14.4600)", 1.0, K+, 1.0, H2O, -1.0, H+) @species(KSO4-,-1) @logKreaction(KSO4-, "(0.8500)", 1.0, K+, 1.0, SO4-2) @species(LiOH,0, 0.00, 0.00) @logKreaction(LiOH, "(-13.6400)", 1.0, Li+, 1.0, H2O, -1.0, H+) @species(LiSO4-,-1) @logKreaction(LiSO4-, "(0.6400)", 1.0, Li+, 1.0, SO4-2) @species(S-2,-2) @logKreaction(S-2, "(-19.0000)", 1.0, HS-, -1.0, H+) @species(H2S,0, 0.00, 0.00) @logKreaction(H2S, "(6.9900)", 1.0, HS-, 1.0, H+) @species(MgCO3,0, 0.00, 0.00) @logKreaction(MgCO3, "(-7.3492)", 1.0, Mg+2, -1.0, H+, 1.0, HCO3-) @species(MgF+,1) @logKreaction(MgF+, "(1.8200)", 1.0, Mg+2, 1.0, F-) @species(MgHCO3+,1) @logKreaction(MgHCO3+, "(1.0682)", 1.0, Mg+2, 1.0, HCO3-) @species(MgOH+,1) @logKreaction(MgOH+, "(-11.4400)", 1.0, Mg+2, 1.0, H2O, -1.0, H+) @species(MgSO4,0, 0.00, 0.00) @logKreaction(MgSO4, "(2.3700)", 1.0, Mg+2, 1.0, SO4-2) @species(MnCl+,1) @logKreaction(MnCl+, "(0.6100)", 1.0, Mn+2, 1.0, Cl-) @species(MnCl2,0, 0.00, 0.00) @logKreaction(MnCl2, "(0.2500)", 1.0, Mn+2, 2.0, Cl-) @species(MnCl3-,-1) @logKreaction(MnCl3-, "(-0.3100)", 1.0, Mn+2, 3.0, Cl-) @species(MnCO3,0, 0.00, 0.00) @logKreaction(MnCO3, "(-5.4290)", 1.0, Mn+2, 1.0, HCO3-, -1.0, H+) @species(MnF+,1) @logKreaction(MnF+, "(0.8400)", 1.0, Mn+2, 1.0, F-) @species(MnHCO3+,1) @logKreaction(MnHCO3+, "(1.9500)", 1.0, Mn+2, 1.0, HCO3-) @species(MnOH+,1) @logKreaction(MnOH+, "(-10.5900)", 1.0, Mn+2, 1.0, H2O, -1.0, H+) @species(MnSO4,0, 0.00, 0.00) @logKreaction(MnSO4, "(2.2500)", 1.0, Mn+2, 1.0, SO4-2) @species(NaCO3-,-1) @logKreaction(NaCO3-, "(-9.0590)", 1.0, Na+, -1.0, H+, 1.0, HCO3-) @species(NaF,0, 0.00, 0.00) @logKreaction(NaF, "(-0.2400)", 1.0, Na+, 1.0, F-) @species(NaHCO3,0, 0.00, 0.00) @logKreaction(NaHCO3, "(-0.2500)", 1.0, Na+, 1.0, HCO3-) @species(NaOH,0, 0.00, 0.00) @logKreaction(NaOH, "(-14.1800)", 1.0, Na+, 1.0, H2O, -1.0, H+) @species(NaSO4-,-1) @logKreaction(NaSO4-, "(0.7000)", 1.0, Na+, 1.0, SO4-2) @species(Nb[OH]4+,1) @logKreaction(Nb[OH]4+, "(6.8955)", 1.0, NbO3-, 2.0, H+, 1.0, H2O) @species(Nb[OH]5,0, 0.00, 0.00) @logKreaction(Nb[OH]5, "(7.3440)", 1.0, NbO3-, 1.0, H+, 2.0, H2O) @species(SrCO3,0, 0.00, 0.00) @logKreaction(SrCO3, "(-7.5238)", 1.0, Sr+2, -1.0, H+, 1.0, HCO3-) @species(SrHCO3+,1) @logKreaction(SrHCO3+, "(1.1846)", 1.0, Sr+2, 1.0, HCO3-) @species(SrOH+,1) @logKreaction(SrOH+, "(-13.2900)", 1.0, Sr+2, 1.0, H2O, -1.0, H+) @species(SrSO4,0, 0.00, 0.00) @logKreaction(SrSO4, "(2.2900)", 1.0, Sr+2, 1.0, SO4-2) @species(CaSiO[OH]3+,1) @logKreaction(CaSiO[OH]3+, "(1.2000)", 1.0, Ca+2, 1.0, SiO[OH]3-) @species(CaSiO2[OH]2,0, 0.00, 0.00) @logKreaction(CaSiO2[OH]2, "(4.6000)", 1.0, Ca+2, 1.0, SiO2[OH]2-2) @species(MgSiO[OH]3+,1) @logKreaction(MgSiO[OH]3+, "(1.5000)", 1.0, Mg+2, 1.0, SiO[OH]3-) @species(MgSiO2[OH]2,0, 0.00, 0.00) @logKreaction(MgSiO2[OH]2, "(5.7000)", 1.0, Mg+2, 1.0, SiO2[OH]2-2) @species(AlSiO[OH]3+2,2) @logKreaction(AlSiO[OH]3+2, "(7.4000)", 1.0, Al+3, 1.0, SiO[OH]3-) @species(FeSiO[OH]3+2,2) @logKreaction(FeSiO[OH]3+2, "(9.7000)", 1.0, Fe+3, 1.0, SiO[OH]3-) @species(Si4O8[OH]4-4,-4) @logKreaction(Si4O8[OH]4-4, "(-36.3000)", 4.0, Si[OH]4, -4.0, H+, -4.0, H2O) @species(AlSiO3[OH]4-3,-3) @logKreaction(AlSiO3[OH]4-3, "(0.5300)", 1.0, Al[OH]4-, 1.0, SiO2[OH]2-2, -1.0, H2O) @species(NiOH+,1) @logKreaction(NiOH+, "(-9.5400)", 1.0, Ni+2, 1.0, H2O, -1.0, H+) @species(Ni[OH]3-,-1) @logKreaction(Ni[OH]3-, "(-29.2000)", 1.0, Ni+2, 3.0, H2O, -3.0, H+) @species(Ni2OH+3,3) @logKreaction(Ni2OH+3, "(-10.6000)", 2.0, Ni+2, 1.0, H2O, -1.0, H+) @species(Ni4[OH]4+4,4) @logKreaction(Ni4[OH]4+4, "(-27.5200)", 4.0, Ni+2, 4.0, H2O, -4.0, H+) @species(NiF+,1) @logKreaction(NiF+, "(1.4300)", 1.0, Ni+2, 1.0, F-) @species(NiCl+,1) @logKreaction(NiCl+, "(0.0800)", 1.0, Ni+2, 1.0, Cl-) @species(NiSO4,0, 0.00, 0.00) @logKreaction(NiSO4, "(2.3500)", 1.0, Ni+2, 1.0, SO4-2) @species(NiNO3+,1) @logKreaction(NiNO3+, "(0.5000)", 1.0, Ni+2, 1.0, NO3-) @species(NiHPO4,0, 0.00, 0.00) @logKreaction(NiHPO4, "(3.0500)", 1.0, Ni+2, 1.0, HPO4-2) @species(NiCO3,0, 0.00, 0.00) @logKreaction(NiCO3, "(4.2000)", 1.0, Ni+2, 1.0, CO3-2) @species(NiHS+,1) @logKreaction(NiHS+, "(5.5000)", 1.0, Ni+2, 1.0, HS-) @species(Ni[HS]2,0, 0.00, 0.00) @logKreaction(Ni[HS]2, "(11.1000)", 1.0, Ni+2, 2.0, HS-) @species(NiHAsO4,0, 0.00, 0.00) @logKreaction(NiHAsO4, "(2.9000)", 1.0, Ni+2, 1.0, HAsO4-2) @species(Ni[CN]4-2,-2) @logKreaction(Ni[CN]4-2, "(30.2000)", 1.0, Ni+2, 4.0, CN-) @species(Ni[CN]5-3,-3) @logKreaction(Ni[CN]5-3, "(28.5000)", 1.0, Ni+2, 5.0, CN-) @species(NiSCN+,1) @logKreaction(NiSCN+, "(1.8100)", 1.0, Ni+2, 1.0, SCN-) @species(Ni[SCN]2,0, 0.00, 0.00) @logKreaction(Ni[SCN]2, "(2.6900)", 1.0, Ni+2, 2.0, SCN-) @species(Ni[SCN]3-,-1) @logKreaction(Ni[SCN]3-, "(3.0200)", 1.0, Ni+2, 3.0, SCN-) @species(Ni[OH]2,0, 0.00, 0.00) @logKreaction(Ni[OH]2, "(-18.0000)", 1.0, Ni+2, 2.0, H2O, -2.0, H+) @species(NiNH3+2,2) @logKreaction(NiNH3+2, "(2.7000)", 1.0, Ni+2, 1.0, NH3) @species(Ni[NH3]2+2,2) @logKreaction(Ni[NH3]2+2, "(4.9000)", 1.0, Ni+2, 2.0, NH3) @species(Ni[NH3]3+2,2) @logKreaction(Ni[NH3]3+2, "(6.5000)", 1.0, Ni+2, 3.0, NH3) @species(Ni[NH3]4+2,2) @logKreaction(Ni[NH3]4+2, "(7.6000)", 1.0, Ni+2, 4.0, NH3) @species(Ni[NH3]5+2,2) @logKreaction(Ni[NH3]5+2, "(8.3000)", 1.0, Ni+2, 5.0, NH3) @species(Ni[NH3]6+2,2) @logKreaction(Ni[NH3]6+2, "(8.2000)", 1.0, Ni+2, 6.0, NH3) @species(Ni[CO3]2-2,-2) @logKreaction(Ni[CO3]2-2, "(6.0000)", 1.0, Ni+2, 2.0, CO3-2) @species(NiHCO3+,1) @logKreaction(NiHCO3+, "(1.0000)", 1.0, Ni+2, 1.0, HCO3-) @species(NiSiO[OH]3+,1) @logKreaction(NiSiO[OH]3+, "(6.3000)", 1.0, Ni+2, 1.0, SiO[OH]3-) @species(Se2-2,-2) @logKreaction(Se2-2, "(25.3200)", 2.0, Se-2, -2.0, e-) @species(Se3-2,-2) @logKreaction(Se3-2, "(49.9700)", 3.0, Se-2, -4.0, e-) @species(Se4-2,-2) @logKreaction(Se4-2, "(73.0200)", 4.0, Se-2, -6.0, e-) @species(NiSeCN+,1) @logKreaction(NiSeCN+, "(1.7700)", 1.0, Ni+2, 1.0, SeCN-) @species(Ni[SeCN]2,0, 0.00, 0.00) @logKreaction(Ni[SeCN]2, "(2.2400)", 1.0, Ni+2, 2.0, SeCN-) @species(H2SeO3,0, 0.00, 0.00) @logKreaction(H2SeO3, "(2.6400)", 1.0, HSeO3-, 1.0, H+) @species(FeSeO3+,1) @logKreaction(FeSeO3+, "(11.1500)", 1.0, Fe+3, 1.0, SeO3-2) @species(NiSeO4,0, 0.00, 0.00) @logKreaction(NiSeO4, "(2.6700)", 1.0, Ni+2, 1.0, SeO4-2) @species(MnSeO4,0, 0.00, 