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git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@9639 1feff8c3-07ed-0310-ac33-dd36852eb9cd
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David L Parkhurst 2015-05-12 16:00:41 +00:00
parent d9970213ab
commit 28056e8da6
1 changed files with 11 additions and 12 deletions
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@ -1,10 +1,9 @@
# PHREEQC database
# Base de Donnee ANDRA - THERMO_CHIMIE
# Thermodynamic database ANDRA – THERMOCHIMIE (www.thermochimie-tdb.com)
# Version 9a
# Nom : Groupement de laboratoires ThermoChimie
# BDD Date : 7/28/2014
# Crée le 7/28/2014
# Remarque : no comment
# Nom: ThermoChimie project
# BDD Date: 7/28/2014
# Comment: no comment
NAMED_EXPRESSIONS
@ -72,7 +71,7 @@ H(0) H2 0 H 1.0079
Hf Hf+4 -4 Hf 178.49
Hg Hg+2 0 Hg 200.59
Hg(+2) Hg+2 0 Hg 200.59
Hg(+1) Hg2+2 0 Hg2 401.18
Hg(+1) Hg+ 0 Hg 200.59
Ho Ho+3 0 Ho 164.9303
I I- 0 I 126.9045
I(+5) IO3- 0 I 126.9045
@ -321,7 +320,7 @@ HfF2+2 ClO4- 0.47
HfNO3+3 ClO4- 0.91
Hg(SeO3)2-2 Na+ 0.008
Hg+2 Cl- 0.168
Hg2+2 Cl- 0.054
Hg+ Cl- 0.054
Ho(CO3)+ Cl- 0.129
Ho(CO3)+ ClO4- 0.17
Ho(CO3)2- Na+ -0.14
@ -1187,11 +1186,11 @@ SOLUTION_SPECIES
# Enthalpy of formation: 14.3 #kJ/mol #05OLI/NOL
-analytic 1.35922E+1 0E+0 -3.10023E+4 0E+0 0E+0
2.000Hg+2 + 1.000H2O - 2.000H+ - 0.500O2 = Hg2+2
log_k -12.200
delta_h 106.213 #kJ/mol
1.000Hg+2 + 0.500H2O - 1.000H+ - 0.2500O2 = Hg+
log_k -6.100
delta_h 53.107 #kJ/mol
# Enthalpy of formation: 166.87 #kJ/mol #01LEM/FUG
-analytic 6.40769E+0 0E+0 -5.54788E+3 0E+0 0E+0
-analytic -6.09069E+0 0E+0 2.77396E+0 0E+0 0E+0
1.000I- + 1.500O2 = IO3-
log_k 17.410 #92GRE/FUG
@ -11655,7 +11654,7 @@ HfO2 = - 4.000H+ + 1.000Hf+4 + 2.000H2O
-analytic -5.6E+0 0E+0 0E+0 0E+0 0E+0
Hg2SeO3(s)
Hg2SeO3 = 1.000SeO3-2 + 1.000Hg2+2
Hg2SeO3 = 1.000SeO3-2 + 2.000Hg+
log_k -15.200 #05OLI/NOL
# delta_h 0.000 #kJ/mol
# Enthalpy of formation: #kJ/mol