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Ellingham Diagrams Stanley M. Howard, SD School of Mines and Technology
Standard Gibb's Energies of Formation for Bromides Chlorides Fluorides Hydrides Iodides Nitrides Oxides Sulfides Selenides Tellurides
The figures include nomographs for equilibrium partial pressures.
Data sources: 1) Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971. 2) D. R. Stull and H. Prophet, JANAF Thermochemical Tables, NSRDS-NBS 37, U.S. Dept of Commerce, National Bureau of Standards, 1971
This is an Internet Resource for MET 320 - Metallurgical Thermodynamics.
Disclaimer: These diagrams are provided for educational purposes only and should not be relied on for design or analysis. There may be errors in some data. The user assumes all liability associated with the use of the diagrams.
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
23
2
3
23
2
2
1
Ellingham Diagram for User-Selected Oxides © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Com-pounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pO2
pO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3 10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
1012
1013101410151016101710181019102010221024102610281030104010501060
pCO/pCO2
pCO/pCO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3
10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
10121013101410151016101710181019102010221024102610281030104010501060
pH2/pH2O
pH2/pH2O
C X
H X
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
23
23
2
2
1
Ellingham Diagram for User-Selected Oxides © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Com-pounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pO2
pO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3 10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
1012
1013101410151016101710181019102010221024102610281030104010501060
pCO/pCO2
pCO/pCO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3
10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
10121013101410151016101710181019102010221024102610281030104010501060
pH2/pH2O
pH2/pH2O
C X
H X
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
3 4
5
2
34
5
2
3
4
23
4
52
2 3
4
2
3
4
2
3
23
42
3
23 4
2
2
1
Ellingham Diagram for Selected Bromides: Part-1 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Com-pounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pBr2
pBr2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
23
42
3
4
2
3 4
23
4
2
3
4
2
3
4
23
23
4
5
Ellingham Diagram for Selected Chlorides: Part-1 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Com-pounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pCl2
pCl2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
3
4
5
2
3
4
5
2 3
4
23 4
2 3
4
52
3 4
2
323
4
2 34
5
23
1
Ellingham Diagram for Selected Chlorides: Part-2 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Com-pounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pCl2
pCl2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
34
5
23
4
5
2 3
4
5
2
32 3
4
2
3 4
2
2 3
2
23
4
Ellingham Diagram for Selected Chlorides: Part-3 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Com-pounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pCl2
pCl2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
3 4
5
2
2
3
4
5
2
3
4
2
3
23
4
5
1
2 3
Ellingham Diagram for Selected Chlorides: Part-4 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Com-pounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pCl2
pCl2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
3
45
2
3 4
2
3
232 3
4
5
23
2 3
Ellingham Diagram for Selected Chlorides: Part-5 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Com-pounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pCl2
pCl2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
34
5
2
3
4
5
2
3
45
2
3
4 52
3
4
23 42
3
Ellingham Diagram for Selected Chlorides: Part-6 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Com-pounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pCl2
pCl2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
3
4
22
3
2
3
4
5
2
3
4
5
2
2
3
4
2
3
23
2
34
23
Ellingham Diagram for Selected Fluorides: Part-1 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Com-pounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pF2
pF2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
3
2 3
4
2
3
4
2
3
2
3
2
2
3
4
23
2
342
3
Ellingham Diagram for Selected Fluorides: Part-2 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Com-pounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pF2
pF2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
3
4
2
3
4
2
3 4 22
3
2
2
2 3
4
5
2
2
34
Ellingham Diagram for Selected Fluorides: Part-3 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Com-pounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pF2
pF2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
3 4
2
3
4
5
2
34
2
22
3
42
2
3
23
2
3
4
23
4
Ellingham Diagram for Selected Fluorides: Part-4 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Com-pounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pF2
pF2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
34
2
3
4
5
2
3
2
3 4
2
3
2
32
3
2
3 4
5
2
34
1
Ellingham Diagram for Selected Fluorides: Part-5 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Com-pounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pF2
pF2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
3
Ellingham Diagram for User-Selected Oxides © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Com-pounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pO2
pO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3 10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
1012
1013101410151016101710181019102010221024102610281030104010501060
pCO/pCO2
pCO/pCO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3
10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
10121013101410151016101710181019102010221024102610281030104010501060
pH2/pH2O
pH2/pH2O
C X
H X
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 24000
10
20
30
40
50
60
70
80
90
100
2
1
2
Ellingham Diagram for User-Selected Hydrides © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
101
102
103
104
105
106
107
108
109101010111012101310141015101610171018101910201022102410261028103010351040105010100
pH2
pH2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
2
3
Ellingham Diagram for User-Selected Oxides © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Com-pounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pO2
pO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3 10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
1012
1013101410151016101710181019102010221024102610281030104010501060
pCO/pCO2
pCO/pCO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3
10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
10121013101410151016101710181019102010221024102610281030104010501060
pH2/pH2O
pH2/pH2O
C X
H X
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
3
2
1
Ellingham Diagram for Selected Hydrides: Part-1 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pH2
pH2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
1
22
3
1
Ellingham Diagram for Selected Hydrides: Part-2 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pH2
pH2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
1
2
2
3
21
Ellingham Diagram for Selected Hydrides: Part-3 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pH2
pH2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 24000
10
20
30
40
50
60
70
80
90
100
2
2
2
Ellingham Diagram for Selected Hydrides: Part-4 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
101
102
103
104
105
106
107
108
109101010111012101310141015101610171018101910201022102410261028103010351040105010100
pH2
pH2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 24000
10
20
30
40
50
60
70
80
90
100
2
2
2
Ellingham Diagram for Selected Hydrides: Part-5 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
101
102
103
104
105
106
107
108
109101010111012101310141015101610171018101910201022102410261028103010351040105010100
pH2
pH2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
3
4
5
2
23
4234
1
Ellingham Diagram for Selected Iodides: Part-1 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pI2
pI2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
3
4
5
2
3
4
2
32
3
2
3
Ellingham Diagram for Selected Iodides: Part-2 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pI2
pI2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
2
22
2
Ellingham Diagram for Selected Nitrides: Part-1 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pN2
pN2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
2
3
4
2
3
Ellingham Diagram for Selected Nitrides: Part-2 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pN2
pN2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
22
2
2
2
3
4
2
3
23
4
52
3 4
2
42
Ellingham Diagram for Selected Oxides: Part-1 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pO2
pO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3 10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
1012
1013101410151016101710181019102010221024102610281030104010501060
pCO/pCO2
pCO/pCO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3
10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
10121013101410151016101710181019102010221024102610281030104010501060
pH2/pH2O
pH2/pH2O
C X
H X
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
22
2
2
3
4
2
2
2
2
3
4
2
3
2
2
3
2
3
2
3
Ellingham Diagram for Selected Oxides: Part-2 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pO2
pO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3 10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
1012
1013101410151016101710181019102010221024102610281030104010501060
pCO/pCO2
pCO/pCO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3
10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