0.00) @logKreaction(MnSeO4, "(2.4300)", 1.0, Mn+2, 1.0, SeO4-2) @species(UO2SeO4,0, 0.00, 0.00) @logKreaction(UO2SeO4, "(2.7400)", 1.0, UO2+2, 1.0, SeO4-2) @species(CaSeO4,0, 0.00, 0.00) @logKreaction(CaSeO4, "(2.0000)", 1.0, Ca+2, 1.0, SeO4-2) @species(UO2[SeO4]2-2,-2) @logKreaction(UO2[SeO4]2-2, "(3.1000)", 1.0, UO2+2, 2.0, SeO4-2) @species(MgSeO4,0, 0.00, 0.00) @logKreaction(MgSeO4, "(2.2000)", 1.0, Mg+2, 1.0, SeO4-2) @species(ZrOH+3,3) @logKreaction(ZrOH+3, "(0.3200)", 1.0, Zr+4, 1.0, H2O, -1.0, H+) @species(Zr[OH]4,0, 0.00, 0.00) @logKreaction(Zr[OH]4, "(-2.1900)", 1.0, Zr+4, 4.0, H2O, -4.0, H+) @species(ZrF2+2,2) @logKreaction(ZrF2+2, "(18.5500)", 1.0, Zr+4, 2.0, F-) @species(ZrF3+,1) @logKreaction(ZrF3+, "(24.7200)", 1.0, Zr+4, 3.0, F-) @species(ZrF4,0, 0.00, 0.00) @logKreaction(ZrF4, "(30.1100)", 1.0, Zr+4, 4.0, F-) @species(ZrSO4+2,2) @logKreaction(ZrSO4+2, "(7.0400)", 1.0, Zr+4, 1.0, SO4-2) @species(ZrF6-2,-2) @logKreaction(ZrF6-2, "(38.1100)", 1.0, Zr+4, 6.0, F-) @species(ZrF+3,3) @logKreaction(ZrF+3, "(10.1200)", 1.0, Zr+4, 1.0, F-) @species(ZrF5-,-1) @logKreaction(ZrF5-, "(34.6000)", 1.0, Zr+4, 5.0, F-) @species(ZrCl+3,3) @logKreaction(ZrCl+3, "(1.5900)", 1.0, Zr+4, 1.0, Cl-) @species(ZrCl2+2,2) @logKreaction(ZrCl2+2, "(2.1700)", 1.0, Zr+4, 2.0, Cl-) @species(Zr[SO4]2,0, 0.00, 0.00) @logKreaction(Zr[SO4]2, "(11.5400)", 1.0, Zr+4, 2.0, SO4-2) @species(Zr[SO4]3-2,-2) @logKreaction(Zr[SO4]3-2, "(14.3000)", 1.0, Zr+4, 3.0, SO4-2) @species(ZrNO3+3,3) @logKreaction(ZrNO3+3, "(1.5900)", 1.0, Zr+4, 1.0, NO3-) @species(Zr[NO3]2+2,2) @logKreaction(Zr[NO3]2+2, "(2.6400)", 1.0, Zr+4, 2.0, NO3-) @species(Zr[CO3]4-4,-4) @logKreaction(Zr[CO3]4-4, "(42.9000)", 1.0, Zr+4, 4.0, CO3-2) @species(Zr[OH]2+2,2) @logKreaction(Zr[OH]2+2, "(0.9800)", 1.0, Zr+4, 2.0, H2O, -2.0, H+) @species(Zr[OH]6-2,-2) @logKreaction(Zr[OH]6-2, "(-29.0000)", 1.0, Zr+4, 6.0, H2O, -6.0, H+) @species(Zr3[OH]4+8,8) @logKreaction(Zr3[OH]4+8, "(0.4000)", 3.0, Zr+4, 4.0, H2O, -4.0, H+) @species(Zr3[OH]9+3,3) @logKreaction(Zr3[OH]9+3, "(12.1900)", 3.0, Zr+4, 9.0, H2O, -9.0, H+) @species(Zr4[OH]15+,1) @logKreaction(Zr4[OH]15+, "(12.5800)", 4.0, Zr+4, 15.0, H2O, -15.0, H+) @species(Zr4[OH]16,0, 0.00, 0.00) @logKreaction(Zr4[OH]16, "(8.3900)", 4.0, Zr+4, 16.0, H2O, -16.0, H+) @species(Zr4[OH]8+8,8) @logKreaction(Zr4[OH]8+8, "(6.5200)", 4.0, Zr+4, 8.0, H2O, -8.0, H+) @species(Ca2Zr[OH]6+2,2) @logKreaction(Ca2Zr[OH]6+2, "(-22.6000)", 2.0, Ca+2, 1.0, Zr+4, 6.0, H2O, -6.0, H+) @species(Ca3Zr[OH]6+4,4) @logKreaction(Ca3Zr[OH]6+4, "(-23.2000)", 3.0, Ca+2, 1.0, Zr+4, 6.0, H2O, -6.0, H+) @species(CaZr[OH]6,0, 0.00, 0.00) @logKreaction(CaZr[OH]6, "(-24.6000)", 1.0, Ca+2, 1.0, Zr+4, 6.0, H2O, -6.0, H+) @species(TcO+2,2) @logKreaction(TcO+2, "(4.0000)", 1.0, TcO[OH]2, 2.0, H+, -2.0, H2O) @species(TcO[OH]+,1) @logKreaction(TcO[OH]+, "(2.5000)", 1.0, TcO[OH]2, 1.0, H+, -1.0, H2O) @species(TcO[OH]3-,-1) @logKreaction(TcO[OH]3-, "(-10.9000)", 1.0, TcO[OH]2, 1.0, H2O, -1.0, H+) @species(TcCO3[OH]2,0, 0.00, 0.00) @logKreaction(TcCO3[OH]2, "(19.3000)", 1.0, TcO[OH]2, 1.0, CO3-2, 2.0, H+, -1.0, H2O) @species(TcCO3[OH]3-,-1) @logKreaction(TcCO3[OH]3-, "(11.0000)", 1.0, TcO[OH]2, 1.0, H+, 1.0, CO3-2) @species(PdCl+,1) @logKreaction(PdCl+, "(5.1000)", 1.0, Pd+2, 1.0, Cl-) @species(PdCl2,0, 0.00, 0.00) @logKreaction(PdCl2, "(8.3000)", 1.0, Pd+2, 2.0, Cl-) @species(PdCl3-,-1) @logKreaction(PdCl3-, "(10.9000)", 1.0, Pd+2, 3.0, Cl-) @species(PdCl4-2,-2) @logKreaction(PdCl4-2, "(11.7000)", 1.0, Pd+2, 4.0, Cl-) @species(PdNH3+2,2) @logKreaction(PdNH3+2, "(9.6000)", 1.0, Pd+2, 1.0, NH3) @species(Pd[NH3]2+2,2) @logKreaction(Pd[NH3]2+2, "(18.5000)", 1.0, Pd+2, 2.0, NH3) @species(Pd[NH3]3+2,2) @logKreaction(Pd[NH3]3+2, "(26.0000)", 1.0, Pd+2, 3.0, NH3) @species(Pd[NH3]4+2,2) @logKreaction(Pd[NH3]4+2, "(32.8000)", 1.0, Pd+2, 4.0, NH3) @species(Pd[OH]2,0, 0.00, 0.00) @logKreaction(Pd[OH]2, "(-4.0000)", 1.0, Pd+2, -2.0, H+, 2.0, H2O) @species(Pd[OH]3-,-1) @logKreaction(Pd[OH]3-, "(-15.5000)", 1.0, Pd+2, -3.0, H+, 3.0, H2O) @species(PdCl3OH-2,-2) @logKreaction(PdCl3OH-2, "(2.5000)", 1.0, Pd+2, 3.0, Cl-, 1.0, H2O, -1.0, H+) @species(PdCl2[OH]2-2,-2) @logKreaction(PdCl2[OH]2-2, "(-7.0000)", 1.0, Pd+2, 2.0, Cl-, 2.0, H2O, -2.0, H+) @species(TnOH+,1) @logKreaction(TnOH+, "(-3.8000)", 1.0, Tn+2, 1.0, H2O, -1.0, H+) @species(Tn[OH]3-,-1) @logKreaction(Tn[OH]3-, "(-17.5000)", 1.0, Tn+2, 3.0, H2O, -3.0, H+) @species(Tn3[OH]4+2,2) @logKreaction(Tn3[OH]4+2, "(-5.6000)", 3.0, Tn+2, 4.0, H2O, -4.0, H+) @species(TnCl+,1) @logKreaction(TnCl+, "(1.7000)", 1.0, Tn+2, 1.0, Cl-) @species(TnCl3-,-1) @logKreaction(TnCl3-, "(2.1000)", 1.0, Tn+2, 3.0, Cl-) @species(TnF+,1) @logKreaction(TnF+, "(5.0000)", 1.0, Tn+2, 1.0, F-) @species(Tn[OH]2,0, 0.00, 0.00) @logKreaction(Tn[OH]2, "(-7.7000)", 1.0, Tn+2, 2.0, H2O, -2.0, H+) @species(TnSO4,0, 0.00, 0.00) @logKreaction(TnSO4, "(2.6000)", 1.0, Tn+2, 1.0, SO4-2) @species(TnOHCl,0, 0.00, 0.00) @logKreaction(TnOHCl, "(-3.1000)", 1.0, Tn+2, 1.0, H2O, 1.0, Cl-, -1.0, H+) @species(TnCl2,0, 0.00, 0.00) @logKreaction(TnCl2, "(2.3600)", 1.0, Tn+2, 2.0, Cl-) @species(Sn[OH]5-,-1) @logKreaction(Sn[OH]5-, "(-8.0000)", 1.0, Sn[OH]4, 1.0, H2O, -1.0, H+) @species(Sn[OH]6-2,-2) @logKreaction(Sn[OH]6-2, "(-18.4000)", 1.0, Sn[OH]4, 2.0, H2O, -2.0, H+) @species(RaOH+,1) @logKreaction(RaOH+, "(0.5000)", 1.0, Ra+2, 1.0, OH-) @species(RaCl+,1) @logKreaction(RaCl+, "(-0.1000)", 1.0, Ra+2, 1.0, Cl-) @species(RaCO3,0, 0.00, 0.00) @logKreaction(RaCO3, "(2.5000)", 1.0, Ra+2, 1.0, CO3-2) @species(RaSO4,0, 0.00, 0.00) @logKreaction(RaSO4, "(2.7500)", 1.0, Ra+2, 1.0, SO4-2) @species(EuOH+2,2) @logKreaction(EuOH+2, "(-7.6400)", 1.0, Eu+3, 1.0, H2O, -1.0, H+) @species(Eu[OH]2+,1) @logKreaction(Eu[OH]2+, "(-15.1000)", 1.0, Eu+3, 2.0, H2O, -2.0, H+) @species(Eu[OH]3,0, 0.00, 0.00) @logKreaction(Eu[OH]3, "(-23.7000)", 1.0, Eu+3, 3.0, H2O, -3.0, H+) @species(Eu[OH]4-,-1) @logKreaction(Eu[OH]4-, "(-36.2000)", 1.0, Eu+3, 4.0, H2O, -4.0, H+) @species(EuCO3+,1) @logKreaction(EuCO3+, "(8.1000)", 1.0, Eu+3, 1.0, CO3-2) @species(Eu[CO3]2-,-1) @logKreaction(Eu[CO3]2-, "(12.1000)", 1.0, Eu+3, 2.0, CO3-2) @species(EuSO4+,1) @logKreaction(EuSO4+, "(3.9500)", 1.0, Eu+3, 1.0, SO4-2) @species(Eu[SO4]2-,-1) @logKreaction(Eu[SO4]2-, "(5.7000)", 