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thermo_data.json
116 lines (116 loc) · 1.88 KB
/
thermo_data.json
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{
"Fe110": {
"dG0": 0.0,
"area": 1,
"ne": 0,
"nH": 0
},
"1/6 H": {
"dG0": -0.3285875,
"area": 6,
"ne": -1,
"nH": -1
},
"1/6 O": {
"dG0": -0.677456,
"area": 6,
"ne": 2,
"nH": 2
},
"1/6 OH": {
"dG0": -0.3147715,
"area": 6,
"ne": 1,
"nH": 1
},
"1/3 H": {
"dG0": -0.667089,
"area": 6,
"ne": -2,
"nH": -2
},
"1/3 O": {
"dG0": -1.179919,
"area": 6,
"ne": 4,
"nH": 4
},
"1/3 OH": {
"dG0": -0.497908,
"area": 6,
"ne": 2,
"nH": 2
},
"1/4 H": {
"dG0": -0.5966945,
"area": 4,
"ne": -1,
"nH": -1
},
"1/4 O": {
"dG0": -0.990489,
"area": 4,
"ne": 2,
"nH": 2
},
"1/4 OH": {
"dG0": -0.5914255,
"area": 4,
"ne": 1,
"nH": 1
},
"1/2 H": {
"dG0": -0.968731,
"area": 4,
"ne": -1,
"nH": -1
},
"1/2 O": {
"dG0": -0.930725,
"area": 4,
"ne": 2,
"nH": 2
},
"1/2 OH": {
"dG0": -0.479579,
"area": 4,
"ne": 1,
"nH": 1
},
"1 H": {
"dG0": -0.2765325,
"area": 1,
"ne": -1,
"nH": -1
},
"1 O": {
"dG0": 0.523481,
"area": 1,
"ne": 2,
"nH": 2
},
"1 OH": {
"dG0": 0.5490935,
"area": 1,
"ne": 1,
"nH": 1
},
"1/4 OH 1/4 H": {
"dG0": -0.791119,
"area": 4,
"ne": 0,
"nH": 0
},
"1/2 OH 1/2 H": {
"dG0": -0.280579,
"area": 4,
"ne": 0,
"nH": 0
},
"Fe++": {
"dG0": -0.894,
"area": 1,
"ne": 2,
"nH": 0
}
}