10121013101410151016101710181019102010221024102610281030104010501060
pH2/pH2O
pH2/pH2O
C X
H X
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
3
2
2
3
4
2
2
23
35
45
3
4
2
3
4 5
23
2
3
2 3
4
5
23
4
Ellingham Diagram for Selected Oxides: Part-3 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pO2
pO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3 10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
1012
1013101410151016101710181019102010221024102610281030104010501060
pCO/pCO2
pCO/pCO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3
10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
10121013101410151016101710181019102010221024102610281030104010501060
pH2/pH2O
pH2/pH2O
C X
H X
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
2
3
2
3
2
2
33
23
2
1
2
2
31 2
Ellingham Diagram for Selected Oxides: Part-4 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pO2
pO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3 10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
1012
1013101410151016101710181019102010221024102610281030104010501060
pCO/pCO2
pCO/pCO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3
10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
10121013101410151016101710181019102010221024102610281030104010501060
pH2/pH2O
pH2/pH2O
C X
H X
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
2
2
2
3
2
3
2
2
3 4
2
3
2
2
3
2
3
4
5
2
3
4
Ellingham Diagram for Selected Oxides: Part-5 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pO2
pO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3 10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
1012
1013101410151016101710181019102010221024102610281030104010501060
pCO/pCO2
pCO/pCO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3
10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
10121013101410151016101710181019102010221024102610281030104010501060
pH2/pH2O
pH2/pH2O
C X
H X
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
2
2
34
5
2
Ellingham Diagram for Selected Oxides: Part-6 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pO2
pO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3 10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
1012
1013101410151016101710181019102010221024102610281030104010501060
pCO/pCO2
pCO/pCO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3
10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
10121013101410151016101710181019102010221024102610281030104010501060
pH2/pH2O
pH2/pH2O
C X
H X
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
2
23
2
3
2
34
5
2
3
4
Ellingham Diagram for Selected Oxides: Part-7 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pO2
pO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3 10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
1012
1013101410151016101710181019102010221024102610281030104010501060
pCO/pCO2
pCO/pCO2
10-40 10-30 10-2010-18 10-16 10-14 10-12 10-10 10-9 10-8 10-7 10-6 10-5 10-4 10-3
10-2
10-1
100
101
102
103
104
105
106
107
108
109
1010
1011
10121013101410151016101710181019102010221024102610281030104010501060
pH2/pH2O
pH2/pH2O
C X
H X
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
2
3
2
3
4
1
1
Ellingham Diagram for Selected Sulfides: Part-1 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pS2
pS2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
3
2
3
23
Ellingham Diagram for Selected Sulfides: Part-2 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pS2
pS2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
34
2
3
23
4
2
Ellingham Diagram for Selected Sulfides: Part-3 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pS2
pS2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2
3
4
2
3
2 3
2
3
4
23
Ellingham Diagram for Selected Sulfides: Part-4 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Compounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pS2
pS2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
12
3
4
5
6
12 3
4
5
6
2 3
1 2 3
45
1 2 3
4
5
6
1 23
4
5
6
12 3
4
23
423
Ellingham Diagram for Selected Selenides: Part-1 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Com-pounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pSe2
pSe2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
12
34
5
12
3
4
5
6
1 2 3
4 5
62
3
234 5
1 23 4
Ellingham Diagram for Selected Tellurides: Part-1 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Com-pounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pTe2
pTe2
0 200 400 600 800 1000 1200 1400 1600 1800 2000 2200 2400-300
-280
-260
-240
-220
-200
-180
-160
-140
-120
-100
-80
-60
-40
-20
0
2 3
4
5
6
23
4
1 23
45
6
1 2
3 4561 2 3
45
Ellingham Diagram for Selected Tellurides: Part-2 © 2006 Stanley. M. Howard
Data from Thomas B. Reed, Free Energy of Formation of Binary Com-pounds, MIT Press, Cambridge, MA, 1971.
T, K
, /
DGo
Kcalgfw
m - Element Meltingb - Element BoilingM - Compound MeltingB - Compound Boiling
100
10-2
10-4
10-6
10-8
10-10
10-12
10-14
10-16
10-18
10-20
10-22
10-24
10-26
10-2810-3010-3510-4010-4510-5010-6010-7010-8010-9010-10010-15010-200
pTe2
pTe2
Bromide DataPart-1 Part-2 p
1 H T, K Br T, K0 -25.6 2Br = Br2 0 9.8
1760 -31.2 m 266 1.5333 0.0
2 P T, K0 -30.3
1760 -9.4
3 W T, K0 -34.2
B 582 -13.81220 0.0
4 B T, K0 -42.8
B 364 -37.61760 -25.6
5 Hg T, K0 -48.3
M 514 -29.5B 592 -27.5b 630 -27.4
1760 -1.8
6 Fe T, K0 -65.0
M 964 -38.6B 1207 -35.6
1760 -40.8
7 Pb T, K0 -71.2
m 601 -52.8
DGo , Kcal/mol DGo , Kcal/molH2 + Br2 = 2HBr
DGo , Kcal/mol2/3P + Br2 = 2/3PBr3
DGo , Kcal/mol1/3W + Br2 = 1/3WBr6
DGo , Kcal/mol2/3B + Br2 = 2/3BBr3
DGo , Kcal/molHg + Br2 = HgBr2
DGo , Kcal/molFe + Br2 = FeBr2
DGo , Kcal/molPb + Br2 = PbBr2
RUN
M 640 -51.5B 1187 -38.8
1760 -40.7
8 Ti T, K0 -80.8
M 311 -70.2B 504 -66.6
1760 -46.6
9 Al T, K0 -90.8
M 370 -76.0B 528 -71.2m 932 -64.0
1760 -57.4
10 Be T, K0 -94.0
M 761 -69.6B 794 -69.0m 1556 -72.5
1760 -73.6
11 Zr T, K0 -98.5
B 630 -76.41760 -59.6
12 Mg T, K0 -129.1
m 923 -97.9M 984 -95.6b 1363 -85.8B 1557 -77.0
1760 -71.6
13 Li T, K0 -174.8
m 454 -158.4M 823 -144.3b 1597 -126.2
1611 -125.3
14 Na T, K
DGo , Kcal/mol1/2Ti + Br2 = 1/2TiBr4
DGo , Kcal/mol2/3Al + Br2 = 2/3AlBr3
DGo , Kcal/mol2/3Be + Br2 = 2/3BeBr3
DGo , Kcal/mol1/2Zr + Br2 = 1/2ZrBr4
DGo , Kcal/molMg + Br2 = MgBr2
DGo , Kcal/mol2Li + Br2 = 2LiBr
DGo , Kcal/mol
0 -177.1m 371 -164.6M 1020 -136.2b 1156 -133.5B 1720 -98.1
15 K T, K0 -196.4
m 336 -180.2M 1007 -150.6b 1031 -150.0B 1657 -111.1
16
17
18
19
1 Al T, K0 -90.8
M 370 -76.0B 528 -71.2m 932 -64.0
1760 -57.4
2Na + Br2 = 2NaBr
DGo , Kcal/mol2K + Br2 = 2KBr
DGo , Kcal/mol2/3Al + Br2 = 2/3AlBr3
2 B T, K0 -42.8
B 364 -37.61760 -25.6
3 Be T, K0 -94.0
M 761 -69.6B 794 -69.0m 1556 -72.5
1760 -73.6
4 Br T, K2Br = Br2 0 9.8
m 266 1.5333 0.0
5 Fe T, K0 -65.0
M 964 -38.6B 1207 -35.6
1760 -40.8
6 H T, K0 -25.6
1760 -31.2
7 Hg T, K0 -48.3
M 514 -29.5B 592 -27.5b 630 -27.4
1760 -1.8
8 K T, K0 -196.4
m 336 -180.2M 1007 -150.6b 1031 -150.0
DGo , Kcal/mol2/3B + Br2 = 2/3BBr3
DGo , Kcal/mol2/3Be + Br2 = 2/3BeBr3
DGo , Kcal/mol
DGo , Kcal/molFe + Br2 = FeBr2
DGo , Kcal/molH2 + Br2 = 2HBr
DGo , Kcal/molHg + Br2 = HgBr2
DGo , Kcal/mol2K + Br2 = 2KBr
B 1657 -111.1
9 Li T, K0 -174.8
m 454 -158.4M 823 -144.3b 1597 -126.2
1611 -125.3
10 Mg T, K0 -129.1
m 923 -97.9M 984 -95.6b 1363 -85.8B 1557 -77.0
1760 -71.6
11 Na T, K0 -177.1
m 371 -164.6M 1020 -136.2b 1156 -133.5B 1720 -98.1
12 P T, K0 -30.3
1760 -9.4
13 Pb T, K0 -71.2
m 601 -52.8M 640 -51.5B 1187 -38.8
1760 -40.7
14 Ti T, K0 -80.8
M 311 -70.2B 504 -66.6
1760 -46.6
15 W T, K0 -34.2
B 582 -13.8
DGo , Kcal/mol2Li + Br2 = 2LiBr
DGo , Kcal/molMg + Br2 = MgBr2
DGo , Kcal/mol2Na + Br2 = 2NaBr
DGo , Kcal/mol2/3P + Br2 = 2/3PBr3
DGo , Kcal/molPb + Br2 = PbBr2
DGo , Kcal/mol1/2Ti + Br2 = 1/2TiBr4
DGo , Kcal/mol1/3W + Br2 = 1/3WBr6
1220 0.0
16 Zr T, K0 -98.5
B 630 -76.41760 -59.6
DGo , Kcal/mol1/2Zr + Br2 = 1/2ZrBr4
Chloride DataPart-1
1 C T, K
0 -12.32500 27.4
2 Ir T, K
0 -29.0M 2500 -4.0
3 Te T, K
0 -38.2M 497 -22.4B 665 -20.0m 723 -28.0b 1200 -12.0
4 Ta T, K
0 -47.4M 494 -32.3B 507 -32.1
2500 -9.4
5 Ag T, K
0 -60.0M 728 -41.4m 1234 -36.0B 1837 -27.6b 2485 -29.2
2500 -30.4
6 Ni T, K
0 -72.0M 626 -50.4B 1260 -30.0m 1725 -33.6
DGo , Kcal/mol
1/2C + Cl2 = 1/2CCl4
DGo , Kcal/mol
Ir + Cl2 = IrCl2
DGo , Kcal/mol
1/2Te + Cl2 = 1/2TeCl4 2/3P
DGo , Kcal/mol
2/5Ta + Cl2 = 2/5TaCl5 2/3Bi
DGo , Kcal/mol
2Ag + Cl2 = 2AgCl 2/3Fe + Cl2 = 2/3FeCl3
DGo , Kcal/mol
Ni + Cl2 = NiCl2 1/2Si
RUN
2500 -38.2
7 Ga T, K
0 -84.4m 303 -73.2M 351 -71.4B 575 -66.8
2500 -60.2
8 V T, K
0 -108.0M 1273 -64.0B 1650 -54.4m 2190 -53.2
2500 -52.0
9 U T, K
0 -140.6M 1108 -103.6m 1406 -95.4B 2000 -78.7
2500 -74.1
10 Ac T, K
0 -162.0M 1075 -128.4m 1090 -128.0B 2030 -101.6
2500 -97.6
11
12
DGo , Kcal/mol
2/3Ga + Cl2 = 2/3GaCl3 2/3In
DGo , Kcal/mol
V + Cl2 = VCl2 2/3Al
DGo , Kcal/mol
2/3U + Cl2 = 2/3UCl3 2/3Sc
DGo , Kcal/mol
2/3Ac + Cl2 = 2/3AcCl3 2/3La
13
14
15
16
17
18
19
1 Ac T, K
0 -162.0M 1075 -128.4m 1090 -128.0B 2030 -101.6
2500 -97.6
2 Ag T, K
0 -60.0M 728 -41.4m 1234 -36.0B 1837 -27.6b 2485 -29.2
2500 -30.4
3 Al T, K
0 -110.9M 465 -92.9B 500 -91.7m 932 -84.6b 2273 -70.2
2500 -71.6
4 As T, K
0 -47.2B 395 -35.2b 886 -36.0
2500 -16.4
5 Au T, K
0 -13.81000 -8.2
DGo , Kcal/mol
2/3Ac + Cl2 = 2/3AcCl3
DGo , Kcal/mol
2Ag + Cl2 = 2AgCl
DGo , Kcal/mol
2/3Al + Cl2 = 2/3AlCl3
DGo , Kcal/mol
2/3As + Cl2 = 2/3AsCl3
DGo , Kcal/mol
2Au + Cl2 = 2AuCl
6 Ba T, K
0 -205.1m 977 -169.2M 1235 -160.6b 1911 -140.0B 2100 -132.4
2500 -124.0
7 Ba T, K
0 -62.8m 2313 -44.4
2500 -42.8
8 Bi T, K
0 -59.2M 977 -44.4m 1235 -43.2B 1911 -40.0b 2100 -28.4
2500 -13.2
9 C T, K
0 -12.32500 27.4
10 Ca T, K
0 -188.8M 977 -154.0m 1235 -152.0b 1911 -136.0B 2100 -128.8
2500 -114.4
11 Cd T, K
0 -92.0m 977 -72.0M 1235 -62.4b 1911 -57.0B 2100 -48.0
2500 -18.0
DGo , Kcal/mol
Ba + Cl2 = BaCl2
DGo , Kcal/mol
2/3Ba + Cl2 = 2/3BaCl3
DGo , Kcal/mol
2/3Bi + Cl2 = 2/3BiCl3
DGo , Kcal/mol
1/2C + Cl2 = 1/2CCl4