1.0, Eu+3, 2.0, SO4-2) @species(EuF+2,2) @logKreaction(EuF+2, "(3.8000)", 1.0, Eu+3, 1.0, F-) @species(EuF2+,1) @logKreaction(EuF2+, "(6.5000)", 1.0, Eu+3, 2.0, F-) @species(EuCl+2,2) @logKreaction(EuCl+2, "(1.1000)", 1.0, Eu+3, 1.0, Cl-) @species(EuCl2+,1) @logKreaction(EuCl2+, "(1.5000)", 1.0, Eu+3, 2.0, Cl-) @species(EuSiO[OH]3+2,2) @logKreaction(EuSiO[OH]3+2, "(8.1000)", 1.0, Eu+3, 1.0, SiO[OH]3-) @species(ThOH+3,3) @logKreaction(ThOH+3, "(-2.5000)", 1.0, Th+4, 1.0, H2O, -1.0, H+) @species(Th[OH]4,0, 0.00, 0.00) @logKreaction(Th[OH]4, "(-17.4000)", 1.0, Th+4, 4.0, H2O, -4.0, H+) @species(ThF+3,3) @logKreaction(ThF+3, "(8.8700)", 1.0, Th+4, 1.0, F-) @species(ThF2+2,2) @logKreaction(ThF2+2, "(15.6300)", 1.0, Th+4, 2.0, F-) @species(ThF3+,1) @logKreaction(ThF3+, "(20.6700)", 1.0, Th+4, 3.0, F-) @species(ThF4,0, 0.00, 0.00) @logKreaction(ThF4, "(25.5800)", 1.0, Th+4, 4.0, F-) @species(Th[CO3]5-6,-6) @logKreaction(Th[CO3]5-6, "(31.0000)", 1.0, Th+4, 5.0, CO3-2) @species(Th[SO4]2,0, 0.00, 0.00) @logKreaction(Th[SO4]2, "(9.6900)", 1.0, Th+4, 2.0, SO4-2) @species(Th[SO4]3-2,-2) @logKreaction(Th[SO4]3-2, "(10.7480)", 1.0, Th+4, 3.0, SO4-2) @species(Th[OH]2+2,2) @logKreaction(Th[OH]2+2, "(-6.2000)", 1.0, Th+4, 2.0, H2O, -2.0, H+) @species(Th2[OH]2+6,6) @logKreaction(Th2[OH]2+6, "(-5.9000)", 2.0, Th+4, 2.0, H2O, -2.0, H+) @species(Th2[OH]3+5,5) @logKreaction(Th2[OH]3+5, "(-6.8000)", 2.0, Th+4, 3.0, H2O, -3.0, H+) @species(Th4[OH]8+8,8) @logKreaction(Th4[OH]8+8, "(-20.4000)", 4.0, Th+4, 8.0, H2O, -8.0, H+) @species(Th4[OH]12+4,4) @logKreaction(Th4[OH]12+4, "(-26.6000)", 4.0, Th+4, 12.0, H2O, -12.0, H+) @species(Th6[OH]14+10,10) @logKreaction(Th6[OH]14+10, "(-36.8000)", 6.0, Th+4, 14.0, H2O, -14.0, H+) @species(Th6[OH]15+9,9) @logKreaction(Th6[OH]15+9, "(-36.8000)", 6.0, Th+4, 15.0, H2O, -15.0, H+) @species(ThCl+3,3) @logKreaction(ThCl+3, "(1.7000)", 1.0, Th+4, 1.0, Cl-) @species(ThIO3+3,3) @logKreaction(ThIO3+3, "(4.1400)", 1.0, Th+4, 1.0, IO3-) @species(Th[IO3]2+2,2) @logKreaction(Th[IO3]2+2, "(6.9700)", 1.0, Th+4, 2.0, IO3-) @species(Th[IO3]3+,1) @logKreaction(Th[IO3]3+, "(9.8700)", 1.0, Th+4, 3.0, IO3-) @species(ThSO4+2,2) @logKreaction(ThSO4+2, "(6.1700)", 1.0, Th+4, 1.0, SO4-2) @species(ThNO3+3,3) @logKreaction(ThNO3+3, "(1.3000)", 1.0, Th+4, 1.0, NO3-) @species(Th[NO3]2+2,2) @logKreaction(Th[NO3]2+2, "(2.3000)", 1.0, Th+4, 2.0, NO3-) @species(ThH2PO4+3,3) @logKreaction(ThH2PO4+3, "(3.4500)", 1.0, Th+4, 1.0, H3PO4, -1.0, H+) @species(ThH3PO4+4,4) @logKreaction(ThH3PO4+4, "(1.8900)", 1.0, Th+4, 1.0, H3PO4) @species(Th[H2PO4]2+2,2) @logKreaction(Th[H2PO4]2+2, "(6.2000)", 1.0, Th+4, 2.0, H3PO4, -2.0, H+) @species(Th[H3PO4][H2PO4]+3,3) @logKreaction(Th[H3PO4][H2PO4]+3, "(5.4200)", 1.0, Th+4, 2.0, H3PO4, -1.0, H+) @species(ThOH[CO3]4-5,-5) @logKreaction(ThOH[CO3]4-5, "(35.6000)", 1.0, Th+4, 1.0, OH-, 4.0, CO3-2) @species(Th[OH]2[CO3]2-2,-2) @logKreaction(Th[OH]2[CO3]2-2, "(36.8000)", 1.0, Th+4, 2.0, OH-, 2.0, CO3-2) @species(Th[OH]4CO3-2,-2) @logKreaction(Th[OH]4CO3-2, "(40.4000)", 1.0, Th+4, 4.0, OH-, 1.0, CO3-2) @species(ThSCN+3,3) @logKreaction(ThSCN+3, "(2.0000)", 1.0, Th+4, 1.0, SCN-) @species(Th[SCN]2+2,2) @logKreaction(Th[SCN]2+2, "(3.4000)", 1.0, Th+4, 2.0, SCN-) @species(Ca4Th[OH]8+4,4) @logKreaction(Ca4Th[OH]8+4, "(-62.4000)", 4.0, Ca+2, 1.0, Th+4, 8.0, H2O, -8.0, H+) @species(ThF6-2,-2) @logKreaction(ThF6-2, "(29.2300)", 1.0, Th+4, 6.0, F-) @species(Th[OH]2CO3,0, 0.00, 0.00) @logKreaction(Th[OH]2CO3, "(30.5000)", 1.0, Th+4, 2.0, OH-, 1.0, CO3-2) @species(Th[OH]3CO3-,-1) @logKreaction(Th[OH]3CO3-, "(38.3000)", 1.0, Th+4, 3.0, OH-, 1.0, CO3-2) @species(Th[OH]3[SiO[OH]3]3-2,-2) @logKreaction(Th[OH]3[SiO[OH]3]3-2, "(-27.8000)", 1.0, Th+4, 3.0, Si[OH]4, 3.0, H2O, -6.0, H+) @species(UOH+3,3) @logKreaction(UOH+3, "(-0.5400)", 1.0, U+4, 1.0, H2O, -1.0, H+) @species(U[OH]4,0, 0.00, 0.00) @logKreaction(U[OH]4, "(-10.0000)", 1.0, U+4, 4.0, H2O, -4.0, H+) @species(UF+3,3) @logKreaction(UF+3, "(9.4200)", 1.0, U+4, 1.0, F-) @species(UF2+2,2) @logKreaction(UF2+2, "(16.5600)", 1.0, U+4, 2.0, F-) @species(UF3+,1) @logKreaction(UF3+, "(21.8900)", 1.0, U+4, 3.0, F-) @species(UF4,0, 0.00, 0.00) @logKreaction(UF4, "(26.3400)", 1.0, U+4, 4.0, F-) @species(UF5-,-1) @logKreaction(UF5-, "(27.7300)", 1.0, U+4, 5.0, F-) @species(UF6-2,-2) @logKreaction(UF6-2, "(29.8000)", 1.0, U+4, 6.0, F-) @species(UCl+3,3) @logKreaction(UCl+3, "(1.7200)", 1.0, U+4, 1.0, Cl-) @species(USO4+2,2) @logKreaction(USO4+2, "(6.5800)", 1.0, U+4, 1.0, SO4-2) @species(U[SO4]2,0, 0.00, 0.00) @logKreaction(U[SO4]2, "(10.5100)", 1.0, U+4, 2.0, SO4-2) @species(UNO3+3,3) @logKreaction(UNO3+3, "(1.4700)", 1.0, U+4, 1.0, NO3-) @species(U[NO3]2+2,2) @logKreaction(U[NO3]2+2, "(2.3000)", 1.0, U+4, 2.0, NO3-) @species(U[CO3]4-4,-4) @logKreaction(U[CO3]4-4, "(35.2200)", 1.0, U+4, 4.0, CO3-2) @species(U[CO3]5-6,-6) @logKreaction(U[CO3]5-6, "(34.1000)", 1.0, U+4, 5.0, CO3-2) @species(UI+3,3) @logKreaction(UI+3, "(1.2500)", 1.0, U+4, 1.0, I-) @species(USCN+3,3) @logKreaction(USCN+3, "(2.9700)", 1.0, U+4, 1.0, SCN-) @species(U[SCN]2+2,2) @logKreaction(U[SCN]2+2, "(4.2600)", 1.0, U+4, 2.0, SCN-) @species(U[OH]2+2,2) @logKreaction(U[OH]2+2, "(-1.1000)", 1.0, U+4, 2.0, H2O, -2.0, H+) @species(U[OH]3+,1) @logKreaction(U[OH]3+, "(-4.7000)", 1.0, U+4, 3.0, H2O, -3.0, H+) @species(UCO3[OH]3-,-1) @logKreaction(UCO3[OH]3-, "(4.0000)", 1.0, U+4, 1.0, CO3-2, 3.0, H2O, -3.0, H+) @species(UO2[CO3]3-5,-5) @logKreaction(UO2[CO3]3-5, "(6.9500)", 1.0, UO2+, 3.0, CO3-2) @species(UO2OH+,1) @logKreaction(UO2OH+, "(-5.2500)", 1.0, UO2+2, 1.0, H2O, -1.0, H+) @species(UO2[OH]2,0, 0.00, 0.00) @logKreaction(UO2[OH]2, "(-12.1500)", 1.0, UO2+2, 2.0, H2O, -2.0, H+) @species(UO2[OH]3-,-1) @logKreaction(UO2[OH]3-, "(-20.2500)", 1.0, UO2+2, 3.0, H2O, -3.0, H+) @species(UO2[OH]4-2,-2) @logKreaction(UO2[OH]4-2, "(-32.4000)", 1.0, UO2+2, 4.0, H2O, -4.0, H+) @species([UO2]2OH+3,3) @logKreaction([UO2]2OH+3, "(-2.7000)", 2.0, UO2+2, 1.0, H2O, -1.0, H+) @species([UO2]2[OH]2+2,2) @logKreaction([UO2]2[OH]2+2, "(-5.6200)", 2.0, UO2+2, 2.0, H2O, -2.0, H+) @species([UO2]3[OH]4+2,2) @logKreaction([UO2]3[OH]4+2, "(-11.9000)", 3.0, UO2+2, 4.0, H2O, -4.0, H+) @species([UO2]3[OH]5+,1) @logKreaction([UO2]3[OH]5+, "(-15.5500)", 