DGo , Kcal/mol
Ca + Cl2 = CaCl2
DGo , Kcal/mol
Cd + Cl2 = CdCl2
12 Co T, K
0 -76.0M 1000 -45.0B 1323 -39.6m 1768 -40.6
2500 -39.2
13 Cr T, K
0 -87.6B 1220 -44.4m 2173 -42.8b 2495 -42.0
14 Cs T, K
0 -212.6m 977 -198.0M 1235 -164.0b 1911 -163.0B 2100 -127.0
2500 -108.0
15 Cu T, K
0 -63.7M 703 -46.9m 1356 -41.2B 1963 -36.5
16 Fe T, K
0 -80.4M 950 -53.5B 1285 -19.7m 1809 -30.6
2500 -54.6
17 Fe T, K
0 -63.8M 577 -46.4B 592 -46.0m 1809 -30.0
2500 -21.2
DGo , Kcal/mol
Co + Cl2 = CoCl2
DGo , Kcal/mol
2/3Cr + Cl2 = 2/3CrCl3
DGo , Kcal/mol
2Cs + Cl2 = 2CsCl
DGo , Kcal/mol
2Cu + Cl2 = 2CuCl
DGo , Kcal/mol
Fe + Cl2 = FeCl2
DGo , Kcal/mol
2/3Fe + Cl2 = 2/3FeCl3
18 Ga T, K
0 -84.4m 303 -73.2M 351 -71.4B 575 -66.8
2500 -60.2
19 Ge T, K
0 -64.8B 357 -55.2m 1210 -40.6
2500 -15.2
20 H T, K
0 -45.02500 -52.3
21 Hf T, K
0 -126.8B 590 -106.8
2500 -82.0
22 Hg T, K
0 -53.4M 550 -33.0B 577 -30.8b 630 -30.0
1800 0.0
23 In T, K
0 -85.0m 430 -71.4B 771 -59.2b 2400 -59.2
2500 -58.2
DGo , Kcal/mol
2/3Ga + Cl2 = 2/3GaCl3
DGo , Kcal/mol
2/3Ge + Cl2 = 2/3GeCl3
DGo , Kcal/mol
2H + Cl2 = 2HCl
DGo , Kcal/mol
1/2Hf + Cl2 = 1/2HfCl4
DGo , Kcal/mol
Hg + Cl2 = HgCl2
DGo , Kcal/mol
2/3In + Cl2 = 2/3InCl3
24 Ir T, K
0 -29.0 2/5P + Cl2 = 2/5PCl5M 2500 -4.0
25 K T, K
0 -209.4m 336 -193.2M 1031 -161.0b 1043 -160.0B 1680 -122.4
2500 -110.4
26 La T, K
0 -169.0M 1125 -131.2m 1153 -130.4B 2020 -109.0
2500 -106.0
27 Li T, K
0 -193.6 2/3Re + Cl2 = 2/3ReCl3m 459 -177.6M 887 -161.0b 1597 -141.2B 1655 -138.4
2500 -118.4
28 Mg T, K
0 -151.0 2/3Mn + Cl2 = 2/3MnCl3m 923 -116.0M 987 -115.6b 1376 -103.6B 1691 -90.0
2500 -68.4
29 Mn T, K
0 -73.5 2/3Sc + Cl2 = 2/3ScCl3M 860 -43.6B 900 -42.8m 1517 -37.0b 2309 -26.4
2500 -23.0
DGo , Kcal/mol
Ir + Cl2 = IrCl2
DGo , Kcal/mol
2K + Cl2 = 2KCl
DGo , Kcal/mol
2/3La + Cl2 = 2/3LaCl3
DGo , Kcal/mol
2Li + Cl2 = 2LiCl
DGo , Kcal/mol
Mg + Cl2 = MgCl2
DGo , Kcal/mol
2/3Mn + Cl2 = 2/3MnCl3
30 Mo T, K
0 -29.2 1/2Se + Cl2 = 1/2SeCl4M 580 -12.8B 630 -11.6
1500 0.0
31 Na T, K
0 -196.8 1/2Si + Cl2 = 1/2SiCl4m 371 -180.0M 1073 -149.4b 1156 -145.6B 1738 -110.0
2500 .96.8
32 Nb T, K
0 -46.4 2AgC + Cl2 = 2AgClM 483 -30.2B 519 -29.2
2500 1.2
33 Ni T, K
0 -72.0 2NaC + Cl2 = 2NaClM 626 -50.4B 1260 -30.0m 1725 -33.6
2500 -38.2
34 P T, K
0 -44.5 2/3Ga + Cl2 = 2/3GaCl3m 317 -41.1b 553 -38.5
1000 -32.0
35 P T, K
0 -38.2m 317 -30.6b 553 -25.0
1000 -13.8
DGo , Kcal/mol
1/3Mo + Cl2 = 1/3MoCl6
DGo , Kcal/mol
2Na + Cl2 = 2NaCl
DGo , Kcal/mol
2/5Nb + Cl2 = 2/5NbCl5
DGo , Kcal/mol
Ni + Cl2 = NiCl2
DGo , Kcal/mol
2/3P + Cl2 = 2/3PCl3
DGo , Kcal/mol
2/5P + Cl2 = 2/5PCl5
36 Pb T, K
0 -83.2m 601 -62.5M 771 -58.6B 1227 -47.6b 2023 -48.4
2500 -42.4
37 Pt T, K
0 -28.7856 0.0
38 Rb T, K
0 -210.4m 312 -195.9b 952 -164.7M 990 -161.6B 1654 -112.7
2000 -105.0
39 Re T, K
0 -35.9M 1000 3.7
40 Sb T, K
0 -59.2M 346 -50.4B 492 -47.0m 903 -44.4b 1713 -36.0
2500 -14.0
41 Sc T, K
0 -145.4M 1233 -104.6B 1350 -102.0m 1811 -101.6
2500 -101.4
DGo , Kcal/mol
Pb + Cl2 = PbCl2
DGo , Kcal/mol
Pt + Cl2 = PtCl2
DGo , Kcal/mol
2Rb + Cl2 = 2RbCl
DGo , Kcal/mol
2/3Re + Cl2 = 2/3ReCl3
DGo , Kcal/mol
2/3Sb + Cl2 = 2/3SbCl3
DGo , Kcal/mol
2/3Sc + Cl2 = 2/3ScCl3
42 Se T, K
0 -22.6B 469 -8.4m 491 -6.6b 1000 -1.0
43 Si T, K
0 -73.4B 330 -66.4m 1683 -47.2
2500 -30.8
44 Sn T, K
0 -63.4B 386 -52.4m 505 -50.4b 2473 -17.2
2500 -16.8
45 Sr T, K
0 -197.0m 1043 -160.7M 1145 -157.0b 1640 -144.0B 2300 -121.6
2500 -119.0
46 Ta T, K
0 -47.4M 494 -32.3B 507 -32.1
2500 -9.4
47 Te T, K
0 -38.2M 497 -22.4B 665 -20.0m 723 -28.0b 1200 -12.0
DGo , Kcal/mol
1/2Se + Cl2 = 1/2SeCl4
DGo , Kcal/mol
1/2Si + Cl2 = 1/2SiCl4
DGo , Kcal/mol
1/2Sn + Cl2 = 1/2SnCl4
DGo , Kcal/mol
Sr + Cl2 = SrCl2
DGo , Kcal/mol
2/5Ta + Cl2 = 2/5TaCl5
DGo , Kcal/mol
1/2Te + Cl2 = 1/2TeCl4
48 Ti T, K
0 -95.6B 409 -84.8m 1940 -62.6
2500 -54.0
49 U T, K
0 -140.6M 1108 -103.6m 1406 -95.4B 2000 -78.7
2500 -74.1
50 U T, K
0 -90.3M 452 -74.9B 550 -73.8m 1406 -64.2
51 V T, K
0 -108.0M 1273 -64.0B 1650 -54.4m 2190 -53.2
2500 -52.0
52 W T, K
0 -36.1B 548 -15.0
1500 -0.8
53 Y T, K
0 -154.4M 973 -124.6B 1725 -110.0m 1773 -109.6
2500 -107.6
DGo , Kcal/mol
1/2Ti + Cl2 = 1/2TiCl4
DGo , Kcal/mol
2/3U + Cl2 = 2/3UCl3
DGo , Kcal/mol
1/3U + Cl2 = 1/3UCl6
DGo , Kcal/mol
V + Cl2 = VCl2
DGo , Kcal/mol
1/3W + Cl2 = 1/3WCl6
DGo , Kcal/mol
2/3Y + Cl2 = 2/3YCl3
54 Zn T, K
0 -97.6M 556 -79.2m 692 -76.0B 1005 -68.0b 1180 -69.2
2500 -47.6
55 Zr T, K
0 -115.0B 604 -94.0m 2125 -75.0
2500 -69.6
DGo , Kcal/mol
Zn + Cl2 = ZnCl2
DGo , Kcal/mol
1/2Zr + Cl2 = 1/2ZrCl4
Part-2 Part-3
Au T, K Se T, K
0 -13.8 0 -22.61000 -8.2 B 469 -8.4
m 491 -6.6b 1000 -1.0
Pt T, K W T, K
0 -28.7 0 -36.1856 0.0 B 548 -15.0
1500 -0.8
P T, K Nb T, K
0 -44.5 0 -46.4m 317 -41.1 M 483 -30.2b 553 -38.5 B 519 -29.2
1000 -32.0 2500 1.2
Bi T, K Ba T, K
0 -59.2 0 -62.8M 977 -44.4 m 2313 -44.4m 1235 -43.2 2500 -42.8B 1911 -40.0b 2100 -28.4
2500 -13.2
Fe T, K Co T, K
0 -63.8 0 -76.0M 577 -46.4 M 1000 -45.0B 592 -46.0 B 1323 -39.6m 1809 -30.0 m 1768 -40.6
2500 -21.2 2500 -39.2
Si T, K U T, K
0 -73.4 0 -90.3B 330 -66.4 M 452 -74.9m 1683 -47.2 B 550 -73.8
2500 -30.8 m 1406 -64.2
DGo , Kcal/mol DGo , Kcal/mol
2Au + Cl2 = 2AuCl 1/2Se + Cl2 = 1/2SeCl
DGo , Kcal/mol DGo , Kcal/mol
Pt + Cl2 = PtCl2 1/3W + Cl2 = 1/3WCl
DGo , Kcal/mol DGo , Kcal/mol
2/3P + Cl2 = 2/3PCl3 2/5Nb + Cl2 = 2/5NbCl
DGo , Kcal/mol DGo , Kcal/mol
2/3Bi + Cl2 = 2/3BiCl 2/3Ba + Cl2 = 2/3BaCl
DGo , Kcal/mol DGo , Kcal/mol
2/3Fe + Cl2 = 2/3FeCl3 Co + Cl2 = CoCl2
DGo , Kcal/mol DGo , Kcal/mol
1/2Si + Cl2 = 1/2SiCl 1/3U + Cl2 = 1/3UCl
In T, K Zr T, K
0 -85.0 0 -115.0m 430 -71.4 B 604 -94.0B 771 -59.2 m 2125 -75.0b 2400 -59.2 2500 -69.6
2500 -58.2
Al T, K Mg T, K
0 -110.9 0 -151.0M 465 -92.9 m 923 -116.0B 500 -91.7 M 987 -115.6m 932 -84.6 b 1376 -103.6b 2273 -70.2 B 1691 -90.0
2500 -71.6 2500 -68.4
Sc T, K Ca T, K
0 -145.4 0 -188.8M 1233 -104.6 M 977 -154.0B 1350 -102.0 m 1235 -152.0m 1811 -101.6 b 1911 -136.0
2500 -101.4 B 2100 -128.82500 -114.4
La T, K Rb T, K
0 -169.0 0 -210.4M 1125 -131.2 m 312 -195.9m 1153 -130.4 b 952 -164.7B 2020 -109.0 M 990 -161.6
2500 -106.0 B 1654 -112.72000 -105.0
Sr T, K
0 -197.0m 1043 -160.7M 1145 -157.0b 1640 -144.0B 2300 -121.6
2500 -119.0
Ba T, K
0 -205.1m 977 -169.2M 1235 -160.6b 1911 -140.0
DGo , Kcal/mol DGo , Kcal/mol
2/3In + Cl2 = 2/3InCl 1/2Zr + Cl2 = 1/2ZrCl
DGo , Kcal/mol DGo , Kcal/mol
2/3Al + Cl2 = 2/3AlCl Mg + Cl2 = MgCl2
DGo , Kcal/mol DGo , Kcal/mol
2/3Sc + Cl2 = 2/3ScCl Ca + Cl2 = CaCl2
DGo , Kcal/mol DGo , Kcal/mol
2/3La + Cl2 = 2/3LaCl 2Rb + Cl2 = 2RbCl
DGo , Kcal/mol
Sr + Cl2 = SrCl2
DGo , Kcal/mol
Ba + Cl2 = BaCl2
B 2100 -132.42500 -124.0
old
Trans T, K Trans T, K
2/5P + Cl2 = 2/5PCl5 0 -38.2 2/5Ta + Cl2 = 2/5TaCl50 -47.4m 317 -30.6 M 494 -32.3b 553 -25.0 B 507 -32.1
1000 -13.8 2500 -9.4
Trans T, K Trans T, K
Pt + Cl2 = PtCl2 0 -28.7 1/2Te + Cl2 = 1/2TeCl40 -38.2856 0.0 M 497 -22.4
B 665 -20.0m 723 -28.0b 1200 -12.0
Trans T, K Trans T, K
2KC + Cl2 = 2KCl 0 -209.4 1/2Sn + Cl2 = 1/2SnCl40 -63.4m 336 -193.2 B 386 -52.4M 1031 -161.0 m 505 -50.4b 1043 -160.0 b 2473 -17.2B 1680 -122.4 2500 -16.8
2500 -110.4
Trans T, K Trans T, K
2/3Re + Cl2 = 2/3ReCl3 0 -35.9 1/2Ti + Cl2 = 1/2TiCl40 -95.6M 1000 3.7 B 409 -84.8
m 1940 -62.62500 -54.0
Trans T, K Trans T, K
2/3Mn + Cl2 = 2/3MnCl3 0 -73.5 1/3W + Cl2 = 1/3WCl60 -36.1M 860 -43.6 B 548 -15.0B 900 -42.8 1500 -0.8m 1517 -37.0b 2309 -26.4
2500 -23.0
Trans T, K Trans T, K
2/3Sc + Cl2 = 2/3ScCl3 0 -145.4 2/3U + Cl2 = 2/3UCl3 0 -140.6M 1233 -104.6 M 1108 -103.6B 1350 -102.0 m 1406 -95.4m 1811 -101.6 B 2000 -78.7
2500 -101.4 2500 -74.1
DGo , Kcal/mol DGo , Kcal/mol
DGo , Kcal/mol DGo , Kcal/mol
DGo , Kcal/mol DGo , Kcal/mol
DGo , Kcal/mol DGo , Kcal/mol
DGo , Kcal/mol DGo , Kcal/mol
DGo , Kcal/mol DGo , Kcal/mol
Trans T, K Trans T, K
1/2Se + Cl2 = 1/2SeCl4 0 -22.6 1/3U + Cl2 = 1/3UCl6 0 -90.3B 469 -8.4 M 452 -74.9m 491 -6.6 B 550 -73.8b 1000 -1.0 m 1406 -64.2
Trans T, K Trans T, K
1/2Si + Cl2 = 1/2SiCl4 0 -73.4 V + Cl2 = VCl2 0 -108.0B 330 -66.4 M 1273 -64.0m 1683 -47.2 B 1650 -54.4
2500 -30.8 m 2190 -53.22500 -52.0
Trans T, K Trans T, K
2AgC + Cl2 = 2AgCl 0 -60.0 2/3Y + Cl2 = 2/3YCl3 0 -154.4M 728 -41.4 M 973 -124.6m 1234 -36.0 B 1725 -110.0B 1837 -27.6 m 1773 -109.6b 2485 -29.2 2500 -107.6
2500 -30.4
Trans T, K Trans T, K
2NaC + Cl2 = 2NaCl 0 -196.8 Zn + Cl2 = ZnCl2 0 -97.6m 371 -180.0 M 556 -79.2M 1073 -149.4 m 692 -76.0b 1156 -145.6 B 1005 -68.0B 1738 -110.0 b 1180 -69.2
2500 .96.8 2500 -47.6
Trans T, K Trans T, K
2/3Ga + Cl2 = 2/3GaCl3 0 -84.4 1/2Zr + Cl2 = 1/2ZrCl40 -115.0m 303 -73.2 B 604 -94.0M 351 -71.4 m 2125 -75.0B 575 -66.8 2500 -69.6
2500 -60.2
Trans T, K
2RbC + Cl2 = 2RbCl 0 -210.4m 312 -195.9b 952 -164.7M 990 -161.6B 1654 -112.7
2000 -105.0
DGo , Kcal/mol DGo , Kcal/mol
DGo , Kcal/mol DGo , Kcal/mol
DGo , Kcal/mol DGo , Kcal/mol
DGo , Kcal/mol DGo , Kcal/mol
DGo , Kcal/mol DGo , Kcal/mol
DGo , Kcal/mol
Trans T, K
2/3Cr + Cl2 = 2/3CrCl30 -87.6B 1220 -44.4m 2173 -42.8b 2495 -42.0
DGo , Kcal/mol
Part-4 Part-5
Mo T, K Re
0 -29.2M 580 -12.8 MB 630 -11.6
1500 0.0
H T, K As
0 -45.02500 -52.3 B
b
Sb T, K Sn
0 -59.2M 346 -50.4 BB 492 -47.0 mm 903 -44.4 bb 1713 -36.0
2500 -14.0
Ge T, K Mn
0 -64.8B 357 -55.2 Mm 1210 -40.6 B
2500 -15.2 mb
Fe T, K Cr
0 -80.4M 950 -53.5 BB 1285 -19.7 mm 1809 -30.6 b
2500 -54.6
Cd T, K Ti
0 -92.0m 977 -72.0 BM 1235 -62.4 mb 1911 -57.0
DGo , Kcal/mol
1/3Mo + Cl2 = 1/3MoCl6 2/3Re + Cl2 = 2/3ReCl3
DGo , Kcal/mol
2H + Cl2 = 2HCl 2/3As + Cl2 = 2/3AsCl3
DGo , Kcal/mol
2/3Sb + Cl2 = 2/3SbCl3 1/2Sn + Cl2 = 1/2SnCl4
DGo , Kcal/mol
2/3Ge + Cl2 = 2/3GeCl3 2/3Mn + Cl2 = 2/3MnCl3
DGo , Kcal/mol
Fe + Cl2 = FeCl2 2/3Cr + Cl2 = 2/3CrCl3
DGo , Kcal/mol
Cd + Cl2 = CdCl2 1/2Ti + Cl2 = 1/2TiCl4
B 2100 -48.02500 -18.0
Hf T, K Y
0 -126.8B 590 -106.8 M
2500 -82.0 Bm
Cs T, K Li
0 -212.6m 977 -198.0 mM 1235 -164.0 Mb 1911 -163.0 bB 2100 -127.0 B
2500 -108.0
DGo , Kcal/mol
1/2Hf + Cl2 = 1/2HfCl4 2/3Y + Cl2 = 2/3YCl3
DGo , Kcal/mol
2Cs + Cl2 = 2CsCl 2Li + Cl2 = 2LiCl
Trans T, K Trans
2/3Ac + Cl2 = 2/3AcCl3 0 -162.0M 1075 -128.4 Mm 1090 -128.0 BB 2030 -101.6 m
2500 -97.6
Trans T, K Trans
2/3Al + Cl2 = 2/3AlCl3 0 -110.9M 465 -92.9 MB 500 -91.7 mm 932 -84.6 Bb 2273 -70.2
2500 -71.6
Trans T, K Trans
2/3Sb + Cl2 = 2/3SbCl3 0 -59.2M 346 -50.4 BB 492 -47.0 mm 903 -44.4b 1713 -36.0
2500 -14.0
Trans T, K Trans
2/3As + Cl2 = 2/3AsCl3 0 -47.2B 395 -35.2b 886 -36.0
2500 -16.4
Trans T, K Trans
Ba + Cl2 = BaCl2 0 -205.1m 977 -169.2 BM 1235 -160.6b 1911 -140.0B 2100 -132.4
2500 -124.0
Trans T, K Trans
2/3Bi + Cl2 = 2/3BiCl3 0 -59.2M 977 -44.4m 1235 -43.2B 1911 -40.0b 2100 -28.4
2500 -13.2
DGo , Kcal/mol
Co + Cl2 = CoCl2
DGo , Kcal/mol
2Cu + Cl2 = 2CuCl
DGo , Kcal/mol
2/3Ge + Cl2 = 2/3GeCl3
DGo , Kcal/mol
2Au + Cl2 = 2AuCl
DGo , Kcal/mol
1/2Hf + Cl2 = 1/2HfCl4
DGo , Kcal/mol
2H + Cl2 = 2HCl
Trans T, K Trans
Cd + Cl2 = CdCl2 0 -92.0m 977 -72.0 mM 1235 -62.4 Bb 1911 -57.0 bB 2100 -48.0
2500 -18.0
Trans T, K Trans
Ca + Cl2 = CaCl2 0 -188.8M 977 -154.0 Mm 1235 -152.0b 1911 -136.0B 2100 -128.8
2500 -114.4
Trans T, K Trans
1/2C + Cl2 = 1/2CCl4 0 -12.32500 27.4 M
Bm
Trans T, K Trans
2CsC + Cl2 = 2CsCl 0 -212.6m 977 -198.0 MM 1235 -164.0 Bb 1911 -163.0 mB 2100 -127.0
2500 -108.0
Trans T, K
2/3Ba + Cl2 = 2/3BaCl3 0 -62.8m 2313 -44.4
2500 -42.8
DGo , Kcal/mol
2/3In + Cl2 = 2/3InCl3
DGo , Kcal/mol
Ir + Cl2 = IrCl2
DGo , Kcal/mol
Fe + Cl2 = FeCl2
DGo , Kcal/mol
2/3Fe + Cl2 = 2/3FeCl3
DGo , Kcal/mol
Part-6
T, K P T, K
0 -35.9 0 -38.21000 3.7 m 317 -30.6
b 553 -25.01000 -13.8
T, K Hg T, K
0 -47.2 0 -53.4395 -35.2 M 550 -33.0886 -36.0 B 577 -30.8
2500 -16.4 b 630 -30.01800 0.0
T, K Cu T, K
0 -63.4 0 -63.7386 -52.4 M 703 -46.9505 -50.4 m 1356 -41.2
2473 -17.2 B 1963 -36.52500 -16.8
T, K Pb T, K
0 -73.5 0 -83.2860 -43.6 m 601 -62.5900 -42.8 M 771 -58.6
1517 -37.0 B 1227 -47.62309 -26.4 b 2023 -48.42500 -23.0 2500 -42.4
T, K Zn T, K
0 -87.6 0 -97.61220 -44.4 M 556 -79.22173 -42.8 m 692 -76.02495 -42.0 B 1005 -68.0
b 1180 -69.22500 -47.6
T, K Na T, K
0 -95.6 0 -196.8409 -84.8 m 371 -180.0
1940 -62.6 M 1073 -149.42500 -54.0 b 1156 -145.6
DGo , Kcal/mol DGo , Kcal/mol
2/5P + Cl2 = 2/5PCl
DGo , Kcal/mol DGo , Kcal/mol
Hg + Cl2 = HgCl
DGo , Kcal/mol DGo , Kcal/mol
2Cu + Cl2 = 2CuCl
DGo , Kcal/mol DGo , Kcal/mol
Pb + Cl2 = PbCl
DGo , Kcal/mol DGo , Kcal/mol
Zn + Cl2 = ZnCl2
DGo , Kcal/mol DGo , Kcal/mol
2Na + Cl2 = 2NaCl
B 1738 -110.02500 .96.8
T, K K T, K
0 -154.4 0 -209.4973 -124.6 m 336 -193.2
1725 -110.0 M 1031 -161.01773 -109.6 b 1043 -160.02500 -107.6 B 1680 -122.4
2500 -110.4
T, K
0 -193.6459 -177.6887 -161.0
1597 -141.21655 -138.42500 -118.4
DGo , Kcal/mol DGo , Kcal/mol
2K + Cl2 = 2KCl
DGo , Kcal/mol
T, K
0 -76.01000 -45.01323 -39.61768 -40.62500 -39.2
T, K
0 -63.7703 -46.9
1356 -41.21963 -36.5
T, K
0 -64.8357 -55.2
1210 -40.62500 -15.2
T, K
0 -13.81000 -8.2
T, K
0 -126.8590 -106.8
2500 -82.0
T, K
0 -45.02500 -52.3
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
T, K
0 -85.0430 -71.4771 -59.2
2400 -59.22500 -58.2
T, K
0 -29.02500 -4.0
T, K
0 -80.4950 -53.5
1285 -19.71809 -30.62500 -54.6
T, K
0 -63.8577 -46.4592 -46.0
1809 -30.02500 -21.2
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
Fluoride DataPart-1 Part-2
1 Ir T, K Se T, K0 -43.3 0 -82.0
M 317 -34.4 m 491 -70.0B 326 -34.2 b 1000 -54.0
2100 0.0 2000 -23.0
2 Au T, K Ag T, K0 -66.0 0 -97.0
M 850 -32.0 M 708 -77.0m 1336 -25.0 m 1234 -73.0B 1475 -22.0 B 1420 -70.0
2500 -14.0 2485 -104.0
3 C T, K P T, K0 -81.2 0 -113.4
2500 -36.0 m 317 -109.3M 553 -106.1
4 Re T, K Cu T, K0 -90.3 0 -127.0
M 292 -83.4 M 1200 -89.0B 307 -83.1 m 1356 -85.0
500 0.0 B 2000 -70.02500 -73.0
5 Te T, K W T, K0 -105.0 0 -139.8
m 723 -86.0 1000 -116.4b 1267 -71.0
2400 -39.0
6 Sb T, K Ni T, K0 -122.0 0 -156.5
B 423 -112.0 M 1200 -113.6m 903 -104.0b 1713 -93.0
2500 -74.0
7 Mo T, K U T, K0 -134.9 0 -166.3
B 309 -128.0 B 329 -159.0
DGo , Kcal/mol DGo , Kcal/mol1/2Ir + F2 = 1/2IrF4 1/3Se + F2 = 1/3SeF6
DGo , Kcal/mol DGo , Kcal/mol2/3Au + F2 = 2/3AuF3 2Ag + F2 = 2AgF
DGo , Kcal/mol DGo , Kcal/mol1/2C + F2 = 1/2CF4 2/3P + F2 = 2/3PF3
DGo , Kcal/mol DGo , Kcal/mol1/3Re + F2 = 1/3ReF6 Cu + F2 = CuF2
DGo , Kcal/mol DGo , Kcal/mol1/3Te + F2 = 1/3TeF6 1/3W + F2 = 1/3WF6
DGo , Kcal/mol DGo , Kcal/mol2/5Sb + F2 = 2/5SbF5 Ni + F2 = NiF2
DGo , Kcal/mol DGo , Kcal/mol1/3Mo + F2 = 1/3MoF6 1/3U + F2 = 1/3UF6
RUN RUN
2500 -85.0 m 1405 -134.32500 -120.3
8 Bi T, K Ti T, K0 -143.0 0 -185.0
m 544 -126.0 B 557 -167.0M 1000 -110.0 b 1940 -150.0B 1300 -102.0 2500 -143.0b 1900 -97.0
2500 -81.0
9 Cd T, K Ce T, K0 -165.0 0 -221.0
m 594 -142.0 m 1040 -184.0b 1040 -125.0 M 1250 -177.0M 1383 -107.0 B 2000 -156.0B 2020 -73.0 2500 -150.0
2500 -62.0
10 Nb T, K Y T, K0 -173.7 0 -264.6
m 351 -160.1 M 1660 -208.0B 506 -156.4 m 1773 -207.0
2500 -113.7 B 2300 -194.02500 -194.0
11 B T, K La T, K0 -183.0 0 -280.6
m 2300 -160.0 m 1153 -238.02500 -158.0 M 1800 -216.0
2500 -197.0
12 Li T, K0 -290.0
m 453 -271.0M 1120 -240.0B 1597 -216.0
1954 -194.02500 -179.0
13
14
DGo , Kcal/mol DGo , Kcal/mol2/3Bi + F2 = 2/3BiF3 1/2Ti + F2 = 1/2TiF4
DGo , Kcal/mol DGo , Kcal/molCd + F2 = CdF2 1/2Ce + F2 = 1/2CeF4
DGo , Kcal/mol DGo , Kcal/mol2/5Nb + F2 = 2/5NbF5 2/3Y + F2 = 2/3YF3
DGo , Kcal/mol DGo , Kcal/mol2/3B + F2 = 2/3BF3 2/3La + F2 = 2/3LaF3
DGo , Kcal/mol2Li + F2 = 2LiF
15
16
17
18
19
1 Ac T, K0 -262.0
m 1090 -222.0M 1600 -207.0
2500 -177.0
DGo , Kcal/mol2/3Ac + F2 = 2/3AcF3
2 Ag T, K0 -97.0
M 708 -77.0m 1234 -73.0B 1420 -70.0
2485 -104.0
3 Al T, K0 -215.3
m 932 -181.0M 1545 -156.0
2500 -157.0
4 As T, K0 -106.0
B 883 -86.02500 -46.0
5 Au T, K0 -66.0
M 850 -32.0m 1336 -25.0B 1475 -22.0
2500 -14.0
6 B T, K0 -183.0
m 2300 -160.02500 -158.0
7 Ba T, K0 -284.0
m 977 -246.0M 1593 -227.0b 1911 -216.0B 2473 -191.0
8 Be T, K0 -220.0
M 1070 -175.0m 1556 -157.0B 1600 -156.0
DGo , Kcal/mol2Ag + F2 = 2AgF
DGo , Kcal/mol2/3Al + F2 = 2/3AlF3
DGo , Kcal/mol2/5As + F2 = 2/5AsF5
DGo , Kcal/mol2/3Au + F2 = 2/3AuF3
DGo , Kcal/mol2/3B + F2 = 2/3BF3
DGo , Kcal/molBa + F2 = BaF2
DGo , Kcal/mol2/3Be + F2 = 2/3BeF3
2500 -146.0
9 Bi T, K0 -143.0
m 544 -126.0M 1000 -110.0B 1300 -102.0b 1900 -97.0
2500 -81.0
10 C T, K0 -81.2
2500 -36.0
11 Ca T, K0 -288.0
m 1123 -245.0M 1691 -224.0b 1955 -222.0
2500 -186.0
12 Cd T, K0 -165.0
m 594 -142.0b 1040 -125.0M 1383 -107.0B 2020 -73.0
2500 -62.0
13 Ce T, K0 -221.0
m 1040 -184.0M 1250 -177.0B 2000 -156.0
2500 -150.0
14 Co T, K0 -158.0
M 1475 -108.2
15 Cr T, K206 -176.0
M 1373 -136.0
DGo , Kcal/mol2/3Bi + F2 = 2/3BiF3
DGo , Kcal/mol1/2C + F2 = 1/2CF4
DGo , Kcal/molCa + F2 = CaF2
DGo , Kcal/molCd + F2 = CdF2
DGo , Kcal/mol1/2Ce + F2 = 1/2CeF4
DGo , Kcal/molCo + F2 = CoF2
DGo , Kcal/mol2/3Cr + F2 = 2/3CrF3
B 1700 -132.0m 2173 -122.0
2500 -120.0
16 Cu T, K0 -127.0
M 1200 -89.0m 1356 -85.0B 2000 -70.0
2500 -73.0
17 Fe T, K0 -167.0
M 1375 -123.2
18 Ga T, K0 -170.9
m 303 -159.0M 1225 -125.0
2500 -115.0
19 Ge T, K0 -140.0
m 1210 -120.02500 -94.0
20 H T, K0 -129.8
1287 -134.1
21 Hf T, K0 -217.0
B 1200 -173.02500 -160.0
22 Hg T, K
DGo , Kcal/molCu + F2 = CuF2
DGo , Kcal/molFe + F2 = FeF2
DGo , Kcal/mol2/3Ga + F2 = 2/3GaF3
DGo , Kcal/mol1/2Ge + F2 = 1/2GeF4
DGo , Kcal/mol2H + F2 = 2HF
DGo , Kcal/mol1/2Hf + F2 = 1/2HfF4
DGo , Kcal/mol
0 -94.0m 630 -70.0M 918 -54.0B 920 -54.0
2500 -12.0
23 In T, K0 -166.7
m 429 -152.0M 1443 -117.0B 1650 -114.0b 2440 -109.0
24 Ir T, K0 -43.3
M 317 -34.4B 326 -34.2
2100 0.0
25 K T, K0 -270.0
m 336 -253.0M 1031 -214.0b 1130 -209.0B 1775 -166.0
2500 -150.0
26 La T, K0 -280.6
m 1153 -238.0M 1800 -216.0
2500 -197.0
27 Li T, K0 -290.0
m 453 -271.0M 1120 -240.0B 1597 -216.0
1954 -194.02500 -179.0
28 Mg T, K0 -263.0
m 923 -224.0b 1393 -207.0B 1536 -197.0
2500 -144.0
Hg + F2 = HgF2
DGo , Kcal/mol2/3In + F2 = 2/3InF3
DGo , Kcal/mol1/2Ir + F2 = 1/2IrF4
DGo , Kcal/mol2K + F2 = 2KF
DGo , Kcal/mol2/3La + F2 = 2/3LaF3
DGo , Kcal/mol2Li + F2 = 2LiF
DGo , Kcal/molMg + F2 = MgF2
29 Mn T, K0 -189.5
M 1129 -152.8m 1517 -143.2
30 Mo T, K0 -134.9
B 309 -128.02500 -85.0
31 Na T, K0 -274.0
m 371 -255.0M 1187 -214.0b 1268 -209.0B 1977 -156.0
2500 -150.0
32 Nb T, K0 -173.7
m 351 -160.1B 506 -156.4
2500 -113.7
33 Ni T, K0 -156.5
M 1200 -113.6
34 P T, K0 -113.4
m 317 -109.3M 553 -106.1
35 Pb T, K0 -158.0
m 601 -137.8M 1097 -121.2
DGo , Kcal/molMn + F2 = MnF2
DGo , Kcal/mol1/3Mo + F2 = 1/3MoF6
DGo , Kcal/mol2Na + F2 = 2NaF
DGo , Kcal/mol2/5Nb + F2 = 2/5NbF5
DGo , Kcal/molNi + F2 = NiF2
DGo , Kcal/mol2/3P + F2 = 2/3PF3
DGo , Kcal/molPb + F2 = PbF2
36 Pt T, K0 -94.3
M 875 -65.4B 1000 -62.3m 2043 -47.3
37 Re T, K0 -90.3
M 292 -83.4B 307 -83.1
500 0.0
38 S T, K0 -86.7
2000 -20.1
39 Sb T, K0 -122.0
B 423 -112.0m 903 -104.0b 1713 -93.0
2500 -74.0
40 Sc T, K0 -244.6
M 1500 -190.0B 1800 -183.0m 1811 -183.0
2500 -179.0
41 Se T, K0 -82.0
m 491 -70.0b 1000 -54.0
2000 -23.0
42 Si T, K0 -185.4
m 1683 -157.0
DGo , Kcal/mol2/5Pt + F2 = 2/5PtF5
DGo , Kcal/mol1/3Re + F2 = 1/3ReF6
DGo , Kcal/mol1/3S + F2 = 1/3SF6
DGo , Kcal/mol2/5Sb + F2 = 2/5SbF5
DGo , Kcal/mol2/3Sc + F2 = 2/3ScF3
DGo , Kcal/mol1/3Se + F2 = 1/3SeF6
DGo , Kcal/mol1/2Si + F2 = 1/2SiF4
2500 -141.0
43 Sn T, K0 -129.5
m 505 -111.0M 720 -104.0B 978 -96.0b 2473 -68.0
2500 -68.0
44 Sr T, K0 -288.0
m 1043 -248.0b 1640 -228.0M 1673 -227.0
2500 -186.0
45 Ta T, K0 -144.4
M 370 -133.5B 502 -130.7
2500 -108.4
46 Te T, K0 -105.0
m 723 -86.0b 1267 -71.0
2400 -39.0
47 Th T, K0 -238.5
M 1330 -189.0m 1968 -173.0B 2000 -172.0
2500 -164.0
48 Ti T, K0 -185.0
B 557 -167.0b 1940 -150.0
2500 -143.0
49 Tl T, K
DGo , Kcal/mol1/2Sn + F2 = 1/2SnF4
DGo , Kcal/molSr + F2 = Srf2
DGo , Kcal/mol2/5Ta + F2 = 2/5TaF5
DGo , Kcal/mol1/3Te + F2 = 1/3TeF6
DGo , Kcal/mol1/2Th + F2 = 1/2ThF4
DGo , Kcal/mol1/2Ti + F2 = 1/2TiF4
DGo , Kcal/mol
0 -129.0m 577 -110.0M 600 -109.0
B 928 -100.0b 1730 -116.0
2500 -98.0
50 U T, K0 -166.3
B 329 -159.0m 1405 -134.3
2500 -120.3
51 V T, K0 -190.0
M 1400 -137.5
52 W T, K0 -139.8
1000 -116.4
53 Y T, K0 -264.6
M 1660 -208.0m 1773 -207.0B 2300 -194.0