3.0, UO2+2, 5.0, H2O, -5.0, H+) @species([UO2]3[OH]7-,-1) @logKreaction([UO2]3[OH]7-, "(-32.2000)", 3.0, UO2+2, 7.0, H2O, -7.0, H+) @species([UO2]4[OH]7+,1) @logKreaction([UO2]4[OH]7+, "(-21.9000)", 4.0, UO2+2, 7.0, H2O, -7.0, H+) @species(UO2F+,1) @logKreaction(UO2F+, "(5.1600)", 1.0, UO2+2, 1.0, F-) @species(UO2F2,0, 0.00, 0.00) @logKreaction(UO2F2, "(8.8300)", 1.0, UO2+2, 2.0, F-) @species(UO2F3-,-1) @logKreaction(UO2F3-, "(10.9000)", 1.0, UO2+2, 3.0, F-) @species(UO2F4-2,-2) @logKreaction(UO2F4-2, "(11.8400)", 1.0, UO2+2, 4.0, F-) @species(UO2Cl+,1) @logKreaction(UO2Cl+, "(0.1700)", 1.0, UO2+2, 1.0, Cl-) @species(UO2Cl2,0, 0.00, 0.00) @logKreaction(UO2Cl2, "(-1.1000)", 1.0, UO2+2, 2.0, Cl-) @species(UO2SO4,0, 0.00, 0.00) @logKreaction(UO2SO4, "(3.1500)", 1.0, UO2+2, 1.0, SO4-2) @species(UO2[SO4]2-2,-2) @logKreaction(UO2[SO4]2-2, "(4.1400)", 1.0, UO2+2, 2.0, SO4-2) @species(UO2NO3+,1) @logKreaction(UO2NO3+, "(0.3000)", 1.0, UO2+2, 1.0, NO3-) @species(UO2PO4-,-1) @logKreaction(UO2PO4-, "(13.2300)", 1.0, UO2+2, 1.0, PO4-3) @species(UO2HPO4,0, 0.00, 0.00) @logKreaction(UO2HPO4, "(7.2400)", 1.0, UO2+2, 1.0, HPO4-2) @species(UO2H2PO4+,1) @logKreaction(UO2H2PO4+, "(1.1200)", 1.0, UO2+2, 1.0, H3PO4, -1.0, H+) @species(UO2H3PO4+2,2) @logKreaction(UO2H3PO4+2, "(0.7600)", 1.0, UO2+2, 1.0, H3PO4) @species(UO2[H2PO4]2,0, 0.00, 0.00) @logKreaction(UO2[H2PO4]2, "(0.6400)", 1.0, UO2+2, 2.0, H3PO4, -2.0, H+) @species(UO2CO3,0, 0.00, 0.00) @logKreaction(UO2CO3, "(9.9400)", 1.0, UO2+2, 1.0, CO3-2) @species(UO2[CO3]2-2,-2) @logKreaction(UO2[CO3]2-2, "(16.6100)", 1.0, UO2+2, 2.0, CO3-2) @species(UO2[CO3]3-4,-4) @logKreaction(UO2[CO3]3-4, "(21.8400)", 1.0, UO2+2, 3.0, CO3-2) @species([UO2]3[CO3]6-6,-6) @logKreaction([UO2]3[CO3]6-6, "(54.0000)", 3.0, UO2+2, 6.0, CO3-2) @species([UO2]2CO3[OH]3-,-1) @logKreaction([UO2]2CO3[OH]3-, "(-0.8600)", 2.0, UO2+2, 3.0, H2O, -3.0, H+, 1.0, CO3-2) @species(UO2H2PO4H3PO4+,1) @logKreaction(UO2H2PO4H3PO4+, "(1.6500)", 1.0, UO2+2, 2.0, H3PO4, -1.0, H+) @species([UO2]3O[OH]2HCO3+,1) @logKreaction([UO2]3O[OH]2HCO3+, "(0.6600)", 3.0, UO2+2, 1.0, CO3-2, 3.0, H2O, -3.0, H+) @species(UO2IO3+,1) @logKreaction(UO2IO3+, "(2.0000)", 1.0, UO2+2, 1.0, IO3-) @species(UO2[IO3]2,0, 0.00, 0.00) @logKreaction(UO2[IO3]2, "(3.5900)", 1.0, UO2+2, 2.0, IO3-) @species(UO2[SO4]3-4,-4) @logKreaction(UO2[SO4]3-4, "(3.0200)", 1.0, UO2+2, 3.0, SO4-2) @species(UO2HAsO4,0, 0.00, 0.00) @logKreaction(UO2HAsO4, "(7.1600)", 1.0, UO2+2, 1.0, HAsO4-2) @species(UO2H2AsO4+,1) @logKreaction(UO2H2AsO4+, "(1.3400)", 1.0, UO2+2, 1.0, H3AsO4, -1.0, H+) @species(UO2[H2AsO4]2,0, 0.00, 0.00) @logKreaction(UO2[H2AsO4]2, "(0.2900)", 1.0, UO2+2, 2.0, H3AsO4, -2.0, H+) @species(UO2CO3F-,-1) @logKreaction(UO2CO3F-, "(13.7500)", 1.0, UO2+2, 1.0, CO3-2, 1.0, F-) @species(UO2CO3F2-2,-2) @logKreaction(UO2CO3F2-2, "(15.5700)", 1.0, UO2+2, 1.0, CO3-2, 2.0, F-) @species(UO2CO3F3-3,-3) @logKreaction(UO2CO3F3-3, "(16.3800)", 1.0, UO2+2, 1.0, CO3-2, 3.0, F-) @species(UO2SiO[OH]3+,1) @logKreaction(UO2SiO[OH]3+, "(7.8000)", 1.0, UO2+2, 1.0, SiO[OH]3-) @species(UO2SCN+,1) @logKreaction(UO2SCN+, "(1.4000)", 1.0, UO2+2, 1.0, SCN-) @species(UO2[SCN]2,0, 0.00, 0.00) @logKreaction(UO2[SCN]2, "(1.2400)", 1.0, UO2+2, 2.0, SCN-) @species(UO2[SCN]3-,-1) @logKreaction(UO2[SCN]3-, "(2.1000)", 1.0, UO2+2, 3.0, SCN-) @species(MgUO2[CO3]3-2,-2) @logKreaction(MgUO2[CO3]3-2, "(26.1100)", 1.0, Mg+2, 1.0, UO2+2, 3.0, CO3-2) @species(CaUO2[CO3]3-2,-2) @logKreaction(CaUO2[CO3]3-2, "(27.1800)", 1.0, Ca+2, 1.0, UO2+2, 3.0, CO3-2) @species(Ca2UO2[CO3]3,0, 0.00, 0.00) @logKreaction(Ca2UO2[CO3]3, "(29.2200)", 2.0, Ca+2, 1.0, UO2+2, 3.0, CO3-2) @species(SrUO2[CO3]3-2,-2) @logKreaction(SrUO2[CO3]3-2, "(26.8600)", 1.0, Sr+2, 1.0, UO2+2, 3.0, CO3-2) @species(BaUO2[CO3]3-2,-2) @logKreaction(BaUO2[CO3]3-2, "(26.6800)", 1.0, Ba+2, 1.0, UO2+2, 3.0, CO3-2) @species(Ba2UO2[CO3]3,0, 0.00, 0.00) @logKreaction(Ba2UO2[CO3]3, "(29.7500)", 2.0, Ba+2, 1.0, UO2+2, 3.0, CO3-2) @species(NpOH+2,2) @logKreaction(NpOH+2, "(-6.8000)", 1.0, Np+3, 1.0, H2O, -1.0, H+) @species(Np[OH]2+,1) @logKreaction(Np[OH]2+, "(-14.7000)", 1.0, Np+3, 2.0, H2O, -2.0, H+) @species(Np[OH]3,0, 0.00, 0.00) @logKreaction(Np[OH]3, "(-25.8000)", 1.0, Np+3, 3.0, H2O, -3.0, H+) @species(NpF+2,2) @logKreaction(NpF+2, "(3.4000)", 1.0, Np+3, 1.0, F-) @species(NpF2+,1) @logKreaction(NpF2+, "(5.8000)", 1.0, Np+3, 2.0, F-) @species(NpCl+2,2) @logKreaction(NpCl+2, "(0.2400)", 1.0, Np+3, 1.0, Cl-) @species(NpCl2+,1) @logKreaction(NpCl2+, "(-0.7400)", 1.0, Np+3, 2.0, Cl-) @species(NpSO4+,1) @logKreaction(NpSO4+, "(3.3000)", 1.0, Np+3, 1.0, SO4-2) @species(Np[SO4]2-,-1) @logKreaction(Np[SO4]2-, "(3.7000)", 1.0, Np+3, 2.0, SO4-2) @species(NpCO3+,1) @logKreaction(NpCO3+, "(8.0000)", 1.0, Np+3, 1.0, CO3-2) @species(Np[CO3]2-,-1) @logKreaction(Np[CO3]2-, "(12.9000)", 1.0, Np+3, 2.0, CO3-2) @species(Np[CO3]3-3,-3) @logKreaction(Np[CO3]3-3, "(15.0000)", 1.0, Np+3, 3.0, CO3-2) @species(NpSiO[OH]3+2,2) @logKreaction(NpSiO[OH]3+2, "(8.1000)", 1.0, Np+3, 1.0, SiO[OH]3-) @species(NpOH+3,3) @logKreaction(NpOH+3, "(0.5500)", 1.0, Np+4, 1.0, H2O, -1.0, H+) @species(Np[OH]4,0, 0.00, 0.00) @logKreaction(Np[OH]4, "(-8.3000)", 1.0, Np+4, 4.0, H2O, -4.0, H+) @species(NpF+3,3) @logKreaction(NpF+3, "(8.9600)", 1.0, Np+4, 1.0, F-) @species(NpF2+2,2) @logKreaction(NpF2+2, "(15.7000)", 1.0, Np+4, 2.0, F-) @species(NpCl+3,3) @logKreaction(NpCl+3, "(1.5000)", 1.0, Np+4, 1.0, Cl-) @species(NpSO4+2,2) @logKreaction(NpSO4+2, "(6.8500)", 1.0, Np+4, 1.0, SO4-2) @species(Np[SO4]2,0, 0.00, 0.00) @logKreaction(Np[SO4]2, "(11.0500)", 1.0, Np+4, 2.0, SO4-2) @species(NpNO3+3,3) @logKreaction(NpNO3+3, "(1.9000)", 1.0, Np+4, 1.0, NO3-) @species(Np[CO3]4-4,-4) @logKreaction(Np[CO3]4-4, "(38.9000)", 1.0, Np+4, 4.0, CO3-2) @species(Np[CO3]5-6,-6) @logKreaction(Np[CO3]5-6, "(37.8000)", 1.0, Np+4, 5.0, CO3-2) @species(Np[OH]2+2,2) @logKreaction(Np[OH]2+2, "(0.3500)", 1.0, Np+4, 2.0, H2O, -2.0, H+) @species(NpI+3,3) @logKreaction(NpI+3, "(1.5000)", 1.0, Np+4, 1.0, I-) @species(NpSCN+3,3) @logKreaction(NpSCN+3, "(3.0000)", 1.0, Np+4, 1.0, SCN-) @species(Np[SCN]2+2,2) @logKreaction(Np[SCN]2+2, "(4.1000)", 1.0, Np+4, 2.0, SCN-) @species(Np[SCN]3+,1) @logKreaction(Np[SCN]3+, "(4.8000)", 