2500 -194.0
54 Zn T, K0 -174.0
m 693 -148.0M 1145 -130.0b 1180 -129.0B 1775 -96.0
2500 -75.0
55 Zr T, K0 -222.5
B 1176 -182.0m 2125 -175.0
2500 -171.0
2Tl + F2 = 2TlF
DGo , Kcal/mol1/3U + F2 = 1/3UF6
DGo , Kcal/mol2/3V + F2 = 2/3VF3
DGo , Kcal/mol1/3W + F2 = 1/3WF6
DGo , Kcal/mol2/3Y + F2 = 2/3YF3
DGo , Kcal/molZn + F2 = ZnF2
DGo , Kcal/mol1/2Zr + F2 = 1/2ZrF4
56
57
58
59
60
61
62
63
64
65
Part-3 Part-4S T, K Pt T, K
0 -86.7 02000 -20.1 M 875
B 1000m 2043
Hg T, K Sn T, K0 -94.0 0
m 630 -70.0 m 505M 918 -54.0 M 720B 920 -54.0 B 978
2500 -12.0 b 24732500
As T, K Ta T, K0 -106.0 0
B 883 -86.0 M 3702500 -46.0 B 502
2500
Tl T, K Pb T, K0 -129.0 0
m 577 -110.0 m 601M 600 -109.0 M 1097B 928 -100.0b 1730 -116.0
2500 -98.0
Ge T, K Fe T, K0 -140.0 0
m 1210 -120.0 M 13752500 -94.0
Co T, K Cr T, K0 -158.0 206
M 1475 -108.2 M 1373B 1700m 2173
2500
Ga T, K V T, K0 -170.9 0
m 303 -159.0 M 1400
DGo , Kcal/mol1/3S + F2 = 1/3SF6 2/5Pt + F2 = 2/5PtF5
DGo , Kcal/molHg + F2 = HgF2 1/2Sn + F2 = 1/2SnF4
DGo , Kcal/mol2/5As + F2 = 2/5AsF5 2/5Ta + F2 = 2/5TaF5
DGo , Kcal/mol2Tl + F2 = 2TlF Pb + F2 = PbF2
DGo , Kcal/mol1/2Ge + F2 = 1/2GeF4 Fe + F2 = FeF2
DGo , Kcal/molCo + F2 = CoF2 2/3Cr + F2 = 2/3CrF3
DGo , Kcal/mol2/3Ga + F2 = 2/3GaF3 2/3V + F2 = 2/3VF3
RUN
M 1225 -125.02500 -115.0
Si T, K Hf T, K0 -185.4 0
m 1683 -157.0 B 12002500 -141.0 2500
Be T, K Sc T, K0 -220.0 0
M 1070 -175.0 M 1500m 1556 -157.0 B 1800B 1600 -156.0 m 1811
2500 -146.0 2500
Mg T, K K T, K0 -263.0 0
m 923 -224.0 m 336b 1393 -207.0 M 1031B 1536 -197.0 b 1130
2500 -144.0 B 17752500
Ba T, K Sr T, K0 -284.0 0
m 977 -246.0 m 1043M 1593 -227.0 b 1640b 1911 -216.0 M 1673B 2473 -191.0 2500
DGo , Kcal/mol1/2Si + F2 = 1/2SiF4 1/2Hf + F2 = 1/2HfF4
DGo , Kcal/mol2/3Be + F2 = 2/3BeF3 2/3Sc + F2 = 2/3ScF3
DGo , Kcal/molMg + F2 = MgF2 2K + F2 = 2KF
DGo , Kcal/molBa + F2 = BaF2 Sr + F2 = Srf2
Part-5H T, K
-94.3 0 -129.8-65.4 1287 -134.1-62.3-47.3
In T, K-129.5 0 -166.7-111.0 m 429 -152.0-104.0 M 1443 -117.0-96.0 B 1650 -114.0-68.0 b 2440 -109.0-68.0
Zn T, K-144.4 0 -174.0-133.5 m 693 -148.0-130.7 M 1145 -130.0-108.4 b 1180 -129.0
B 1775 -96.02500 -75.0
Mn T, K-158.0 0 -189.5-137.8 M 1129 -152.8-121.2 m 1517 -143.2
Al T, K-167.0 0 -215.3-123.2 m 932 -181.0
M 1545 -156.02500 -157.0
Zr T, K-176.0 0 -222.5-136.0 B 1176 -182.0-132.0 m 2125 -175.0-122.0 2500 -171.0-120.0
Th T, K-190.0 0 -238.5-137.5 M 1330 -189.0
DGo , Kcal/mol DGo , Kcal/mol2H + F2 = 2HF
DGo , Kcal/mol DGo , Kcal/mol2/3In + F2 = 2/3InF3
DGo , Kcal/mol DGo , Kcal/molZn + F2 = ZnF2
DGo , Kcal/mol DGo , Kcal/molMn + F2 = MnF2
DGo , Kcal/mol DGo , Kcal/mol2/3Al + F2 = 2/3AlF3
DGo , Kcal/mol DGo , Kcal/mol1/2Zr + F2 = 1/2ZrF4
DGo , Kcal/mol DGo , Kcal/mol1/2Th + F2 = 1/2ThF4
RUN
m 1968 -173.0B 2000 -172.0
2500 -164.0
Ac T, K-217.0 0 -262.0-173.0 m 1090 -222.0-160.0 M 1600 -207.0
2500 -177.0
Na T, K-244.6 0 -274.0-190.0 m 371 -255.0-183.0 M 1187 -214.0-183.0 b 1268 -209.0-179.0 B 1977 -156.0
2500 -150.0
Ca T, K-270.0 0 -288.0-253.0 m 1123 -245.0-214.0 M 1691 -224.0
-209.0 b 1955 -222.0-166.0 2500 -186.0-150.0
-288.0-248.0-228.0-227.0-186.0
DGo , Kcal/mol DGo , Kcal/mol2/3Ac + F2 = 2/3AcF3
DGo , Kcal/mol DGo , Kcal/mol2Na + F2 = 2NaF
DGo , Kcal/mol DGo , Kcal/molCa + F2 = CaF2
DGo , Kcal/mol
Hydride DataPart-1 Part-2
1 I T, K N T, K
0 -3.1 0 -8.01550 -8.6 439 0.0
2 Mg T, K Br T, K
0 -17.6 0 -25.6554 0.0 1700 -31.0
3 Cs T, K Na T, K
0 -26.2 0 -27.1302 -14.8 m 371 -13.4661 0.0 M 900 -7.9
4 Ca T, K Ba T, K
0 -42.0 0 -40.9m 713 -19.8 m 983 -10.1
1067 0.0 1286 0.0
5 Li T, K Cl T, K
0 -43.6 0 -45.0m 454 -27.4 1700 -49.9M 962 -7.1
1217 0.0
6
DGo , Kcal/mol DGo , Kcal/mol
2I + H2 = 2IH 2/3N + H2 = 2/3NH3
DGo , Kcal/mol DGo , Kcal/mol
Mg + H2 = MgH2 2Br + H2 = 2BrH
DGo , Kcal/mol DGo , Kcal/mol
2Cs + H2 = 2CsH 2Na + H2 = 2NaH
DGo , Kcal/mol DGo , Kcal/mol
Ca + H2 = CaH2 Ba + H2 = BaH2
DGo , Kcal/mol DGo , Kcal/mol
2Li + H2 = 2LiH 2Cl + H2 = 2ClH
RUN
7
8
9
10
11
12
13
14
15
16
17
18
19
1 As T, K
0 9.7b 886 13.0
1630 21.0
2 B T, K
0 1.51700 29.6
3 Ba T, K
0 -40.9m 983 -10.1
1286 0.0
4 Be T, K
0 1.0500 13.6
5 Br T, K
0 -25.61700 -31.0
6 C T, K
DGo , Kcal/mol
2/3As + H2 = 2/3AsH3
DGo , Kcal/mol
2/3B + H2 = 2/3BH3
DGo , Kcal/mol
Ba + H2 = BaH2
DGo , Kcal/mol
Be + H2 = BeH2
DGo , Kcal/mol
2Br + H2 = 2BrH
DGo , Kcal/mol
0 -9.61417 0.0
7 C T, K
0 53.71700 31.6
8 Ca T, K
0 -42.0m 713 -19.8
1067 0.0
9 Cl T, K
0 -45.01700 -49.9
10 Cs T, K
0 -26.2302 -14.8661 0.0
11 F T, K
0 -129.81287 -134.1
12 Ge T, K
1/2C + H2 = 1/2CH4
DGo , Kcal/mol
2C + H2 = C2H2
DGo , Kcal/mol
Ca + H2 = CaH2
DGo , Kcal/mol
2Cl + H2 = 2ClH
DGo , Kcal/mol
2Cs + H2 = 2CsH
DGo , Kcal/mol
2F + H2 = 2FH
DGo , Kcal/mol
0 10.01210 23.81700 27.2
13 I T, K
0 -3.11550 -8.6
14 K T, K
0 -27.7m 336 -13.4
M 701 0.0
15 Li T, K
0 -43.6m 454 -27.4
M 962 -7.11217 0.0
16 Mg T, K
0 -17.6554 0.0
17 N T, K
0 -8.0439 0.0
18 N T, K
1/2Ge + H2 = 1/2GeH4
DGo , Kcal/mol
2I + H2 = 2IH
DGo , Kcal/mol
2K + H2 = 2KH
DGo , Kcal/mol
2Li + H2 = 2LiH
DGo , Kcal/mol
Mg + H2 = MgH2
DGo , Kcal/mol
2/3N + H2 = 2/3NH3
DGo , Kcal/mol
0 10.71500 51.7
19 Na T, K
0 -27.1m 371 -13.4M 900 -7.9
20 P T, K
0 3.0b 704 5.3
1540 14.9
21 Pb T, K
0 29.6m 601 36.8
1700 52.6
22 Rb T, K
0 -25.0m 312 -13.3
627 0.0
23 Sb T, K
0 22.4m 903 25.6
1700 32.3
24 Si T, K
2N + H2 = N2H2
DGo , Kcal/mol
2Na + H2 = 2NaH
DGo , Kcal/mol
2/3P + H2 = 2/3PH3
DGo , Kcal/mol
1/2Pb + H2 = 1/2PbH4
DGo , Kcal/mol
2Rb + H2 = 2RbH
DGo , Kcal/mol
2/3Sb + H2 = 2/3SbH3
DGo , Kcal/mol
0 2.7m 1683 21.7
1700 21.9
25 Sn T, K
0 19.1m 505 24.8
1700 42.2
26 Sr T, K
0 -42.3m 1043 -9.6
1330 0.0
27
H T, KH2 0 -59.6
1700 -36.4
1/2Si + H2 = 1/2SiH4
DGo , Kcal/mol
1/2Sn + H2 = 1/2SnH4
DGo , Kcal/mol
Sr + H2 = SrH2
DGo , Kcal/mol
Part-3 Part-4 p
C T, K Pb T, K
0 -9.6 0 29.61417 0.0 m 601 36.8
1700 52.6
Rb T, K Sn T, K
0 -25.0 0 19.1m 312 -13.3 m 505 24.8
627 0.0 1700 42.2
K T, K Ge T, K
0 -27.7 0 10.0m 336 -13.4 1210 23.8M 701 0.0 1700 27.2
Sr T, K P T, K
0 -42.3 0 3.0m 1043 -9.6 b 704 5.3
1330 0.0 1540 14.9
F T, K B T, K
0 -129.8 0 1.51287 -134.1 1700 29.6
DGo , Kcal/mol DGo , Kcal/mol
1/2C + H2 = 1/2CH4 1/2Pb + H2 = 1/2PbH4
DGo , Kcal/mol DGo , Kcal/mol
2Rb + H2 = 2RbH 1/2Sn + H2 = 1/2SnH4
DGo , Kcal/mol DGo , Kcal/mol
2K + H2 = 2KH 1/2Ge + H2 = 1/2GeH4
DGo , Kcal/mol DGo , Kcal/mol
Sr + H2 = SrH2 2/3P + H2 = 2/3PH3
DGo , Kcal/mol DGo , Kcal/mol
2F + H2 = 2FH 2/3B + H2 = 2/3BH3
Part-5 p
C T, K
0 53.71700 31.6
Sb T, K
0 22.4m 903 25.6
1700 32.3
N T, K
0 10.71500 51.7
As T, K
0 9.7b 886 13.0
1630 21.0
Si T, K
0 2.7m 1683 21.7
1700 21.9
Be T, K
0 1.0500 13.6
DGo , Kcal/mol
2C + H2 = C2H2
DGo , Kcal/mol
2/3Sb + H2 = 2/3SbH3
DGo , Kcal/mol
2N + H2 = N2H2
DGo , Kcal/mol
2/3As + H2 = 2/3AsH3
DGo , Kcal/mol
1/2Si + H2 = 1/2SiH4
DGo , Kcal/mol
Be + H2 = BeH2
Iodide DataPart-1 Part-2
1 H T, K Fe T, K
0 -3.1 0 -26.51550 -8.6 M 860 -17.1
B 1366 -12.0
2 Hg T, K Ti T, K
0 -38.7 0 -58.7M 530 -20.8 M 428 -44.8B 627 -18.6 B 650 -40.6b 630 -18.5 1550 -25.1
1460 0.0
3 Pb T, K Be T, K
0 -55.9 0 -63.3m 601 -35.8 B 755 -39.6M 680 -33.0 m 1556 -44.1B 1135 -21.2
1550 -23.9
4 Al T, K Li T, K
0 -60.7 0 -143.6464 -48.5 m 454 -126.2558 -45.8 M 742 -113.8932 -39.2 B 1415 -95.5
1550 -32.0 1550 -97.0
5 Zr T, K K T, K
0 -71.7 0 -169.1m 704 -48.0 m 336 -156.5
1550 -36.6 M 954 -131.8b 1031 -128.2B 1617 -93.0
6 Na T, K
0 -154.3m 371 -139.0M 933 -113.8b 1156 -109.2
DGo , Kcal/mol DGo , Kcal/mol
2H + I2 = 2HI Fe + I2 = FeI2
DGo , Kcal/mol DGo , Kcal/mol
Hg + I2 = HgI2 1/2Ti + I2 = 1/2TiI4
DGo , Kcal/mol DGo , Kcal/mol
Pb + I2 = PbI2 Be + I2 = BeI2
DGo , Kcal/mol DGo , Kcal/mol
2/3Al + I2 = 2/3AlI3 2Li + I2 = 2LiI
DGo , Kcal/mol DGo , Kcal/mol
1/2Zr + I2 = 1/2ZrI4 2K + I2 = 2KI
DGo , Kcal/mol
2Na + I2 = 2NaI
RUN
B 1577 -83.2
7
8
9
10
11
12
13
14
15
16
17
18
19
1 Al T, K
0 -60.7464 -48.5558 -45.8932 -39.2
1550 -32.0
2 Be T, K
0 -63.3B 755 -39.6m 1556 -44.1
3 Fe T, K
0 -26.5M 860 -17.1B 1366 -12.0
4 H T, K
0 -3.11550 -8.6
5 Hg T, K
0 -38.7M 530 -20.8B 627 -18.6b 630 -18.5
1460 0.0
6 K T, K
DGo , Kcal/mol
2/3Al + I2 = 2/3AlI3
DGo , Kcal/mol
Be + I2 = BeI2
DGo , Kcal/mol
Fe + I2 = FeI2
DGo , Kcal/mol
2H + I2 = 2HI
DGo , Kcal/mol
Hg + I2 = HgI2
DGo , Kcal/mol
0 -169.1m 336 -156.5M 954 -131.8b 1031 -128.2B 1617 -93.0
7 Li T, K
0 -143.6m 454 -126.2M 742 -113.8B 1415 -95.5
1550 -97.0
8 Na T, K
0 -154.3m 371 -139.0M 933 -113.8b 1156 -109.2B 1577 -83.2
9 Pb T, K
0 -55.9m 601 -35.8M 680 -33.0B 1135 -21.2
1550 -23.9
10 Ti T, K
0 -58.7M 428 -44.8B 650 -40.6
1550 -25.1
11 Zr T, K
0 -71.7m 704 -48.0
1550 -36.6
12
2K + I2 = 2KI
DGo , Kcal/mol
2Li + I2 = 2LiI
DGo , Kcal/mol
2Na + I2 = 2NaI
DGo , Kcal/mol
Pb + I2 = PbI2
DGo , Kcal/mol
1/2Ti + I2 = 1/2TiI4
DGo , Kcal/mol
1/2Zr + I2 = 1/2ZrI4
13 Trans T, KI2 0 13.7m 312 1.5b 627 0.0
14
DGo , Kcal/mol
Nitride DataPart-1 Part-2
1 Fe T, K N T, K
0 -5.8 0237 0.0 441
2 Mo T, K Cr T, K
0 -31.9 01150 0.0 1834
3 Cr T, K V T, K
0 -51.0 0m 1526 0.0 2099
4 Si T, K Mg T, K
0 -90.0 0m 1680 -22.5 m 923
2130 0.0 b 1376
5 Nb T, K Ta T, K
0 -113.4 0600 -86.4 2500
6 B T, K Ca T, K
0 -121.4 0m 2300 -20.8 m 1123
2720 0.0 M 1468b 1765
DGo , Kcal/mol
8Fe + N2 = 2Fe4N 2/3N + N2 = 2/3NH3
DGo , Kcal/mol
4Mo + N2 = 2Mo2N 4Cr + N2 = 2Cr2N
DGo , Kcal/mol
2Cr + N2 = 2CrN 2V + N2 = 2VN
DGo , Kcal/mol
Si + N2 = 1/2Si2N4 3Mg + N2 = Mg3N2
DGo , Kcal/mol
4Nb + N2 = 2Nb2N 2Ta + N2 = 2TaN
DGo , Kcal/mol
2B + N2 = 2BN 3Ca + N2 = Ca3N2
RUN RUN
1860
7 Al T, K Ce T, K
0 -144.3 0m 932 -101.0 m 1077b 2736 -10.8 2500
8 Ti T, K Zr T, K
0 -160.5 0m 1940 -73.4 2128
9
10
11
12
DGo , Kcal/mol
2Al + N2 = 2AlN 2Ce + N2 = 2CeN
DGo , Kcal/mol
2Ti + N2 = 2TiN 2Zr + N2 = 2ZrN
13
14
15
16
17
18
19
1 Al T, K
0 -144.3m 932 -101.0b 2736 -10.8
2 B T, K
0 -121.4m 2300 -20.8
2720 0.0
3 Ca T, K
0 -121.4m 1123 -48.4M 1468 -29.7b 1765 -12.1
1860 0.0
4 Ce T, K
0 -155.8m 1077 -102.2
2500 -24.4
5 Cr T, K
0 -44.01834 0.0
6 Cr T, K
DGo , Kcal/mol
2Al + N2 = 2AlN
DGo , Kcal/mol
2B + N2 = 2BN
DGo , Kcal/mol