1.0, Np+4, 3.0, SCN-) @species(Np[OH]3+,1) @logKreaction(Np[OH]3+, "(-2.8000)", 1.0, Np+4, 3.0, H2O, -3.0, H+) @species(NpCO3[OH]3-,-1) @logKreaction(NpCO3[OH]3-, "(2.0000)", 1.0, Np+4, 1.0, CO3-2, 3.0, H2O, -3.0, H+) @species(NpSiO[OH]3+3,3) @logKreaction(NpSiO[OH]3+3, "(11.2000)", 1.0, Np+4, 1.0, SiO[OH]3-) @species(NpO2[OH],0, 0.00, 0.00) @logKreaction(NpO2[OH], "(-11.3000)", 1.0, NpO2+, 1.0, H2O, -1.0, H+) @species(NpO2[OH]2-,-1) @logKreaction(NpO2[OH]2-, "(-23.6000)", 1.0, NpO2+, 2.0, H2O, -2.0, H+) @species(NpO2F,0, 0.00, 0.00) @logKreaction(NpO2F, "(1.2000)", 1.0, NpO2+, 1.0, F-) @species(NpO2SO4-,-1) @logKreaction(NpO2SO4-, "(0.4400)", 1.0, NpO2+, 1.0, SO4-2) @species(NpO2HPO4-,-1) @logKreaction(NpO2HPO4-, "(2.9500)", 1.0, NpO2+, 1.0, HPO4-2) @species(NpO2CO3-,-1) @logKreaction(NpO2CO3-, "(4.9600)", 1.0, NpO2+, 1.0, CO3-2) @species(NpO2[CO3]2-3,-3) @logKreaction(NpO2[CO3]2-3, "(6.5300)", 1.0, NpO2+, 2.0, CO3-2) @species(NpO2[CO3]3-5,-5) @logKreaction(NpO2[CO3]3-5, "(5.5000)", 1.0, NpO2+, 3.0, CO3-2) @species(NpO2[CO3]2OH-4,-4) @logKreaction(NpO2[CO3]2OH-4, "(-5.3000)", 1.0, NpO2+, 2.0, CO3-2, 1.0, H2O, -1.0, H+) @species(NpO2IO3,0, 0.00, 0.00) @logKreaction(NpO2IO3, "(0.5000)", 1.0, NpO2+, 1.0, IO3-) @species(NpO2SiO[OH]3,0, 0.00, 0.00) @logKreaction(NpO2SiO[OH]3, "(7.0000)", 1.0, NpO2+, 1.0, SiO[OH]3-) @species(NpO2SCN,0, 0.00, 0.00) @logKreaction(NpO2SCN, "(0.0800)", 1.0, NpO2+, 1.0, SCN-) @species(NpO2OH+,1) @logKreaction(NpO2OH+, "(-5.1000)", 1.0, NpO2+2, 1.0, H2O, -1.0, H+) @species([NpO2]2[OH]2+2,2) @logKreaction([NpO2]2[OH]2+2, "(-6.2700)", 2.0, NpO2+2, 2.0, H2O, -2.0, H+) @species([NpO2]3[OH]5+,1) @logKreaction([NpO2]3[OH]5+, "(-17.1200)", 3.0, NpO2+2, 5.0, H2O, -5.0, H+) @species(NpO2F+,1) @logKreaction(NpO2F+, "(4.5700)", 1.0, NpO2+2, 1.0, F-) @species(NpO2F2,0, 0.00, 0.00) @logKreaction(NpO2F2, "(7.6000)", 1.0, NpO2+2, 2.0, F-) @species(NpO2Cl+,1) @logKreaction(NpO2Cl+, "(0.4000)", 1.0, NpO2+2, 1.0, Cl-) @species(NpO2SO4,0, 0.00, 0.00) @logKreaction(NpO2SO4, "(3.2800)", 1.0, NpO2+2, 1.0, SO4-2) @species(NpO2[SO4]2-2,-2) @logKreaction(NpO2[SO4]2-2, "(4.7000)", 1.0, NpO2+2, 2.0, SO4-2) @species(NpO2CO3,0, 0.00, 0.00) @logKreaction(NpO2CO3, "(9.3200)", 1.0, NpO2+2, 1.0, CO3-2) @species(NpO2[CO3]2-2,-2) @logKreaction(NpO2[CO3]2-2, "(16.5200)", 1.0, NpO2+2, 2.0, CO3-2) @species(NpO2[CO3]3-4,-4) @logKreaction(NpO2[CO3]3-4, "(19.3700)", 1.0, NpO2+2, 3.0, CO3-2) @species([NpO2]3[CO3]6-6,-6) @logKreaction([NpO2]3[CO3]6-6, "(49.8400)", 3.0, NpO2+2, 6.0, CO3-2) @species([NpO2]2CO3[OH]3-,-1) @logKreaction([NpO2]2CO3[OH]3-, "(-2.8700)", 2.0, NpO2+2, 1.0, CO3-2, 3.0, H2O, -3.0, H+) @species(NpO2HPO4,0, 0.00, 0.00) @logKreaction(NpO2HPO4, "(6.2000)", 1.0, NpO2+2, 1.0, HPO4-2) @species(NpO2H2PO4+,1) @logKreaction(NpO2H2PO4+, "(3.3200)", 1.0, NpO2+2, 1.0, H2PO4-) @species(NpO2[HPO4]2-2,-2) @logKreaction(NpO2[HPO4]2-2, "(9.5000)", 1.0, NpO2+2, 2.0, HPO4-2) @species(NpO2IO3+,1) @logKreaction(NpO2IO3+, "(1.2000)", 1.0, NpO2+2, 1.0, IO3-) @species(NpO2[OH]3-,-1) @logKreaction(NpO2[OH]3-, "(-20.0000)", 1.0, NpO2+2, 3.0, H2O, -3.0, H+) @species(NpO2[OH]4-2,-2) @logKreaction(NpO2[OH]4-2, "(-32.0000)", 1.0, NpO2+2, 4.0, H2O, -4.0, H+) @species(NpO2SiO[OH]3+,1) @logKreaction(NpO2SiO[OH]3+, "(7.2000)", 1.0, NpO2+2, 1.0, SiO[OH]3-) @species(NpO2SiO2[OH]2,0, 0.00, 0.00) @logKreaction(NpO2SiO2[OH]2, "(16.5000)", 1.0, NpO2+2, 1.0, SiO2[OH]2-2) @species(PuOH+2,2) @logKreaction(PuOH+2, "(-6.9000)", 1.0, Pu+3, 1.0, H2O, -1.0, H+) @species(PuSO4+,1) @logKreaction(PuSO4+, "(3.9000)", 1.0, Pu+3, 1.0, SO4-2) @species(Pu[SO4]2-,-1) @logKreaction(Pu[SO4]2-, "(5.7000)", 1.0, Pu+3, 2.0, SO4-2) @species(PuSCN+2,2) @logKreaction(PuSCN+2, "(1.3000)", 1.0, Pu+3, 1.0, SCN-) @species(Pu[OH]2+,1) @logKreaction(Pu[OH]2+, "(-14.8000)", 1.0, Pu+3, 2.0, H2O, -2.0, H+) @species(Pu[OH]3,0, 0.00, 0.00) @logKreaction(Pu[OH]3, "(-25.9000)", 1.0, Pu+3, 3.0, H2O, -3.0, H+) @species(PuF+2,2) @logKreaction(PuF+2, "(3.4000)", 1.0, Pu+3, 1.0, F-) @species(PuF2+,1) @logKreaction(PuF2+, "(5.8000)", 1.0, Pu+3, 2.0, F-) @species(PuCl+2,2) @logKreaction(PuCl+2, "(1.2000)", 1.0, Pu+3, 1.0, Cl-) @species(PuCO3+,1) @logKreaction(PuCO3+, "(8.0000)", 1.0, Pu+3, 1.0, CO3-2) @species(Pu[CO3]2-,-1) @logKreaction(Pu[CO3]2-, "(12.9000)", 1.0, Pu+3, 2.0, CO3-2) @species(Pu[CO3]3-3,-3) @logKreaction(Pu[CO3]3-3, "(15.0000)", 1.0, Pu+3, 3.0, CO3-2) @species(PuSiO[OH]3+2,2) @logKreaction(PuSiO[OH]3+2, "(8.1000)", 1.0, Pu+3, 1.0, SiO[OH]3-) @species(PuOH+3,3) @logKreaction(PuOH+3, "(0.0000)", 1.0, Pu+4, 1.0, H2O, -1.0, H+) @species(Pu[OH]4,0, 0.00, 0.00) @logKreaction(Pu[OH]4, "(-9.3000)", 1.0, Pu+4, 4.0, H2O, -4.0, H+) @species(PuF+3,3) @logKreaction(PuF+3, "(8.8400)", 1.0, Pu+4, 1.0, F-) @species(PuF2+2,2) @logKreaction(PuF2+2, "(15.7000)", 1.0, Pu+4, 2.0, F-) @species(PuCl+3,3) @logKreaction(PuCl+3, "(1.8000)", 1.0, Pu+4, 1.0, Cl-) @species(PuSO4+2,2) @logKreaction(PuSO4+2, "(6.8900)", 1.0, Pu+4, 1.0, SO4-2) @species(Pu[SO4]2,0, 0.00, 0.00) @logKreaction(Pu[SO4]2, "(11.1400)", 1.0, Pu+4, 2.0, SO4-2) @species(PuNO3+3,3) @logKreaction(PuNO3+3, "(1.9500)", 1.0, Pu+4, 1.0, NO3-) @species(PuH3PO4+4,4) @logKreaction(PuH3PO4+4, "(2.4000)", 1.0, Pu+4, 1.0, H3PO4) @species(Pu[CO3]4-4,-4) @logKreaction(Pu[CO3]4-4, "(37.0000)", 1.0, Pu+4, 4.0, CO3-2) @species(Pu[CO3]5-6,-6) @logKreaction(Pu[CO3]5-6, "(35.6500)", 1.0, Pu+4, 5.0, CO3-2) @species(Pu[OH]2+2,2) @logKreaction(Pu[OH]2+2, "(-1.2000)", 1.0, Pu+4, 2.0, H2O, -2.0, H+) @species(Pu[OH]3+,1) @logKreaction(Pu[OH]3+, "(-3.1000)", 1.0, Pu+4, 3.0, H2O, -3.0, H+) @species(PuSiO[OH]3+3,3) @logKreaction(PuSiO[OH]3+3, "(11.8000)", 1.0, Pu+4, 1.0, SiO[OH]3-) @species(Ca4Pu[OH]8+4,4) @logKreaction(Ca4Pu[OH]8+4, "(-55.7000)", 4.0, Ca+2, 1.0, Pu+4, 8.0, H2O, -8.0, H+) @species(PuCO3[OH]3-,-1) @logKreaction(PuCO3[OH]3-, "(6.0000)", 1.0, Pu+4, 1.0, CO3-2, 3.0, H2O, -3.0, H+) @species(PuO2OH,0, 0.00, 0.00) @logKreaction(PuO2OH, "(-9.7300)", 1.0, PuO2+, 1.0, H2O, -1.0, H+) @species(PuO2CO3-,-1) @logKreaction(PuO2CO3-, "(5.1200)", 1.0, PuO2+, 1.0, CO3-2) @species(PuO2[CO3]3-5,-5) @logKreaction(PuO2[CO3]3-5, "(5.0300)", 1.0, PuO2+, 3.0, CO3-2) @species(PuO2OH+,1) @logKreaction(PuO2OH+, "(-5.5000)", 1.0, PuO2+2, 1.0, H2O, -1.0, H+) @species(PuO2[OH]2,0, 0.00, 