3Ca + N2 = Ca3N2
DGo , Kcal/mol
2Ce + N2 = 2CeN
DGo , Kcal/mol
4Cr + N2 = 2Cr2N
DGo , Kcal/mol
0 -51.0m 1526 0.0
7 Fe T, K
0 -5.8237 0.0
8 Mg T, K
0 -109.6m 923 -65.8b 1376 -41.3
9 Mo T, K
0 -31.91150 0.0
10 N T, K
0 -24.1441 0.0
11 Nb T, K
0 -113.4600 -86.4
12 Si T, K
2Cr + N2 = 2CrN
DGo , Kcal/mol
8Fe + N2 = 2Fe4N
DGo , Kcal/mol
3Mg + N2 = Mg3N2
DGo , Kcal/mol
4Mo + N2 = 2Mo2N
DGo , Kcal/mol
2/3N + N2 = 2/3NH3
DGo , Kcal/mol
4Nb + N2 = 2Nb2N
DGo , Kcal/mol
0 -90.0m 1680 -22.5
2130 0.0
13 Ta T, K
0 -115.22500 -18.5
14 Ti T, K
0 -160.5m 1940 -73.4
15 V T, K
0 -83.32099 0.0
16 Zr T, K
0 -163.82128 -67.2
Si + N2 = 1/2Si2N4
DGo , Kcal/mol
2Ta + N2 = 2TaN
DGo , Kcal/mol
2Ti + N2 = 2TiN
DGo , Kcal/mol
2V + N2 = 2VN
DGo , Kcal/mol
2Zr + N2 = 2ZrN
-24.10.0
-44.00.0
-83.30.0
-109.6-65.8-41.3
-115.2-18.5
-121.4-48.4-29.7-12.1
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
0.0
-155.8-102.2
-24.4
-163.8-67.2
DGo , Kcal/mol
DGo , Kcal/mol
Bi T, K
0 -103.6M 1098 -48.5
1400 -33.3
9
-8
Bi T, K
0 0.8M 1098 -8.3
1400 -14.2
Bi T, K
0 -92.0M 1098 -44.0
1400 -31.2b 1852 -12.0
Ce T, K
0 -285.7 -3
m 1077 -237.0 4
Ce T, K
0 -180.91077 -109.4
Ce T, K
0 -259.5m 1077 -205.1
DGo , Kcal/mol
3/2Bi + O2 = 1/2Bi3O4
DGo , Kcal/mol
4Bi3O4+O2 = 6Bi2O3
DGo , Kcal/mol
4/3Bi +O2 = 2/3Bi2O3
DGo , Kcal/mol
4/3Ce +O2 = 2/3Ce2O3
DGo , Kcal/mol
2Ce2O3 + O2 = 4CeO2
DGo , Kcal/mol
Ce + O2 = CeO2
Cr T, K
0 -178.51660 -111.0
m 2176 -90.0b 2495 -77.5M 2603 -75.5
Cr T, K
0 -26.5M 1660 41.0
Cr T, K
0 -140.5M 1660 -73.0
Cu T, K4Cu+O2=2Cu2O 0 -80.0
m 1357 -33.0M 1509 -28.0
16092500 -9.5
Cu T, K2Cu2O+O2=4CuO 0 -69.0
1357 1.01509 3.8
1609 7.1
Cu T, K2Cu+O2=2CuO 0 -74.5
m 1357 -16.01509
M 1609 -9.51870 0.0
DGo , Kcal/mol
4/3Cr +O2 = 2/3Cr2O3
DGo , Kcal/mol
2Cr2O3 + O2 = 4CrO2
DGo , Kcal/mol
Cr + O2 = CrO2
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
Eu T, K
0 -290.4m 1090 -245.0
Eu T, K
0 -199.51090 -136.1
Eu T, K
0 -260.1m 1090 -208.7
Trans T, K TransFe3O4/FeO 0 -130.4 FeO/Fe
m 1809 -62.8 MM 1867 -60.3 m
Trans T, K TransFeO/Fe 0 -142.1 Fe2O3
M 1642 -75.0 mm 1809 -71.9
2000 -67.9
Trans T, K TransFe2O3 0 -129.2 Fe/Fe3O4
m 1809 -55.5mM
DGo , Kcal/mol
2Eu + O2 = 2EuO
DGo , Kcal/mol
4EuO +O2 = 2Eu2O3
DGo , Kcal/mol
4/3Eu +O2 = 2/3Eu2O3
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
Mn T, K
0 -184.0m 1517 -130.0M 2054 -108.0b 2309 -99.0
2500 -89.5
Mn T, K
0 -95.51517 -19.0
Mn T, K
0 -154.5m 1517 -93.0
1620 -88.51120 -109.1
Mn T, K
0 -36.51120 43.3
Mn T, K
0 -125.01120 -71.0
Nb T, K
0 -192.01764 -125.2
M 2218 -108.0m 3043 -77.0
DGo , Kcal/mol
2Mn + O2 = 2MnO
DGo , Kcal/mol
4MnO + O2 = 2Mn2O3
DGo , Kcal/mol
4/3Mn + O2 = 2/3Mn2O3
DGo , Kcal/mol
2Mn2O3 + O2 = 4MnO2
DGo , Kcal/mol
Mn + O2 = MnO2
DGo , Kcal/mol
2Nb + O2 = 2NbO
T, K0 -159.0
M 1764 -85.6
Nb T, K
0 -181.0M 1764 -112.0
Nb T, K
0 -209.0m 1764 -163.3
Nb T, K
0 -188.01764 -124.82218 -108.6
m 3043 -79.0M 3183 -73.9
Tb T, K
0 -295.6m 1638 -224.1
Tb T, K
0 -47.31638 39.5
4NbO + O2 = 2Nb2O3 DGo , Kcal/mol
DGo , Kcal/mol
4/3Nb + O2 = 2/3Nb2O3
DGo , Kcal/mol
2Nb2O3 + O2 = 4NbO2
DGo , Kcal/mol
Nb + O2 = NbO2
DGo , Kcal/mol
4/3Tb + O2 = 2/3Tb2O3
DGo , Kcal/mol
4.762Tb2O3 + O2 = 9.524TbO1.71
Tb T, K
0 -265.2m 1638 -191.8
Ti T, K
0 -247.5m 1940 -161.0M 2033 -159.0
2128 -155.62150 -154.92500 -142.5
Ti T, K
0 -231.01940 -152.0
m 2033 -147.42128 -145.3
M 2150 -144.8
Ti T, K
0 -242.0m 1940 -158.0
2033 -155.12128 -152.2
M 2150 -151.5
Ti T, K
0 -192.01940 -108.02033 -100.2
M 2128 -92.2m 2150 -90.3
Ti T, K
0 -237.0m 1940 -153.0
2033 -149.62128 -146.22150 -145.4
M 2450 -134.52500 -133.0
DGo , Kcal/mol
1.17Tb + O2 = 1.17TbO1.709
DGo , Kcal/mol
2Ti + O2 = 2TiO
DGo , Kcal/mol
4TiO + O2 = 2Ti2O3
DGo , Kcal/mol
4/3Ti + O2 = 2/3Ti2O3
DGo , Kcal/mol
6Ti2O3 + O2 = 4Ti3O5
DGo , Kcal/mol
6/5Ti + O2 = 2/5Ti3O5
Ti T, K
0 -168.01940 -90.0
M 2033 -83.1m 2128 -76.1
2150 -75.52450 -67.02500 -64.0
Ti T, K
0 -225.5m 1940 -142.5
2033 -138.5M 2128 -134.5
2150 -133.72450 -123.22500 -121.5
Tl T, K
0 -69.0M 573 -52.0m 577 -51.0B 773 -43.0
990 -40.11200 -37.4
b 1760 -30.0
Tl T, K
0 -49.5m 573 -13.3
577 -13.5b 773 -5.4M 990 6.6
1200 18.71760 15.0
Tl T, K
0 -56.0573 -26.2
m 577 -26.0773 -17.9
M 990 -9.01200 0.0
V T, K
0 -198.2m 2190 -116.5
2240 -112.4M 2350 -103.5
2500 -95.0
DGo , Kcal/mol
2Ti3O5 + O2 = 6TiO2
DGo , Kcal/mol
Ti + O2 = TiO2
DGo , Kcal/mol
4Tl + O2 = 2Tl2O
DGo , Kcal/mol
Tl2O + O2 = Tl2O3
DGo , Kcal/mol
4/3Ti + O2 = 2/3Tl2O3
DGo , Kcal/mol
2V + O2 = 2VO
V T, K
0 -192.22190 -96.1
M 2240 -100.6
V T, K
0 -196.21818 -124.4
m 2190 -109.7M 2240 -108.5
V T, K
0 -83.41610 -33.3
M 1818 -26.82190 -54.9
m 2240 -48.8
V T, K
0 -168.0943 -132.7
M 1818 -100.0m 2190 -96.0
2240 -93.62500 -81.0
V T, K
0 -75.5M 943 -19.1
1610 -33.3
m 1818 -37.72190 -6.0
V T, K
0 -149.5M 943 -110.0
1818 -87.5m 2190 -78.0
DGo , Kcal/mol
4VO + O2 = 2V2O3
DGo , Kcal/mol
4/3V + O2 = 2/3V2O3
DGo , Kcal/mol
2V2O3 + O2 = 4VO2
DGo , Kcal/mol
V + O2 = VO2
DGo , Kcal/mol
4VO2 + O2 = 2V2O5
DGo , Kcal/mol
4/5V + O2 = 2/5V2O5
Ge T, K
0 -129.0m 1210 -73.0M 1389 -64.0
2500 -19.0
Ge T, K
0 -16.0m 1210 -67.4
2000 -85.3
DGo , Kcal/mol
Ge + O2 = GeO2
DGo , Kcal/mol
2Ge + O2 = 2GeO(g)
Bi O2
12 9 6
-12 -8 -4
Ce O2
-4 -3 -2
4 4 4
4/3Bi +O2 = 2/3Bi2O3
3/2Bi + O2 = 1/2Bi3O4
4Bi3O4+O2 = 6Bi2O3
4/3Ce +O2 = 2/3Ce2O3
Ce + O2 = CeO2
2Ce2O3 + O2 = 4CeO2
same as Ce
T, K0 -142.1 2Fe+O2=2FeO
1642 -75.01809 -71.92000 -67.9
T, K0 -129.2 4/3Fe+O2=2/3Fe2O3 6FeO+O2=2Fe3O4
1809 -55.50 -95.3
T, K0 -130.4 1.5Fe+O2=0.5Fe3O4
1642 -69.01809 -62.81867 -60.3 4Fe3O4+O2=6Fe2O3
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
V T, K
0 -196.2943 -159.0
1818 -124.4m 2190 -109.7M 2240 -108.5
V T, K
1610 -33.3M 1818 -32.3
0 -79.5943 -36.6
m 2190 -30.42240 162.8
V T, K
0 -149.5M 943 -110.0
1818 -87.5m 2190 -78.0
DGo , Kcal/mol
4/3V + O2 = 2/3V2O3
DGo , Kcal/mol
V2O3 + O2 = V2O5
DGo , Kcal/mol
4/5V + O2 = 2/5V2O5
Oxide DataPart-1 Part-2
1 Bi T, K Mn T, K
0 0.8 0M 1098 -8.3 1120
1400 -14.2
2 Ag T, K Cu T, K
0 -14.0 0480 0.0 m 1509
M 1609
3 Pt T, K Cu T, K
0 -32.0 0734 0.0 m 1357
M 15092500
4 Tl T, K Mn T, K
0 -49.5 0m 573 -13.3 1517
577 -13.5b 773 -5.4M 990 6.6
1200 18.71760 15.0
5 Se T, K Ni T, K
0 -54.0 0m 491 -33.0 m 1725M 603 -28.0 M 2257b 952 -27.0 2500
2250 0.0
6 Tl T, K Cd T, K
0 -69.0 0M 573 -52.0 m 594m 577 -51.0 b 1040B 773 -43.0 1800b 1760 -30.0
DGo , Kcal/mol
4Bi3O4+O2 = 6Bi2O3 2Mn2O3 + O2 = 4MnO2
DGo , Kcal/mol
4Ag + O2 = 2Ag2O Cu2O + O2 = 2CuO
DGo , Kcal/mol
3/2Pt + O2 = 1/2Pt3O4 4Cu + O2 = 2Cu2O
DGo , Kcal/mol
Tl2O + O2 = Tl2O3 4MnO + O2 = 2Mn2O3
DGo , Kcal/mol
Se + O2 = SeO2 2Ni + O2 = 2NiO
DGo , Kcal/mol
4Tl + O2 = 2Tl2O 2Cd + O2 = CdO
RUN
2000 0.0
7 S T, K C T, K
0 -86.0 03400 -28.0 3400
8 Bi T, K Nb T, K
0 -103.6 01400 -33.3 M 1764
9 Co T, K Ga T, K
0 -114.2 0m 1768 -41.5 m 303M 2078 -27.0 M 2073
2500 -12.0 b 2676
10 Zn T, K Mn T, K
0 -166.0 0m 693 -134.0 m 1517b 1180 -109.0 M 2054M 2240 -9.0 b 2309
2340 0.0 2500
11 Ce T, K Nb T, K
0 -180.9 01077 -109.4 M 2218
m 3043
12 Ta T, K Nb T, K
0 -196.0 0M 2150 -106.0 m 1764m 3270 -67.0
DGo , Kcal/mol
S + O2 = SO2 2CO + O2 = CO2
DGo , Kcal/mol
3/2Bi + O2 = 1/2Bi3O4 4NbO + O2 = 2Nb2O3
DGo , Kcal/mol
2Co + O2 = 2CoO 4/3Ga +O2 = 2/3Ga2O3
DGo , Kcal/mol
2Zn + O2 = 2ZnO 2Mn + O2 = 2MnO
DGo , Kcal/mol
2Ce2O3 + O2 = 4CeO2 2Nb + O2 = 2NbO
DGo , Kcal/mol
4/5Ta + O2 = 2/5Ta2O5 2Nb2O3 + O2 = 4NbO2
13 Zr T, K U T, K
0 -262.0 0m 2125 -166.0 m 1405M 2980 -130.0 M 3151
14 Ce T, K Ba T, K
0 -285.7 0m 1077 -237.0 m 983
b 1895M 2191
2500
15 Pr T, K Be T, K
0 -289.4 0m 1208 -236.1 m 1556
M 2843
16 Sc T, K Gd T, K
72 -300.0 0m 1811 -220.0 m 1558
17 Y T, K
44m 1773
18
DGo , Kcal/mol
Zr + O2 = ZrO2 U + O2 = UO2
DGo , Kcal/mol
4/3Ce +O2 = 2/3Ce2O3 2Ba + O2 = BaO
DGo , Kcal/mol
4/3Pr + O2 = 2/3Pr2O3 2Be + O2 = BeO
DGo , Kcal/mol
4/3Sc + O2 = 2/3Sc2O3 4/3Gd +O2 = 2/3Gd2O3
4/3Y + O2 = 2/3Y2O3
19
1 Ag T, K
0 -14.0480 0.0
2 Al T, K
0 -266.6m 932 -220.0M 2345 -147.6b 2736 -128.5
3 As T, K
0 -104.0M 585 -79.0B 730 -77.0b 886 -71.0
2500 -16.0
4 B T, K
0 -200.5M 723 -171.5m 2313 -112.0
5 Ba T, K
0 -265.0m 983 -222.0b 1895 -183.0M 2191 -159.0
2500 -131.0
DGo , Kcal/mol
4Ag + O2 = 2Ag2O
DGo , Kcal/mol
4/3Al +O2 = 2/3Al2O3
DGo , Kcal/mol
As +O2 = 1/2As2O4
DGo , Kcal/mol
4/3B +O2 = 2/3B2O3
DGo , Kcal/mol
2Ba + O2 = BaO
6 Be T, K
0 -286.0m 1556 -212.0M 2843 -160.0
7 Bi T, K
0 0.8M 1098 -8.3
1400 -14.2
8 Bi T, K
0 -103.61400 -33.3
9 C T, K
0 -53.43400 -195.9
10 C T, K
0 -94.23400 -95.9
11 C T, K
0 -135.03400 4.7
DGo , Kcal/mol
2Be + O2 = BeO
DGo , Kcal/mol
4Bi3O4+O2 = 6Bi2O3
DGo , Kcal/mol
3/2Bi + O2 = 1/2Bi3O4
DGo , Kcal/mol
2C + O2 = 2CO
DGo , Kcal/mol
C + O2 = CO2
DGo , Kcal/mol
2CO + O2 = CO2
12 Ca T, K
65 -300.0m 1123 -249.0b 1756 -217.0M 2887 -117.0
13 Cd T, K
0 -124.0m 594 -96.0b 1040 -74.0
1800 0.0
14 Ce T, K
0 -285.7m 1077 -237.0
15 Ce T, K
0 -180.91077 -109.4
16 Co T, K
0 -114.2m 1768 -41.5M 2078 -27.0
2500 -12.0
17 Cr T, K
0 -178.5m 2176 -90.0b 2495 -77.5M 2603 -75.5
DGo , Kcal/mol
2Ca + O2 = CaO
DGo , Kcal/mol
2Cd + O2 = CdO
DGo , Kcal/mol
4/3Ce +O2 = 2/3Ce2O3
DGo , Kcal/mol
2Ce2O3 + O2 = 4CeO2
DGo , Kcal/mol
2Co + O2 = 2CoO
DGo , Kcal/mol
4/3Cr +O2 = 2/3Cr2O3
18 Cr T, K
0 -26.5M 1660 41.0
19 Cs T, K
0 -151.8m 302 -125.0M 763 -84.0B 915 -73.0b 955 -72.0
20 Cu T, K
0 -80.0m 1357 -33.0M 1509 -28.0
2500 -9.5
21 Cu T, K
0 -69.0m 1509 3.8M 1609 7.1
22 Dy T, K
0 -269.3m 1680 -220.5
23 Er T, K
0 -260.1m 1770 -208.7
DGo , Kcal/mol
2Cr2O3 + O2 = 4CrO2
DGo , Kcal/mol
4Cs + O2 = 2Cs2O
DGo , Kcal/mol
4Cu + O2 = 2Cu2O
DGo , Kcal/mol
Cu2O + O2 = 2CuO
DGo , Kcal/mol
4/3Dy +O2 = 2/3Dy2O3
DGo , Kcal/mol
4/3Er +O2 = 2/3Er2O3
24 Eu T, K
0 -290.4m 1090 -245.0
25 Eu T, K
0 -199.51090 -136.1
26 Fe T, K
0 -100.01853 2.9
27 Fe T, K
840 -99.0m 1642 -51.2
28 Fe T, K
840 -99.0M 1642 -75.0m 1809 -71.9
2000 -67.9
29 Fe T, K
0 -130.4840 -99.0
DGo , Kcal/mol
2Eu + O2 = 2EuO
DGo , Kcal/mol
4EuO +O2 = 2Eu2O3
DGo , Kcal/mol
4Fe3O4 + O2 = 6Fe2O3
DGo , Kcal/mol
6FeO + O2 = 2Fe3O4