0.00) @logKreaction(PuO2[OH]2, "(-13.2000)", 1.0, PuO2+2, 2.0, H2O, -2.0, H+) @species([PuO2]2[OH]2+2,2) @logKreaction([PuO2]2[OH]2+2, "(-7.5000)", 2.0, PuO2+2, 2.0, H2O, -2.0, H+) @species(PuO2F+,1) @logKreaction(PuO2F+, "(4.5600)", 1.0, PuO2+2, 1.0, F-) @species(PuO2F2,0, 0.00, 0.00) @logKreaction(PuO2F2, "(7.2500)", 1.0, PuO2+2, 2.0, F-) @species(PuO2Cl+,1) @logKreaction(PuO2Cl+, "(0.2300)", 1.0, PuO2+2, 1.0, Cl-) @species(PuO2Cl2,0, 0.00, 0.00) @logKreaction(PuO2Cl2, "(-1.1500)", 1.0, PuO2+2, 2.0, Cl-) @species(PuO2SO4,0, 0.00, 0.00) @logKreaction(PuO2SO4, "(3.3800)", 1.0, PuO2+2, 1.0, SO4-2) @species(PuO2[SO4]2-2,-2) @logKreaction(PuO2[SO4]2-2, "(4.4000)", 1.0, PuO2+2, 2.0, SO4-2) @species(PuO2CO3,0, 0.00, 0.00) @logKreaction(PuO2CO3, "(9.5000)", 1.0, PuO2+2, 1.0, CO3-2) @species(PuO2[CO3]2-2,-2) @logKreaction(PuO2[CO3]2-2, "(14.7000)", 1.0, PuO2+2, 2.0, CO3-2) @species(PuO2[CO3]3-4,-4) @logKreaction(PuO2[CO3]3-4, "(18.0000)", 1.0, PuO2+2, 3.0, CO3-2) @species(PuO2SiO[OH]3+,1) @logKreaction(PuO2SiO[OH]3+, "(6.0000)", 1.0, PuO2+2, 1.0, SiO[OH]3-) @species(PuO2SiO2[OH]2,0, 0.00, 0.00) @logKreaction(PuO2SiO2[OH]2, "(12.6000)", 1.0, PuO2+2, 1.0, SiO2[OH]2-2) @species([UO2]2NpO2[CO3]6-6,-6) @logKreaction([UO2]2NpO2[CO3]6-6, "(53.5900)", 2.0, UO2+2, 1.0, NpO2+2, 6.0, CO3-2) @species([UO2]2PuO2[CO3]6-6,-6) @logKreaction([UO2]2PuO2[CO3]6-6, "(52.7000)", 2.0, UO2+2, 1.0, PuO2+2, 6.0, CO3-2) @species(AmOH+2,2) @logKreaction(AmOH+2, "(-7.2000)", 1.0, Am+3, 1.0, H2O, -1.0, H+) @species(Am[OH]2+,1) @logKreaction(Am[OH]2+, "(-15.1000)", 1.0, Am+3, 2.0, H2O, -2.0, H+) @species(Am[OH]3,0, 0.00, 0.00) @logKreaction(Am[OH]3, "(-26.2000)", 1.0, Am+3, 3.0, H2O, -3.0, H+) @species(AmF+2,2) @logKreaction(AmF+2, "(3.4000)", 1.0, Am+3, 1.0, F-) @species(AmF2+,1) @logKreaction(AmF2+, "(5.8000)", 1.0, Am+3, 2.0, F-) @species(AmCl+2,2) @logKreaction(AmCl+2, "(0.2400)", 1.0, Am+3, 1.0, Cl-) @species(AmSO4+,1) @logKreaction(AmSO4+, "(3.3000)", 1.0, Am+3, 1.0, SO4-2) @species(Am[SO4]2-,-1) @logKreaction(Am[SO4]2-, "(3.7000)", 1.0, Am+3, 2.0, SO4-2) @species(AmNO3+2,2) @logKreaction(AmNO3+2, "(1.3300)", 1.0, Am+3, 1.0, NO3-) @species(AmH2PO4+2,2) @logKreaction(AmH2PO4+2, "(3.0000)", 1.0, Am+3, 1.0, H2PO4-) @species(AmCO3+,1) @logKreaction(AmCO3+, "(8.0000)", 1.0, Am+3, 1.0, CO3-2) @species(Am[CO3]2-,-1) @logKreaction(Am[CO3]2-, "(12.9000)", 1.0, Am+3, 2.0, CO3-2) @species(Am[CO3]3-3,-3) @logKreaction(Am[CO3]3-3, "(15.0000)", 1.0, Am+3, 3.0, CO3-2) @species(AmSiO[OH]3+2,2) @logKreaction(AmSiO[OH]3+2, "(8.1000)", 1.0, Am+3, 1.0, SiO[OH]3-) @species(AmCl2+,1) @logKreaction(AmCl2+, "(-0.7400)", 1.0, Am+3, 2.0, Cl-) @species(AmHCO3+2,2) @logKreaction(AmHCO3+2, "(3.1000)", 1.0, Am+3, 1.0, HCO3-) @species(AmSCN+2,2) @logKreaction(AmSCN+2, "(1.3000)", 1.0, Am+3, 1.0, SCN-) @species(CaAm[OH]3+2,2) @logKreaction(CaAm[OH]3+2, "(-26.3000)", 1.0, Ca+2, 1.0, Am+3, 3.0, H2O, -3.0, H+) @species(Ca2Am[OH]4+3,3) @logKreaction(Ca2Am[OH]4+3, "(-37.2000)", 2.0, Ca+2, 1.0, Am+3, 4.0, H2O, -4.0, H+) @species(Ca3Am[OH]6+3,3) @logKreaction(Ca3Am[OH]6+3, "(-60.7000)", 3.0, Ca+2, 1.0, Am+3, 6.0, H2O, -6.0, H+) @species(AmO2OH,0, 0.00, 0.00) @logKreaction(AmO2OH, "(-11.3000)", 1.0, AmO2+, 1.0, H2O, -1.0, H+) @species(AmO2[OH]2-,-1) @logKreaction(AmO2[OH]2-, "(-23.6000)", 1.0, AmO2+, 2.0, H2O, -2.0, H+) @species(AmO2CO3-,-1) @logKreaction(AmO2CO3-, "(5.1000)", 1.0, AmO2+, 1.0, CO3-2) @species(AmO2[CO3]2-3,-3) @logKreaction(AmO2[CO3]2-3, "(6.7000)", 1.0, AmO2+, 2.0, CO3-2) @species(AmO2[CO3]3-5,-5) @logKreaction(AmO2[CO3]3-5, "(5.1000)", 1.0, AmO2+, 3.0, CO3-2) @species(CmOH+2,2) @logKreaction(CmOH+2, "(-7.2000)", 1.0, Cm+3, 1.0, H2O, -1.0, H+) @species(Cm[OH]2+,1) @logKreaction(Cm[OH]2+, "(-15.1000)", 1.0, Cm+3, 2.0, H2O, -2.0, H+) @species(Cm[OH]3,0, 0.00, 0.00) @logKreaction(Cm[OH]3, "(-26.2000)", 1.0, Cm+3, 3.0, H2O, -3.0, H+) @species(CmF+2,2) @logKreaction(CmF+2, "(3.4000)", 1.0, Cm+3, 1.0, F-) @species(CmF2+,1) @logKreaction(CmF2+, "(5.8000)", 1.0, Cm+3, 2.0, F-) @species(CmCl+2,2) @logKreaction(CmCl+2, "(0.2400)", 1.0, Cm+3, 1.0, Cl-) @species(CmCl2+,1) @logKreaction(CmCl2+, "(-0.7400)", 1.0, Cm+3, 2.0, Cl-) @species(CmSO4+,1) @logKreaction(CmSO4+, "(3.3000)", 1.0, Cm+3, 1.0, SO4-2) @species(Cm[SO4]2-,-1) @logKreaction(Cm[SO4]2-, "(3.7000)", 1.0, Cm+3, 2.0, SO4-2) @species(CmNO3+2,2) @logKreaction(CmNO3+2, "(1.3300)", 1.0, Cm+3, 1.0, NO3-) @species(CmH2PO4+2,2) @logKreaction(CmH2PO4+2, "(3.0000)", 1.0, Cm+3, 1.0, H2PO4-) @species(CmCO3+,1) @logKreaction(CmCO3+, "(8.0000)", 1.0, Cm+3, 1.0, CO3-2) @species(Cm[CO3]2-,-1) @logKreaction(Cm[CO3]2-, "(12.9000)", 1.0, Cm+3, 2.0, CO3-2) @species(Cm[CO3]3-3,-3) @logKreaction(Cm[CO3]3-3, "(15.0000)", 1.0, Cm+3, 3.0, CO3-2) @species(CmHCO3+2,2) @logKreaction(CmHCO3+2, "(3.1000)", 1.0, Cm+3, 1.0, HCO3-) @species(CmSiO[OH]3+2,2) @logKreaction(CmSiO[OH]3+2, "(8.1000)", 1.0, Cm+3, 1.0, SiO[OH]3-) @species(CmSCN+2,2) @logKreaction(CmSCN+2, "(1.3000)", 1.0, Cm+3, 1.0, SCN-) @species(CaCm[OH]3+2,2) @logKreaction(CaCm[OH]3+2, "(-26.3000)", 1.0, Ca+2, 1.0, Cm+3, 3.0, H2O, -3.0, H+) @species(Ca2Cm[OH]4+3,3) @logKreaction(Ca2Cm[OH]4+3, "(-37.2000)", 2.0, Ca+2, 1.0, Cm+3, 4.0, H2O, -4.0, H+) @species(Ca3Cm[OH]6+3,3) @logKreaction(Ca3Cm[OH]6+3, "(-60.7000)", 3.0, Ca+2, 1.0, Cm+3, 6.0, H2O, -6.0, H+) @mineral(Anhydrite[s]) @logKreaction(Anhydrite[s], "-1 * (-4.3575)", 1.0, Ca+2, 1.0, SO4-2) @mineral(Aragonite[s]) @logKreaction(Aragonite[s], "-1 * (1.9928)", 1.0, Ca+2, -1.0, H+, 1.0, HCO3-) @mineral(As[cr][s]) @logKreaction(As[cr][s], "-1 * (-40.9892)", 1.0, HAsO4-2, 7.0, H+, 5.0, e-, -4.0, H2O) @mineral(Barite[s]) @logKreaction(Barite[s], "-1 * (-9.9704)", 1.0, Ba+2, 1.0, SO4-2) @mineral(Brucite[s]) @logKreaction(Brucite[s], "-1 * (16.8400)", 1.0, Mg+2, 2.0, H2O, -2.0, H+) @mineral(Calcite[s]) @logKreaction(Calcite[s], "-1 * (1.8490)", 1.0, Ca+2, -1.0, H+, 1.0, HCO3-) @mineral(Celestite[s]) @logKreaction(Celestite[s], "-1 * (-6.6319)", 1.0, Sr+2, 1.0, SO4-2) @mineral(Dolomite[dis][s]) @logKreaction(Dolomite[dis][s], "-1 * (4.1180)", 1.0, Ca+2, 1.0, Mg+2, -2.0, H+, 2.0, HCO3-) @mineral(Dolomite[ord][s]) @logKreaction(Dolomite[ord][s], "-1 * (3.5680)", 1.0, Ca+2, 1.0, Mg+2, -2.0, H+, 2.0, HCO3-) @mineral(Fe[cr][s]) @logKreaction(Fe[cr][s], "-1 * (13.8226)", 