DGo , Kcal/mol
2Fe + O2 = 2FeO
DGo , Kcal/mol
3/2Fe + O2 = 1/2Fe3O4
30 Ga T, K
0 -172.0m 303 -158.0M 2073 -64.0b 2676 -50.0
31 Gd T, K
0 -288.6m 1558 -219.7
32 Ge T, K
0 -129.0m 1210 -73.0M 1389 -64.0
2500 -19.0
33 Ge T, K
0 -16.0m 1210 -67.4
2000 -85.3
34 H T, K
0 -119.33400 -26.9
35 Hf T, K
0 -265.0m 2495 -152.0M 3013 -115.0
DGo , Kcal/mol
4/3Ga +O2 = 2/3Ga2O3
DGo , Kcal/mol
4/3Gd +O2 = 2/3Gd2O3
DGo , Kcal/mol
Ge + O2 = GeO2
DGo , Kcal/mol
2Ge + O2 = 2GeO(g)
DGo , Kcal/mol
2H2 + O2 = 2H2O
DGo , Kcal/mol
Hf + O2 = HfO2
36 Ho T, K
0 -298.5m 1734 -220.8
37 In T, K
0 -148.0m 429 -127.0M 2183 -41.3b 2364 -33.0
38 Ir T, K
0 -43.01090 0.0
39 K T, K
0 -172.0m 336 -151.0M 980 -107.0b 1031 -104.0B 1325 -71.0
2160 0.0
40 La T, K
0 -284.8m 1193 -205.7
41 Li T, K
0 -286.0m 453 -258.0b 1597 -173.0M 2000 -128.0
DGo , Kcal/mol
4/3Ho + O2 = 2/3Ho2O3
DGo , Kcal/mol
4/3In + O2 = 2/3In2O3
DGo , Kcal/mol
2/3Ir + O2 = 2/3IrO3
DGo , Kcal/mol
4K + O2 = 2K2O
DGo , Kcal/mol
4/3La + O2 = 2/3La2O3
DGo , Kcal/mol
4Li + O2 = 2Li2O
42 Lu T, K
0 -298.2m 1925 -210.8
43 Mg T, K
0 -286.0m 923 -240.0b 1376 -214.0M 3125 -52.0
44 Mn T, K
0 -184.0m 1517 -130.0M 2054 -108.0b 2309 -99.0
2500 -89.5
45 Mn T, K
0 -95.51517 -19.0
46 Mn T, K
0 -36.51120 43.3
47 Na T, K
0 -197.0m 371 -176.0b 1156 -122.0M 1193 -119.0B 1600 -62.0
2250 0.0
DGo , Kcal/mol
4/3Lu + O2 = 2/3Lu2O3
DGo , Kcal/mol
2Mg + O2 = 2MgO
DGo , Kcal/mol
2Mn + O2 = 2MnO
DGo , Kcal/mol
4MnO + O2 = 2Mn2O3
DGo , Kcal/mol
2Mn2O3 + O2 = 4MnO2
DGo , Kcal/mol
4Na + O2 = 2Na2O
48 Nb T, K
0 -192.0M 2218 -108.0m 3043 -77.0
49 Nb T, K
0 -159.0M 1764 -85.6
50 Nb T, K
0 -209.0m 1764 -163.3
51 Ni T, K
0 -114.0m 1725 -44.5M 2257 -24.5
2500 -15.0
52 Os T, K
0 -62.0923 -23.0
53 P T, K
0 -142.0M 631 -95.0b 704 -93.0
2500 42.0
DGo , Kcal/mol
2Nb + O2 = 2NbO
DGo , Kcal/mol
4NbO + O2 = 2Nb2O3
DGo , Kcal/mol
2Nb2O3 + O2 = 4NbO2
DGo , Kcal/mol
2Ni + O2 = 2NiO
DGo , Kcal/mol
Os + O2 = OsO2
DGo , Kcal/mol
4/5P + O2 = 2/5P2O5
54 Pb T, K
0 -104.0m 762 -69.0M 1159 -52.0B 1745 -29.0b 2016 -35.0
2500 -24.0
55 Pr T, K
0 -246.9m 1208 -194.6
56 Pr T, K
0 -289.4m 1208 -236.1
57 Pt T, K
0 -32.0734 0.0
58 Pu T, K
0 -258.0m 913 -222.0M 1880 -185.0
2500 -175.0
59 Rb T, K
0 -157.8m 312 -138.0M 910 -96.0b 952 -95.0
DGo , Kcal/mol
2Pb + O2 = 2PbO
DGo , Kcal/mol
PrO1.83
DGo , Kcal/mol
4/3Pr + O2 = 2/3Pr2O3
DGo , Kcal/mol
3/2Pt + O2 = 1/2Pt3O4
DGo , Kcal/mol
4/3Pu + O2 = 2/3Pu2O3
DGo , Kcal/mol
4Rb + O2 = 2Rb2O
60 Rh T, K
0 -42.01050 0.0
61 S T, K
0 -86.03400 -28.0
62 Sb T, K
0 -111.0m 904 -74.0M 928 -73.0B 1698 -45.0b 1908 -32.0
2380 0.0
63 Sc T, K
72 -300.0m 1811 -220.0
64 Se T, K
0 -54.0m 491 -33.0M 603 -28.0b 952 -27.0
2250 0.0
65 Si T, K
0 -216.5m 1685 -145.8M 1696 -145.4
2500 -107.8
DGo , Kcal/mol
4/3Rh + O2 = 2/3Rh2O3
DGo , Kcal/mol
S + O2 = SO2
DGo , Kcal/mol
4/3Sb +O2 = 2/3Sb2O3
DGo , Kcal/mol
4/3Sc + O2 = 2/3Sc2O3
DGo , Kcal/mol
Se + O2 = SeO2
DGo , Kcal/mol
Si + O2 = SiO2
66 Sm T, K
0 -288.7m 1345 -227.1
67 Sn T, K
0 -138.8m 505 -114.0B 2140 -31.0
68 Sr T, K
0 -281.0m 1043 -233.0b 1640 -205.0M 2690 -116.0
69 Ta T, K
0 -196.0M 2150 -106.0m 3270 -67.0
70 Tb T, K
0 -295.6m 1638 -224.1
71 Tb T, K
0 -47.31638 39.5
DGo , Kcal/mol
4/3Sm + O2 = 2/3Sm2O3
DGo , Kcal/mol
Sn + O2 = SnO2
DGo , Kcal/mol
2Sr + O2 = 2SrO
DGo , Kcal/mol
4/5Ta + O2 = 2/5Ta2O5
DGo , Kcal/mol
4/3Tb + O2 = 2/3Tb2O3
DGo , Kcal/mol
4.762Tb2O3 + O2 = 9.524TbO1.709
72 Te T, K
0 -77.0m 723 -46.0M 1006 -33.0b 1267 -2.0
1700 0.0
73 Tb T, K
0 -251.9m 1638 -178.7
74 Th T, K
0 -293.0m 1968 -204.0M 3493 -136.0
75 Ti T, K
0 -247.5m 1940 -161.0M 2033 -159.0
2500 -142.5
76 Ti T, K
0 -231.01940 -152.0
m 2033 -147.42128 -145.3
M 2150 -144.8
77 Ti T, K
0 -192.01940 -108.02033 -100.2
M 2128 -92.2m 2150 -90.3
DGo , Kcal/mol
Te + O2 = TeO2
DGo , Kcal/mol
TbO1.817
DGo , Kcal/mol
Th + O2 = ThO2
DGo , Kcal/mol
2Ti + O2 = 2TiO
DGo , Kcal/mol
4TiO + O2 = 2Ti2O3
DGo , Kcal/mol
6Ti2O3 + O2 = 4Ti3O5
78 Ti T, K
0 -168.01940 -90.0
M 2033 -83.1m 2128 -76.1
2150 -75.52450 -67.02500 -64.0
79 Tl T, K
0 -69.0M 573 -52.0m 577 -51.0B 773 -43.0b 1760 -30.0
2000 0.0
80 Tl T, K
0 -49.5m 573 -13.3
577 -13.5b 773 -5.4M 990 6.6
1200 18.71760 15.0
81 Tm T, K
0 -299.3m 1873 -216.1
82 U T, K
0 -258.0m 1405 -202.0M 3151 -130.0
83 V T, K
0 -198.2m 2190 -116.5M 2350 -103.5
2500 -95.0
DGo , Kcal/mol
2Ti3O5 + O2 = 6TiO2
DGo , Kcal/mol
4Tl + O2 = 2Tl2O
DGo , Kcal/mol
Tl2O + O2 = Tl2O3
DGo , Kcal/mol
4/3Tm + O2 = 2/3Tm2O3
DGo , Kcal/mol
U + O2 = UO2
DGo , Kcal/mol
2V + O2 = 2VO
84 V T, K
0 -192.22190 -96.1
m 2240 -100.6
85 V T, K
0 -83.4M 1610 -33.3
86 V T, K
0 -75.5M 943 -19.1m 1610 -33.3
87 V T, K
1610 -33.3M 1818 -32.3
88 W T, K
0 -133.0M 1743 -67.0B 2100 -57.0
2500 -52.0
89 Y T, K
44 -300.0m 1773 -221.6
DGo , Kcal/mol
4VO + O2 = 2V2O3
DGo , Kcal/mol
2V2O3 + O2 = 4VO2
DGo , Kcal/mol
4VO2 + O2 = 2V2O5
DGo , Kcal/mol
V2O3 + O2 = V2O5
DGo , Kcal/mol
2/3W + O2 = 2/3WO3
DGo , Kcal/mol
4/3Y + O2 = 2/3Y2O3
90 Yb T, K
0 -288.1m 1097 -239.3
91 Zn T, K
0 -166.0m 693 -134.0b 1180 -109.0M 2240 -9.0
2340 0.0
92 Zr T, K
0 -262.0m 2125 -166.0M 2980 -130.0
93
94
95
96
DGo , Kcal/mol
4/3Yb + O2 = 2/3Yb2O3
DGo , Kcal/mol
2Zn + O2 = 2ZnO
DGo , Kcal/mol
Zr + O2 = ZrO2
97
98
99
100
101
102
103
104
Part-3
Rh T, K
-36.5 0 -42.043.3 1050 0.0
Tb T, K
-69.0 0 -47.33.8 1638 39.57.1
As T, K
-80.0 0 -104.0-33.0 M 585 -79.0-28.0 B 730 -77.0-9.5 b 886 -71.0
2500 -16.0
Sb T, K
-95.5 0 -111.0-19.0 m 904 -74.0
M 928 -73.0B 1698 -45.0b 1908 -32.0
2380 0.0
W T, K
-114.0 0 -133.0-44.5 M 1743 -67.0-24.5 B 2100 -57.0-15.0 2500 -52.0
P T, K
-124.0 0 -142.0-96.0 M 631 -95.0-74.0 b 704 -93.00.0 2500 42.0
DGo , Kcal/mol DGo , Kcal/mol
4/3Rh + O2 = 2/3Rh2O3
DGo , Kcal/mol DGo , Kcal/mol
4.762Tb2O3 + O2 = 9.524TbO1.709
DGo , Kcal/mol DGo , Kcal/mol
As +O2 = 1/2As2O4
DGo , Kcal/mol DGo , Kcal/mol
4/3Sb +O2 = 2/3Sb2O3
DGo , Kcal/mol DGo , Kcal/mol
2/3W + O2 = 2/3WO3
DGo , Kcal/mol DGo , Kcal/mol
4/5P + O2 = 2/5P2O5
Cs T, K
-135.0 0 -151.84.7 m 302 -125.0
M 763 -84.0B 915 -73.0b 955 -72.0
Ti T, K
-159.0 0 -168.0-85.6 1940 -90.0
M 2033 -83.1m 2128 -76.1
2150 -75.52450 -67.02500 -64.0
Ti T, K
-172.0 0 -192.0-158.0 1940 -108.0-64.0 2033 -100.2-50.0 M 2128 -92.2
m 2150 -90.3
Ti T, K
-184.0 0 -231.0-130.0 1940 -152.0-108.0 m 2033 -147.4-99.0 2128 -145.3-89.5 M 2150 -144.8
Ti T, K
-192.0 0 -247.5-108.0 m 1940 -161.0-77.0 M 2033 -159.0
2500 -142.5
Er T, K
-209.0 0 -260.1-163.3 m 1770 -208.7
DGo , Kcal/mol DGo , Kcal/mol
4Cs + O2 = 2Cs2O
DGo , Kcal/mol DGo , Kcal/mol
2Ti3O5 + O2 = 6TiO2
DGo , Kcal/mol DGo , Kcal/mol
6Ti2O3 + O2 = 4Ti3O5
DGo , Kcal/mol DGo , Kcal/mol
4TiO + O2 = 2Ti2O3
DGo , Kcal/mol DGo , Kcal/mol
2Ti + O2 = 2TiO
DGo , Kcal/mol DGo , Kcal/mol
4/3Er +O2 = 2/3Er2O3
Dy T, K
-258.0 0 -269.3-202.0 m 1680 -220.5-130.0
Li T, K
-265.0 0 -286.0-222.0 m 453 -258.0-183.0 b 1597 -173.0-159.0 M 2000 -128.0-131.0
Th T, K
-286.0 0 -293.0-212.0 m 1968 -204.0-160.0 M 3493 -136.0
Ca T, K
-288.6 65 -300.0-219.7 m 1123 -249.0
b 1756 -217.0M 2887 -117.0
-300.0-221.6
DGo , Kcal/mol DGo , Kcal/mol
4/3Dy +O2 = 2/3Dy2O3
DGo , Kcal/mol DGo , Kcal/mol
4Li + O2 = 2Li2O
DGo , Kcal/mol DGo , Kcal/mol
Th + O2 = ThO2
DGo , Kcal/mol DGo , Kcal/mol
2Ca + O2 = CaO
DGo , Kcal/mol
Part-4 Part-5
V T, K Ir T, K
1610 -33.3 0M 1818 -32.3 1090
C T, K Os T, K
0 -53.4 03400 -195.9 923
V T, K Te T, K
0 -75.5 0M 943 -19.1 m 723m 1610 -33.3 M 1006
b 12671700
V T, K Pb T, K
0 -83.4 0M 1610 -33.3 m 762
M 1159B 1745b 2016
2500
C T, K Ge T, K
0 -94.2 03400 -95.9 m 1210
M 13892500
Fe T, K Ge T, K
840 -99.0 0m 1642 -51.2 m 1210
2000
DGo , Kcal/mol
V2O3 + O2 = V2O5 2/3Ir + O2 = 2/3IrO3
DGo , Kcal/mol
2C + O2 = 2CO Os + O2 = OsO2
DGo , Kcal/mol
4VO2 + O2 = 2V2O5 Te + O2 = TeO2
DGo , Kcal/mol
2V2O3 + O2 = 4VO2 2Pb + O2 = 2PbO
DGo , Kcal/mol
C + O2 = CO2 Ge + O2 = GeO2
DGo , Kcal/mol
6FeO + O2 = 2Fe3O4 2Ge + O2 = 2GeO(g)
RUN
Fe T, K Sn T, K
840 -99.0 0M 1642 -75.0 m 505m 1809 -71.9 B 2140
2000 -67.9
Fe T, K Rb T, K
0 -100.0 01853 2.9 m 312
M 910b 952
Fe T, K Eu T, K
0 -130.4 0840 -99.0 1090
H T, K Pr T, K
0 -119.3 03400 -26.9 m 1208
V T, K Pu T, K
0 -192.2 02190 -96.1 m 913
m 2240 -100.6 M 18802500
V T, K Al T, K
0 -198.2 0m 2190 -116.5 m 932M 2350 -103.5 M 2345
2500 -95.0 b 2736
DGo , Kcal/mol
2Fe + O2 = 2FeO Sn + O2 = SnO2
DGo , Kcal/mol
4Fe3O4 + O2 = 6Fe2O3 4Rb + O2 = 2Rb2O
DGo , Kcal/mol
3/2Fe + O2 = 1/2Fe3O4 4EuO +O2 = 2Eu2O3
DGo , Kcal/mol
2H2 + O2 = 2H2O 1.09Pr + O2 = PrO1.83
DGo , Kcal/mol
4VO + O2 = 2V2O3 4/3Pu + O2 = 2/3Pu2O3
DGo , Kcal/mol
2V + O2 = 2VO 4/3Al +O2 = 2/3Al2O3
Tb T, K La T, K
0 -251.9 0m 1638 -178.7 m 1193
Sr T, K Eu T, K
0 -281.0 0m 1043 -233.0 m 1090b 1640 -205.0M 2690 -116.0
Mg T, K Lu T, K
0 -286.0 0m 923 -240.0 m 1925b 1376 -214.0M 3125 -52.0
Tb T, K
0 -295.6m 1638 -224.1
DGo , Kcal/mol
1.17Tb + O2 = 1.17TbO1.709 4/3La + O2 = 2/3La2O3
DGo , Kcal/mol
2Sr + O2 = 2SrO 2Eu + O2 = 2EuO
DGo , Kcal/mol
2Mg + O2 = 2MgO 4/3Lu + O2 = 2/3Lu2O3
DGo , Kcal/mol
4/3Tb + O2 = 2/3Tb2O3
Part-6 Part-7
Cr T, K In T, K
-43.0 0 -26.5 00.0 M 1660 41.0 m 429
M 2183b 2364
Cr T, K K T, K
-62.0 0 -178.5 0-23.0 m 2176 -90.0 m 336
b 2495 -77.5 M 980M 2603 -75.5 b 1031
B 13252160
Na T, K B T, K
-77.0 0 -197.0 0-46.0 m 371 -176.0 M 723-33.0 b 1156 -122.0 m 2313-2.0 M 1193 -119.00.0 B 1600 -62.0
2250 0.0
Hf T, K Si T, K
-104.0 0 -265.0 0-69.0 m 2495 -152.0 m 1685-52.0 M 3013 -115.0 M 1696-29.0 2500-35.0-24.0
Yb T, K Sm T, K
-129.0 0 -288.1 0-73.0 m 1097 -239.3 m 1345-64.0-19.0
Ho T, K Tm T, K
-16.0 0 -298.5 0-67.4 m 1734 -220.8 m 1873-85.3
DGo , Kcal/mol DGo , Kcal/mol
2Cr2O3 + O2 = 4CrO2 4/3In + O2 = 2/3In2O3
DGo , Kcal/mol DGo , Kcal/mol
4/3Cr +O2 = 2/3Cr2O3 4K + O2 = 2K2O
DGo , Kcal/mol DGo , Kcal/mol
4Na + O2 = 2Na2O 4/3B +O2 = 2/3B2O3
DGo , Kcal/mol DGo , Kcal/mol
Hf + O2 = HfO2 Si + O2 = SiO2
DGo , Kcal/mol DGo , Kcal/mol
4/3Yb + O2 = 2/3Yb2O3 4/3Sm + O2 = 2/3Sm2O3
DGo , Kcal/mol DGo , Kcal/mol
4/3Ho + O2 = 2/3Ho2O3 4/3Tm + O2 = 2/3Tm2O3
RUN
-138.8-114.0-31.0
-157.8-138.0-96.0-95.0