1.0, Fe+2, 2.0, e-) @mineral(Fluorite[s]) @logKreaction(Fluorite[s], "-1 * (-10.5997)", 1.0, Ca+2, 2.0, F-) @mineral(Goethite[s]) @logKreaction(Goethite[s], "-1 * (-1.0000)", 2.0, H2O, -3.0, H+, 1.0, Fe+3) @mineral(Graphite[s]) @logKreaction(Graphite[s], "-1 * (-21.8192)", 1.0, HCO3-, 5.0, H+, 4.0, e-, -3.0, H2O) @mineral(Gypsum[s]) @logKreaction(Gypsum[s], "-1 * (-4.5809)", 1.0, Ca+2, 1.0, SO4-2, 2.0, H2O) @mineral(Hausmannite[s]) @logKreaction(Hausmannite[s], "-1 * (61.0300)", 3.0, Mn+2, 4.0, H2O, -8.0, H+, -2.0, e-) @mineral(Manganite[s]) @logKreaction(Manganite[s], "-1 * (25.3400)", 1.0, Mn+2, 2.0, H2O, -3.0, H+, -1.0, e-) @mineral(Melanterite[s]) @logKreaction(Melanterite[s], "-1 * (-2.2093)", 1.0, Fe+2, 1.0, SO4-2, 7.0, H2O) @mineral(Mo[cr][s]) @logKreaction(Mo[cr][s], "-1 * (19.6670)", 1.0, MoO4-2, 8.0, H+, 6.0, e-, -4.0, H2O) @mineral(Tugarinovite[s]) @logKreaction(Tugarinovite[s], "-1 * (29.9560)", 1.0, MoO4-2, 4.0, H+, 2.0, e-, -2.0, H2O) @mineral(Molybdite[s]) @logKreaction(Molybdite[s], "-1 * (12.0550)", 1.0, MoO4-2, 2.0, H+, -1.0, H2O) @mineral(Nb2O5[cr][s]) @logKreaction(Nb2O5[cr][s], "-1 * (24.3410)", 2.0, NbO3-, 2.0, H+, -1.0, H2O) @mineral(NbO2[cr][s]) @logKreaction(NbO2[cr][s], "-1 * (7.9780)", 1.0, NbO3-, 2.0, H+, 1.0, e-, -1.0, H2O) @mineral(Portlandite[s]) @logKreaction(Portlandite[s], "-1 * (22.8000)", 1.0, Ca+2, 2.0, H2O, -2.0, H+) @mineral(Pyrochroite[s]) @logKreaction(Pyrochroite[s], "-1 * (15.2000)", 1.0, Mn+2, 2.0, H2O, -2.0, H+) @mineral(Pyrolusite[s]) @logKreaction(Pyrolusite[s], "-1 * (41.3800)", 1.0, Mn+2, 2.0, H2O, -4.0, H+, -2.0, e-) @mineral(Rhodochrosite[s]) @logKreaction(Rhodochrosite[s], "-1 * (-0.8011)", 1.0, Mn+2, 1.0, HCO3-, -1.0, H+) @mineral(Rhodochrosite[syn][s]) @logKreaction(Rhodochrosite[syn][s], "-1 * (-0.0611)", 1.0, Mn+2, 1.0, HCO3-, -1.0, H+) @mineral(Siderite[s]) @logKreaction(Siderite[s], "-1 * (-0.5612)", 1.0, Fe+2, 1.0, HCO3-, -1.0, H+) @mineral(FeCO3[pr][s]) @logKreaction(FeCO3[pr][s], "-1 * (-0.1211)", 1.0, Fe+2, 1.0, HCO3-, -1.0, H+) @mineral(Strontianite[s]) @logKreaction(Strontianite[s], "-1 * (1.0583)", 1.0, Sr+2, -1.0, H+, 1.0, HCO3-) @mineral(Witherite[s]) @logKreaction(Witherite[s], "-1 * (1.7672)", 1.0, Ba+2, -1.0, H+, 1.0, HCO3-) @mineral(Hematite[s]) @logKreaction(Hematite[s], "-1 * (1.1200)", 3.0, H2O, -6.0, H+, 2.0, Fe+3) @mineral(Pyrite[s]) @logKreaction(Pyrite[s], "-1 * (-18.5000)", 1.0, Fe+2, 2.0, HS-, -2.0, H+, -2.0, e-) @mineral(Troilite[s]) @logKreaction(Troilite[s], "-1 * (-5.3100)", 1.0, Fe+2, 1.0, HS-, -1.0, H+) @mineral(Magnesite[s]) @logKreaction(Magnesite[s], "-1 * (2.0410)", 1.0, Mg+2, -1.0, H+, 1.0, HCO3-) @mineral(S[rhomb][s]) @logKreaction(S[rhomb][s], "-1 * (-2.1440)", 1.0, HS-, -1.0, H+, -2.0, e-) @mineral(Fe[OH]3[am][s]) @logKreaction(Fe[OH]3[am][s], "-1 * (5.0000)", 3.0, H2O, -3.0, H+, 1.0, Fe+3) @mineral(Fe[OH]3[mic][s]) @logKreaction(Fe[OH]3[mic][s], "-1 * (3.0000)", 3.0, H2O, -3.0, H+, 1.0, Fe+3) @mineral(Magnetite[s]) @logKreaction(Magnetite[s], "-1 * (10.0200)", 1.0, Fe+2, 4.0, H2O, -8.0, H+, 2.0, Fe+3) @mineral(Gibbsite[s]) @logKreaction(Gibbsite[s], "-1 * (7.7559)", 1.0, Al+3, 3.0, H2O, -3.0, H+) @mineral(Quartz[s]) @logKreaction(Quartz[s], "-1 * (-3.7460)", 1.0, Si[OH]4, -2.0, H2O) @mineral(SiO2[am][s]) @logKreaction(SiO2[am][s], "-1 * (-2.7140)", 1.0, Si[OH]4, -2.0, H2O) @mineral(Kaolinite[s]) @logKreaction(Kaolinite[s], "-1 * (7.4350)", 2.0, Al+3, 2.0, Si[OH]4, 1.0, H2O, -6.0, H+) @mineral(NiCO3[cr][s]) @logKreaction(NiCO3[cr][s], "-1 * (-11.0000)", 1.0, Ni+2, 1.0, CO3-2) @mineral(Ni[OH]2[cr_[s]) @logKreaction(Ni[OH]2[cr_[s], "-1 * (11.0200)", 1.0, Ni+2, 2.0, H2O, -2.0, H+) @mineral(NiO[cr][s]) @logKreaction(NiO[cr][s], "-1 * (12.4800)", 1.0, Ni+2, 1.0, H2O, -2.0, H+) @mineral(NiCO3:5_5H2O[s][s]) @logKreaction(NiCO3:5_5H2O[s][s], "-1 * (-7.5300)", 1.0, Ni+2, 1.0, CO3-2, 5.5, H2O) @mineral(Ni3[AsO4]2:8H2O[s][s]) @logKreaction(Ni3[AsO4]2:8H2O[s][s], "-1 * (-28.1000)", 3.0, Ni+2, 2.0, AsO4-3, 8.0, H2O) @mineral(MnSe[s][s]) @logKreaction(MnSe[s][s], "-1 * (-16.0000)", 1.0, Mn+2, 1.0, Se-2) @mineral(Se[cr][s]) @logKreaction(Se[cr][s], "-1 * (-61.1500)", 1.0, SeO3-2, 6.0, H+, 4.0, e-, -3.0, H2O) @mineral(NiSeO3:2H2O[cr][s]) @logKreaction(NiSeO3:2H2O[cr][s], "-1 * (-5.8000)", 1.0, Ni+2, 1.0, SeO3-2, 2.0, H2O) @mineral(MnSeO3:2H2O[cr][s]) @logKreaction(MnSeO3:2H2O[cr][s], "-1 * (-7.6000)", 1.0, Mn+2, 1.0, SeO3-2, 2.0, H2O) @mineral(MgSeO3:6H2O[cr][s]) @logKreaction(MgSeO3:6H2O[cr][s], "-1 * (-5.8200)", 1.0, Mg+2, 1.0, SeO3-2, 6.0, H2O) @mineral(CaSeO3:H2O[cr][s]) @logKreaction(CaSeO3:H2O[cr][s], "-1 * (-6.4000)", 1.0, Ca+2, 1.0, SeO3-2, 1.0, H2O) @mineral(SrSeO3[cr][s]) @logKreaction(SrSeO3[cr][s], "-1 * (-6.3000)", 1.0, Sr+2, 1.0, SeO3-2) @mineral(BaSeO3[cr][s]) @logKreaction(BaSeO3[cr][s], "-1 * (-6.5000)", 1.0, Ba+2, 1.0, SeO3-2) @mineral(BaSeO4[cr][s]) @logKreaction(BaSeO4[cr][s], "-1 * (-7.5600)", 1.0, Ba+2, 1.0, SeO4-2) @mineral(Baddeleyite[s]) @logKreaction(Baddeleyite[s], "-1 * (-7.0000)", 1.0, Zr+4, 2.0, H2O, -4.0, H+) @mineral(Zr[OH]4[am_fr][s]) @logKreaction(Zr[OH]4[am_fr][s], "-1 * (-3.2400)", 1.0, Zr+4, 4.0, H2O, -4.0, H+) @mineral(Zr[HPO4]2:H2O[cr][s]) @logKreaction(Zr[HPO4]2:H2O[cr][s], "-1 * (-22.8000)", 1.0, Zr+4, 2.0, H3PO4, 1.0, H2O, -4.0, H+) @mineral(TcO2:1_6H2O[s][s]) @logKreaction(TcO2:1_6H2O[s][s], "-1 * (-8.4000)", 1.0, TcO[OH]2, 0.6, H2O) @mineral(Pd[cr][s]) @logKreaction(Pd[cr][s], "-1 * (-30.8000)", 1.0, Pd+2, 2.0, e-) @mineral(Pd[OH]2[s][s]) @logKreaction(Pd[OH]2[s][s], "-1 * (-3.3000)", 1.0, Pd+2, -2.0, H+, 2.0, H2O) @mineral(Tn[cr][s]) @logKreaction(Tn[cr][s], "-1 * (4.6300)", 1.0, Tn+2, 2.0, e-) @mineral(TnO[s][s]) @logKreaction(TnO[s][s], "-1 * (2.5000)", 1.0, Tn+2, 1.0, H2O, -2.0, H+) @mineral(TnS[pr][s]) @logKreaction(TnS[pr][s], "-1 * (-14.7000)", 1.0, Tn+2, 1.0, HS-, -1.0, H+) @mineral(Cassiterite[s]) @logKreaction(Cassiterite[s], "-1 * (-8.0000)", 1.0, Sn[OH]4, -2.0, H2O) @mineral(SnO2[am][s]) @logKreaction(SnO2[am][s], "-1 * (-7.3000)", 1.0, Sn[OH]4, -2.0, H2O) @mineral(CaSn[OH]6[s][s]) @logKreaction(CaSn[OH]6[s][s], "-1 * (8.7000)", 1.0, Sn[OH]4, 2.0, H2O, 1.0, Ca+2, -2.0, H+) @mineral(RaCO3[cr][s]) @logKreaction(RaCO3[cr][s], "-1 * (-8.3000)", 1.0, Ra+2, 1.0, CO3-2) @mineral(RaSO4[cr][s]) @logKreaction(RaSO4[cr][s], "-1 * (-10.2600)", 1.0, Ra+2, 1.0, SO4-2) @mineral(Eu[OH]3[cr][s]) @logKreaction(Eu[OH]3[cr][s], "-1 * (14.9000)", 1.0, Eu+3, 3.0, H2O, -3.0, H+) @mineral(Eu[OH]3[am][s]) @logKreaction(Eu[OH]3[am][s], "-1 * (17.6000)", 1.0, Eu+3, 3.0, H2O, -3.0, H+) @mineral(Eu2[CO3]3[cr][s]) @logKreaction(Eu2[CO3]3[cr][s], "-1 * (-35.0000)", 2.0, Eu+3, 3.0, CO3-2) @mineral(EuOHCO3[cr][s]) @logKreaction(EuOHCO3[cr][s], "-1 * (-21.7000)", 1.0, Eu+3, 1.0, OH-, 1.0, CO3-2) @mineral(EuF3[cr][s]) @logKreaction(EuF3[cr][s], "-1 * (-17.4000)", 1.0, Eu+3, 3.0, F-) @mineral(ThO2[am_hyd_fr][s]) @logKreaction(ThO2[am_hyd_fr][s], "-1 * (9.3000)", 1.0, Th+4, 2.0, H2O, -4.0, H+) @mineral(ThO2[am_hyd_ag][s]) @logKreaction(ThO2[am_hyd_ag][s], "-1 * (8.5000)", 1.0, Th+4, 2.0, H2O, -4.0, H+) @mineral(ThF4[cr_hyd][s]) @logKreaction(ThF4[cr_hyd][s], "-1 * (-31.8000)", 1.0, Th+4, 4.0, F-) @mineral(Na6Th[CO3]5:12H2O[cr][s]) @logKreaction(Na6Th[CO3]5:12H2O[cr][s], "-1 * (-42.2000)", 6.0, Na+, 1.0, Th+4, 5.0, CO3-2, 12.0, H2O) @mineral(Th3[PO4]4[s][s]) @logKreaction(Th3[PO4]4[s][s], "-1 * (-112.0000)", 3.0, Th+4, 4.0, PO4-3) @mineral(UF4:2_5H2O[cr][s]) @logKreaction(UF4:2_5H2O[cr][s], "-1 * (-30.1200)", 1.0, U+4, 4.0, F-, 2.5, H2O) @mineral(U[OH]2SO4[cr][s]) @logKreaction(U[OH]2SO4[cr][s], "-1 * (-3.1700)", 1.0, U+4, 1.0, SO4-2, 2.0, H2O, -2.0, H+) @mineral(UO2[am_hyd][s]) @logKreaction(UO2[am_hyd][s], "-1 * (1.5000)", 1.0, U+4, 2.0, H2O, -4.0, H+) @mineral(USiO4[s][s]) @logKreaction(USiO4[s][s], "-1 * (-1.5000)", 1.0, U+4, 1.0, Si[OH]4, -4.0, H+) @mineral(Rutherfordine[s]) @logKreaction(Rutherfordine[s], "-1 * (-14.7600)", 1.0, UO2+2, 1.0, CO3-2) @mineral(Chernikovite[s]) @logKreaction(Chernikovite[s], "-1 * (-2.5000)", 1.0, UO2+2, 1.0, H3PO4, 4.0, H2O, -2.0, H+) @mineral([UO2]3[PO4]2:4H2O[cr][s]) @logKreaction([UO2]3[PO4]2:4H2O[cr][s], "-1 * (-5.9600)", 3.0, UO2+2, 2.0, H3PO4, 4.0, H2O, -6.0, H+) @mineral(Metaschoepite[s]) @logKreaction(Metaschoepite[s], "-1 * (5.9600)", 1.0, UO2+2, 3.0, H2O, -2.0, H+) @mineral(Becquerelite[s]) @logKreaction(Becquerelite[s], "-1 * (40.5000)", 1.0, Ca+2, 6.0, UO2+2, 18.0, H2O, -14.0, H+) @mineral(Compreignacite[s]) @logKreaction(Compreignacite[s], "-1 * (37.1000)", 2.0, K+, 6.0, UO2+2, 18.0, H2O, -14.0, H+) @mineral(Soddyite[s]) @logKreaction(Soddyite[s], "-1 * (6.2000)", 2.0, UO2+2, 1.0, Si[OH]4, 2.0, H2O, -4.0, H+) @mineral(Uranophane[s]) @logKreaction(Uranophane[s], "-1 * (9.4000)", 1.0, Ca+2, 2.0, UO2+2, 2.0, Si[OH]4, 5.0, H2O, -6.0, H+) @mineral(Na-Boltwoodite[s]) @logKreaction(Na-Boltwoodite[s], "-1 * (5.8000)", 1.0, Na+, 1.0, UO2+2, 1.0, Si[OH]4, 2.0, H2O, -3.0, H+) @mineral(Na-Weeksite[s]) @logKreaction(Na-Weeksite[s], "-1 * (1.5000)", 2.0, Na+, 2.0, UO2+2, 6.0, Si[OH]4, -6.0, H+, -5.0, H2O) @mineral(NpO2[am_hyd][s]) @logKreaction(NpO2[am_hyd][s], "-1 * (-0.7000)", 1.0, Np+4, 2.0, H2O, -4.0, H+) @mineral(NpO2OH[am_fr][s]) @logKreaction(NpO2OH[am_fr][s], "-1 * (5.3000)", 1.0, NpO2+, 1.0, H2O, -1.0, H+) @mineral(NaNpO2CO3:3_5H2O[cr][s]) @logKreaction(NaNpO2CO3:3_5H2O[cr][s], "-1 * (-11.0000)", 1.0, Na+, 1.0, NpO2+, 1.0, CO3-2, 3.5, H2O) @mineral(Na3NpO2[CO3]2[cr][s]) @logKreaction(Na3NpO2[CO3]2[cr][s], "-1 * (-14.2200)", 3.0, Na+, 1.0, NpO2+, 2.0, CO3-2) @mineral(KNpO2CO3[s][s]) @logKreaction(KNpO2CO3[s][s], "-1 * (-13.1500)", 1.0, K+, 1.0, NpO2+, 1.0, CO3-2) @mineral(K3NpO2[CO3]2[s][s]) @logKreaction(K3NpO2[CO3]2[s][s], "-1 * (-15.4600)", 3.0, K+, 1.0, NpO2+, 2.0, CO3-2) @mineral(NpO2OH[am_ag][s]) @logKreaction(NpO2OH[am_ag][s], "-1 * (4.7000)", 1.0, NpO2+, 1.0, H2O, -1.0, H+) @mineral(NpO2CO3[s][s]) @logKreaction(NpO2CO3[s][s], "-1 * (-14.6000)", 1.0, NpO2+2, 1.0, CO3-2) @mineral(NpO3:H2O[cr][s]) @logKreaction(NpO3:H2O[cr][s], "-1 * (5.4700)", 1.0, NpO2+2, 2.0, H2O, -2.0, H+) @mineral(K4NpO2[CO3]3[s][s]) @logKreaction(K4NpO2[CO3]3[s][s], "-1 * (-26.4000)", 4.0, K+, 1.0, NpO2+2, 3.0, CO3-2) @mineral([NH4]4NpO2[CO3]3[s][s]) @logKreaction([NH4]4NpO2[CO3]3[s][s], "-1 * (-26.8100)", 4.0, NH4+, 1.0, NpO2+2, 3.0, CO3-2) @mineral(Pu[OH]3[cr][s]) @logKreaction(Pu[OH]3[cr][s], "-1 * (15.8000)", 1.0, Pu+3, 3.0, H2O, -3.0, H+) @mineral(PuPO4[s_hyd][s]) @logKreaction(PuPO4[s_hyd][s], "-1 * (-24.6000)", 1.0, Pu+3, 1.0, PO4-3) @mineral(Pu[HPO4]2[am_hyd][s]) @logKreaction(Pu[HPO4]2[am_hyd][s], "-1 * (-30.4500)", 1.0, Pu+4, 2.0, HPO4-2) @mineral(PuO2[hyd_ag][s]) @logKreaction(PuO2[hyd_ag][s], "-1 * (-2.3300)", 1.0, Pu+4, 2.0, H2O, -4.0, H+) @mineral(PuO2OH[am][s]) @logKreaction(PuO2OH[am][s], "-1 * (5.0000)", 1.0, PuO2+, 1.0, H2O, -1.0, H+) @mineral(PuO2[OH]2:H2O[cr][s]) @logKreaction(PuO2[OH]2:H2O[cr][s], "-1 * (5.5000)", 1.0, PuO2+2, 3.0, H2O, -2.0, H+) @mineral(PuO2CO3[s][s]) @logKreaction(PuO2CO3[s][s], "-1 * (-14.6500)", 1.0, PuO2+2, 1.0, CO3-2) @mineral(Am[OH]3[cr][s]) @logKreaction(Am[OH]3[cr][s], "-1 * (15.6000)", 1.0, Am+3, 3.0, H2O, -3.0, H+) @mineral(Am[OH]3[am][s]) @logKreaction(Am[OH]3[am][s], "-1 * (16.9000)", 1.0, Am+3, 3.0, H2O, -3.0, H+) @mineral(Am[CO3]1_5[am_hyd][s]) @logKreaction(Am[CO3]1_5[am_hyd][s], "-1 * (-16.7000)", 1.0, Am+3, 1.5, CO3-2) @mineral(AmOHCO3:0_5H2O[cr][s]) @logKreaction(AmOHCO3:0_5H2O[cr][s], "-1 * (-22.4000)", 1.0, Am+3, 1.0, OH-, 1.0, CO3-2, 0.5, H2O) @mineral(AmOHCO3[am_hyd][s]) @logKreaction(AmOHCO3[am_hyd][s], "-1 * (-20.2000)", 1.0, Am+3, 1.0, OH-, 1.0, CO3-2) @mineral(NaAm[CO3]2:5H2O[cr][s]) @logKreaction(NaAm[CO3]2:5H2O[cr][s], "-1 * (-21.0000)", 1.0, Na+, 1.0, Am+3, 2.0, CO3-2, 5.0, H2O) @mineral(AmO2OH[am][s]) @logKreaction(AmO2OH[am][s], "-1 * (5.3000)", 1.0, AmO2+, 1.0, H2O, -1.0, H+) @mineral(NaAmO2CO3[s][s]) @logKreaction(NaAmO2CO3[s][s], "-1 * (-10.9000)", 1.0, Na+, 1.0, AmO2+, 1.0, CO3-2) @mineral(Cm[OH]3[am_coll][s]) @logKreaction(Cm[OH]3[am_coll][s], "-1 * (17.2000)", 1.0, Cm+3, 3.0, H2O, -3.0, H+) @gas(CH4[g]) @logKreaction(CH4[g], "-1 * (-2.8565)", 1.0, CH4) @gas(CO2[g]) @logKreaction(CO2[g], "-1 * (-7.8198)", 1.0, H+, -1.0, H2O, 1.0, HCO3-) @gas(H2[g]) @logKreaction(H2[g], "-1 * (-3.1056)", 1.0, H2) @gas(N2[g]) @logKreaction(N2[g], "-1 * (-3.1864)", 1.0, N2) @gas(O2[g]) @logKreaction(O2[g], "-1 * (-2.8944)", 1.0, O2) @gas(H2S[g]) @logKreaction(H2S[g], "-1 * (-8.0100)", 1.0, HS-, 1.0, H+) @gas(H2Se[g]) @logKreaction(H2Se[g], "-1 * (-1.1000)", 1.0, H2Se)