-199.5-136.1
-246.9-194.6
-258.0-222.0-185.0-175.0
-266.6-220.0-147.6-128.5
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
-284.8-205.7
-290.4-245.0
-298.2-210.8
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
-148.0-127.0-41.3-33.0
-172.0-151.0-107.0-104.0-71.00.0
-200.5-171.5-112.0
-216.5-145.8-145.4-107.8
-288.7-227.1
-299.3-216.1
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
RUN
Selenide DataPart-1
1 Cu T, K
0 -18.9x 490 -23.4X 952 -25.2
2 Ag T, K
0 -20.6x 490 -25.8X 952 -28.3M 1153 -23.4
1200 -22.3
3 Hg T, K
0 -25.1x 490 -22.5b 630 -21.2X 952 -3.0M 1072 7.1
1200 16.5
4 Sn T, K
0 -32.8x 490 -32.9m 505 -32.8X 952 -27.5M 1133 -20.1B 1506 -9.1
1700 -14.0
5 Pb T, K
0 -36.0x 490 -34.9m 601 -34.1X 952 -30.1M 1349 -14.0B 1531 -8.8
1700 -14.1
6 Ge T, K
0 -39.4x 490 -40.6X 952 -39.4B 1195 -30.7
DGo , Kcal/mol
2Cu + Se2 = 2CuSe
DGo , Kcal/mol
4Ag + Se2 = 2Ag2Se
DGo , Kcal/mol
2Hg + Se2 = 2HgSe
DGo , Kcal/mol
2Sn + Se2 = 2SnSe
DGo , Kcal/mol
2Pb + Se2 = 2PbSe
DGo , Kcal/mol
2Ge + Se2 = 2GeSe
RUN
m 1213 -31.51500 -38.0
7 Mn T, K
0 -56.0x 490 -59.8X 952 -61.0
1200 -54.4
8 Cd T, K
0 -71.3x 490 -68.2m 594 -67.0X 952 -61.1B 1038 -57.2M 1541 -11.2
1680 1.4
9 Zn T, K
0 -84.0x 490 -82.1m 693 -80.2X 952 -76.5b 1184 -66.4M 1803 -10.3
1935 0.010
11
12
DGo , Kcal/mol
2Mn + Se2 = 2MnSe
DGo , Kcal/mol
2Cd + Se2 = 2CdSe
DGo , Kcal/mol
2Zn + Se2 = 2ZnSe
13
14
15
16
17
18
19
1 Ag T, K
0 -20.6x 490 -25.8X 952 -28.3M 1153 -23.4
1200 -22.3
2 Cd T, K
0 -71.3x 490 -68.2m 594 -67.0X 952 -61.1B 1038 -57.2M 1541 -11.2
1680 1.4
3 Cu T, K
0 -18.9x 490 -23.4X 952 -25.2
4 Ge T, K
0 -39.4x 490 -40.6X 952 -39.4B 1195 -30.7m 1213 -31.5
1500 -38.0
5 Hg T, K
0 -25.1x 490 -22.5b 630 -21.2X 952 -3.0M 1072 7.1
1200 16.5
DGo , Kcal/mol
4Ag + Se2 = 2Ag2Se
DGo , Kcal/mol
2Cd + Se2 = 2CdSe
DGo , Kcal/mol
2Cu + Se2 = 2CuSe
DGo , Kcal/mol
2Ge + Se2 = 2GeSe
DGo , Kcal/mol
2Hg + Se2 = 2HgSe
6 Mn T, K
0 -56.0x 490 -59.8X 952 -61.0
1200 -54.4
7 Pb T, K
0 -36.0x 490 -34.9m 601 -34.1X 952 -30.1M 1349 -14.0B 1531 -8.8
1700 -14.1
8 Sn T, K
0 -32.8x 490 -32.9m 505 -32.8X 952 -27.5M 1133 -20.1B 1506 -9.1
1700 -14.0
9 Zn T, K
0 -84.0x 490 -82.1m 693 -80.2X 952 -76.5b 1184 -66.4M 1803 -10.3
1935 0.010
DGo , Kcal/mol
2Mn + Se2 = 2MnSe
DGo , Kcal/mol
2Pb + Se2 = 2PbSe
DGo , Kcal/mol
2Sn + Se2 = 2SnSe
DGo , Kcal/mol
2Zn + Se2 = 2ZnSe
Sulfide DataPart-1 Part-2
1 C T, K Fe T, K
1929 0.0 0 -13.62500 -24.0 969 36.5
2 C T, K Cu T, K
0 -3.1 0 -54.02500 -7.4 900 -23.1
3 H T, K Fe T, K
0 -43.1 0 -72.81826 0.0 M 1468 -17.8
m 1809 -15.7
4 S T, K Co T, K
0 -49.0 0 -79.22500 -55.2 1048 -37.5
5 Ni T, K Mo T, K
0 -78.4 0 -86.6800 -48.0 1780 0.0
6 Sn T, K Cd T, K
0 -81.0 0 -105.0m 505 -61.8 m 594 -79.3M 1154 -33.2 b 1038 -58.0B 1490 -22.2 M 1683 2.8
DGo , Kcal/mol DGo , Kcal/mol
2C + S2 = 2CS 2FeS + S2 = 2FeS2
DGo , Kcal/mol DGo , Kcal/mol
C + S2 = CS2 2Cu + S2 = 2CuS
DGo , Kcal/mol DGo , Kcal/mol
2H2 + S2 = 2H2S 2Fe + S2 = 2FeS
DGo , Kcal/mol DGo , Kcal/mol
O2 + S2 = 2SO 9/4Co + S2 = 1/4Co9S8
DGo , Kcal/mol DGo , Kcal/mol
3Ni + S2 = Ni3S2 Mo + S2 = MoS2
DGo , Kcal/mol DGo , Kcal/mol
2Sn + S2 = 2SnS 2Cd + S2 = 2CdS
RUN
2000 -37.0
7 Zn T, K Mg T, K
0 -116.6 0 -199.3m 693 -89.9 m 923 -156.2b 1184 -68.4 b 1380 -134.1M 1993 4.7 2000 -73.7
8 Ce T, K
0 -267.0m 1077 -223.9M 2723 -158.0
9
10
11
12
DGo , Kcal/mol DGo , Kcal/mol
2Zn + S2 = 2ZnS 2Mg + S2 = 2MgS
DGo , Kcal/mol
2Ce + S2 = 2CeS
13
14
15
16
17
18
19
1 Ag T, K
0 -44.8M 1115 -23.6m 1235 -21.7
1500 -15.3
2 Al T, K
0 -133.9m 933 -93.3M 1373 -73.9
2000 -52.3
3 C T, K
1929 0.02500 -24.0
4 C T, K
0 -3.12500 -7.4
5 Cd T, K
0 -105.0m 594 -79.3b 1038 -58.0M 1683 2.8
6 Ce T, K
DGo , Kcal/mol
4Ag + S2 = 2Ag2S
DGo , Kcal/mol
4/3Al + S2 = 2/3Al2S3
DGo , Kcal/mol
2C + S2 = 2CS
DGo , Kcal/mol
C + S2 = CS2
DGo , Kcal/mol
2Cd + S2 = 2CdS
DGo , Kcal/mol
0 -267.0m 1077 -223.9M 2723 -158.0
7 Cu T, K
0 -62.7m 1356 -42.9
8 Cu T, K
0 -54.0900 -23.1
9 Fe T, K
0 0.0969 0.0
10 Fe T, K
0 -72.8M 1468 -17.8m 1809 -15.7
11 Ga T, K
0 -258.9m 673 -228.2M 1124 -207.5b 1760 -175.8
2500 -108.1
12 Ge T, K
2Ce + S2 = 2CeS
DGo , Kcal/mol
4Cu + S2 = 2Cu2S
DGo , Kcal/mol
2Cu + S2 = 2CuS
DGo , Kcal/mol
2FeS + S2 = 2FeS2
DGo , Kcal/mol
2Fe + S2 = 2FeS
DGo , Kcal/mol
2Ga + S2 = 2GaS
DGo , Kcal/mol
0 -73.6M 898 -43.9B 1050 -40.8m 1213 -51.7
1500 -61.6
13 H T, K
0 -43.11826 0.0
14 Ir T, K
0 -64.51600 -7.0
15 Mg T, K
0 -199.3m 923 -156.2b 1380 -134.1
2000 -73.7
16 Mn T, K
0 -128.0m 1517 -80.7M 1803 -70.0
2000 -63.9
17 Mo T, K
0 -86.61780 0.0
18 Na T, K
2Ge + S2 = 2GeS
DGo , Kcal/mol
2H2 + S2 = 2H2S
DGo , Kcal/mol
4/3Ir + S2 = 2/3Ir2S3
DGo , Kcal/mol
2Mg + S2 = 2MgS
DGo , Kcal/mol
2Mn + S2 = 2MnS
DGo , Kcal/mol
Mo + S2 = MoS2
DGo , Kcal/mol
0 -208.0m 371 -187.1b 1156 -137.7M 1192 -135.1
1800 -78.5
19 Ni T, K
0 -78.4800 -48.0
20 Pb T, K
0 -75.8m 600 -53.2M 1392 -20.2B 1560 -15.3
2000 -29.6
21 Pt T, K
0 -43.71000 0.0
22 S T, K
0 -173.21669 0.0
23 S T, K
0 -218.42500 -25.0
24 Si T, K
4Na + S2 = 2Na2S
DGo , Kcal/mol
3Ni + S2 = Ni3S2
DGo , Kcal/mol
2Pb + S2 = 2PbS
DGo , Kcal/mol
2Pt + S2 = 2PtS
DGo , Kcal/mol
S + S2 = SO2
DGo , Kcal/mol
2/3S + S2 = 2/3SO3
DGo , Kcal/mol
0 -79.8M 1363 -31.4B 1403 -30.3
25 Sn T, K
0 -81.0m 505 -61.8M 1154 -33.2B 1490 -22.2
2000 -37.0
26 Co T, K
0 -79.21048 -37.5
27 S T, KSO 0 -49.0
2500 -55.2
28 W T, K
0 -79.21400 -19.7
29 Zn T, K
0 -116.6m 693 -89.9b 1184 -68.4M 1993 4.7
Si + S2 = SiS2
DGo , Kcal/mol
2Sn + S2 = 2SnS
DGo , Kcal/mol
Co9S8
DGo , Kcal/mol
DGo , Kcal/mol
W + S2 = WS2
DGo , Kcal/mol
2Zn + S2 = 2ZnS
Part-3 Part-4
Pt T, K Ag T, K
0 -43.7 0 -44.81000 0.0 M 1115 -23.6
m 1235 -21.71500 -15.3
Cu T, K Ir T, K
0 -62.7 0 -64.5m 1356 -42.9 1600 -7.0
Ge T, K Pb T, K
0 -73.6 0 -75.8M 898 -43.9 m 600 -53.2B 1050 -40.8 M 1392 -20.2m 1213 -51.7 B 1560 -15.3
1500 -61.6 2000 -29.6
W T, K Si T, K
0 -79.2 0 -79.81400 -19.7 M 1363 -31.4
B 1403 -30.3
Mn T, K Al T, K
0 -128.0 0 -133.9m 1517 -80.7 m 933 -93.3M 1803 -70.0 M 1373 -73.9
2000 -63.9 2000 -52.3
Na T, K S T, K
0 -208.0 0 -173.2m 371 -187.1 1669 0.0b 1156 -137.7M 1192 -135.1
DGo , Kcal/mol DGo , Kcal/mol
2Pt + S2 = 2PtS 4Ag + S2 = 2Ag2S
DGo , Kcal/mol DGo , Kcal/mol
4Cu + S2 = 2Cu2S 4/3Ir + S2 = 2/3Ir2S3
DGo , Kcal/mol DGo , Kcal/mol
2Ge + S2 = 2GeS 2Pb + S2 = 2PbS
DGo , Kcal/mol DGo , Kcal/mol
W + S2 = WS2 Si + S2 = SiS2
DGo , Kcal/mol DGo , Kcal/mol
2Mn + S2 = 2MnS 4/3Al + S2 = 2/3Al2S3
DGo , Kcal/mol DGo , Kcal/mol
4Na + S2 = 2Na2S 2O2 + S2 = 2SO2
RUN
1800 -78.5
S T, K Ga T, K
0 -218.4 0 -258.92500 -25.0 m 673 -228.2
M 1124 -207.5b 1760 -175.8
2500 -108.1
DGo , Kcal/mol DGo , Kcal/mol
2/3S + S2 = 2/3SO3 2Ga + S2 = 2GaS
RUN
Fe T, K
0 -72.8969 -36.5
M 1468 -17.8m 1809 -15.7
Fe T, K
0 -13.6969 36.5
Fe T, K
0 -43.2969 0.0
DGo , Kcal/mol
2Fe + S2 = 2FeS
DGo , Kcal/mol
2FeS + S2 = 2FeS2
DGo , Kcal/mol
Fe + S2 = FeS2
Telluride DataPart-1 Part-2
1 Sb T, K Bi T, K
0 -9.0 0x 723 -10.9 m 544m 893 -8.5 x 723X 1271 -8.6 M 860
1600 6.3 X 12711600
2 Ag T, K Ge T, K
0 -14.0 0x 723 -18.6 x 723M 1230 -15.9 M 998m 1233 -16.0 m 1213X 1271 -15.9 B 1215
1600 -12.2 X 12711700
3 Hg T, K Sn T, K
0 -21.7 0b 630 -15.8 m 505x 723 -10.7 x 723M 943 3.6 M 1063X 1271 21.2 X 1271
B 15301700
4 Pb T, K Mn T, K
0 -33.2 0m 601 -31.9 x 723x 723 -31.2 X 1271M 1190 -23.0 m 1517X 1271 -22.5 1800B 1464 -17.6
1700 -17.9
5 Cd T, K Zn T, K
0 -52.4 0m 594 -48.3 m 693x 723 -46.8 x 723b 1038 -39.4 b 1184X 1271 -23.2 X 1271M 1378 -13.6 M 1576
1700 11.4 1700
6 Ca T, K
0 -130.0x 723 -126.3m 1116 -119.7X 1271 -116.6
DGo , Kcal/mol
4/3Sb + Te2 = 2/3Sb2Te3 4/3Bi + Te2 = 2/3Bi2Te3
DGo , Kcal/mol
4Ag + Te2 = 2Ag2Te 2Ge + Te2 = 2GeTe
DGo , Kcal/mol
2Hg + Te2 = 2HgTe 2Sn + Te2 = 2SnTe
DGo , Kcal/mol
2Pb + Te2 = 2PbTe 2Mn + Te2 = 2MnTe
DGo , Kcal/mol
2Cd + Te2 = 2CdTe 2Zn + Te2 = 2ZnTe
DGo , Kcal/mol
2Ca + Te2 = 2CaTe
RUN
b 1756 -97.22000 -77.4
7
8
9
10
11
12
13
14
15
16
17
18
19
1 Ag T, K
0 -14.0x 723 -18.6M 1230 -15.9m 1233 -16.0X 1271 -15.9
1600 -12.2
2 Bi T, K
0 -12.5m 544 -13.2x 723 -12.3M 860 -10.0X 1271 -7.3
1600 1.4
3 Ca T, K
0 -130.0x 723 -126.3m 1116 -119.7X 1271 -116.6b 1756 -97.2
2000 -77.4
4 Cd T, K
0 -52.4m 594 -48.3x 723 -46.8b 1038 -39.4X 1271 -23.2M 1378 -13.6
1700 11.4
5 Ge T, K
0 -16.0x 723 -15.3M 998 -11.6m 1213 -11.4B 1215 -11.4X 1271 -14.4
1700 -28.1
6 Hg T, K
DGo , Kcal/mol
4Ag + Te2 = 2Ag2Te
DGo , Kcal/mol
4/3Bi + Te2 = 2/3Bi2Te3
DGo , Kcal/mol
2Ca + Te2 = 2CaTe
DGo , Kcal/mol
2Cd + Te2 = 2CdTe
DGo , Kcal/mol
2Ge + Te2 = 2GeTe
DGo , Kcal/mol
0 -21.7b 630 -15.8x 723 -10.7M 943 3.6X 1271 21.2
7 Mn T, K
0 -45.0x 723 -49.2X 1271 -46.2m 1517 -39.9
1800 -31.5
8 Pb T, K
0 -33.2m 601 -31.9x 723 -31.2M 1190 -23.0X 1271 -22.5B 1464 -17.6
1700 -17.9
9 Sb T, K
0 -9.0x 723 -10.9m 893 -8.5X 1271 -8.6
1600 6.3
10 Sn T, K
0 -28.4m 505 -28.4x 723 -26.9M 1063 -20.7X 1271 -19.3
B 1530 -12.61700 -12.7
11 Zn T, K
0 -60.9m 693 -54.3x 723 -54.0b 1184 -42.1X 1271 -35.5M 1576 -7.4
1700 2.5
2Hg + Te2 = 2HgTe
DGo , Kcal/mol
2Mn + Te2 = 2MnTe
DGo , Kcal/mol
2Pb + Te2 = 2PbTe
DGo , Kcal/mol
4/3Sb + Te2 = 2/3Sb2Te3
DGo , Kcal/mol
2Sn + Te2 = 2SnTe
DGo , Kcal/mol
2Zn + Te2 = 2ZnTe
-12.5-13.2-12.3-10.0
-7.31.4
-16.0-15.3-11.6-11.4-11.4-14.4-28.1
-28.4-28.4-26.9-20.7-19.3-12.6-12.7
-45.0-49.2-46.2-39.9-31.5
-60.9-54.3-54.0-42.1-35.5
-7.42.5
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
DGo , Kcal/mol
RUNRUN
RUN
Log_PC2 T DG_at_2400 Log_PC2 T DG_at_24000 2400 0.0 0 2400 0.0
-1 2400 -11.0 1 2400 11.0-2 2400 -22.0 2 2400 22.0-4 2400 -43.9 4 2400 43.9-6 2400 -65.9 6 2400 65.9-8 2400 -87.9 8 2400 87.9
-10 2400 -109.8 10 2400 109.8-15 2400 -164.7 15 2400 164.7-20 2400 -219.7 20 2400 219.7-25 2400 -274.6 25 2400 274.6-30 2185 -300.0 30 2400 329.5-35 1873 -300.0 35 2400 384.4-40 1639 -300.0 40 2400 439.3-45 1457 -300.0 45 2400 494.2-50 1311 -300.0 50 2400 549.1-55 1192 -300.0 55 2400 604.0-60 1093 -300.0 60 2400 659.0-65 1009 -300.0 65 2400 713.9-70 937 -300.0 70 2400 768.8-75 874 -300.0 75 2400 823.7-80 819 -300.0 80 2400 878.6
