Free Gibbs Eenergy calculations for the reacion of alpha alumina with different elements

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Free Gibbs Energy calculations for the reacion of alpha Alumina with different elements Prepared by Younes Sina Name Formula Tmax (K) ΔGf@ 298K (kJ/mol) ΔGf @Tmax (kJ/mol) ΔGr @298.15 ΔGr @T (kJ/mol) yttrium oxide Y2O3 298.15 -1816.6 -1816.6 -234.253011 -234.253011 ytterbium (III) oxide Yb2O3 298.15 -1726.7 -1726.7 -144.353011 -144.353011 zinc oxide ZnO 473.15 -320.5150931 -302.9763905 620.8017097 618.0708285 zirconium (IV) oxide ZrO2 1500 -1039.753049 -817.373307 45.434831 10.4 thallium (I) oxide Tl2O 298.15 -147.3 -147.3 1140.446989 1140.446989 thulium oxide Tm2O3 298.15 -1794.5 -1794.5 -212.153011 -212.153011 uranium (IV) oxide UO2 942 -1031.826765 -921.9003816 69.213683 -1.6 uranium (VI) oxide UO3 942 -1145.739293 -982.6217668 436.607696 399.4 triuranium heptaoxide U3O7 298.15 -3242.9 -3242.9 1347.728923 1347.728923 uranium (v,vi) oxide U3O8 298.15 -3369.5 -3369.5 2550.275912 2550.275912 uranium (iv,v) oxide U4O9 298.15 -4275.1 -4275.1 471.940967 471.940967 vanadium (II) oxide VO 1500 -404.3159023 -308.0405491 369.3992821 332.5 vanadium (III) oxide V2O3 1500 -1139.606957 -851.381471 442.740032 402.9 vanadium dioxide V2O4 1500 -1319.581684 -917.3167857 2370.642904 2236 vanadium (V) oxide V2O5 943 -1421.150289 -1150.649619 3648.284078 3458 trivanadium pentaoxide V3O5 298.15 -1803 -1803 2502.734945 2502.734945 tungsten (IV) oxide WO2 1500 -533.8840918 -323.9778349 1563.041703 1509.8 tungsten (VI) oxide WO3 1500 -764.0966708 -467.9824964 818.2503182 781.1 strontium oxide SrO 1500 -561.4174122 -446.854051 - 101.9052476 43.437847 tantalum (V) oxide Ta2O5 1500 -1911.071905 -1407.632918 2178.51923 2012 terbium (iii,iv) oxide Tb4O7 298.15 -3531.296 -3531.296 482.540923 482.540923 technetium trioxide TcO3 298.15 -461.0768 -461.0768 1121.270189 1121.270189 tellurium dioxide TeO2 298.15 -270.3 -270.3 2353.793978 2353.793978 thorium (IV) oxide ThO2 298.15 -1169.2 -1169.2 -342.906022 -342.906022

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Free Gibbs Energy calculations for the reacion of alpha Alumina with different elements Prepared by Younes Sina

Transcript of Free Gibbs Eenergy calculations for the reacion of alpha alumina with different elements

Page 1: Free Gibbs Eenergy calculations for the reacion of alpha alumina with different elements

Free Gibbs Energy calculations for the reacion of alpha Alumina with different elements

Prepared by Younes Sina

Name Formula

Tmax (K) ΔGf@ 298K (kJ/mol) ΔGf @Tmax (kJ/mol)

ΔGr @298.15

ΔGr @T (kJ/mol)

yttrium oxide Y2O3 298.15 -1816.6 -1816.6

-234.253011 -234.253011

ytterbium (III) oxide Yb2O3 298.15 -1726.7 -1726.7

-144.353011 -144.353011

zinc oxide ZnO 473.15 -320.5150931 -302.9763905

620.8017097 618.0708285

zirconium (IV) oxide ZrO2 1500 -1039.753049 -817.373307

45.434831 10.4

thallium (I) oxide Tl2O 298.15 -147.3 -147.3

1140.446989 1140.446989

thulium oxide Tm2O3 298.15 -1794.5 -1794.5

-212.153011 -212.153011

uranium (IV) oxide UO2 942 -1031.826765 -921.9003816

69.213683 -1.6

uranium (VI) oxide UO3 942 -1145.739293 -982.6217668

436.607696 399.4

triuranium heptaoxide U3O7 298.15 -3242.9 -3242.9

1347.728923 1347.728923

uranium (v,vi) oxide U3O8 298.15 -3369.5 -3369.5

2550.275912 2550.275912

uranium (iv,v) oxide U4O9 298.15 -4275.1 -4275.1

471.940967 471.940967

vanadium (II) oxide VO 1500 -404.3159023 -308.0405491

369.3992821 332.5

vanadium (III) oxide V2O3 1500 -1139.606957 -851.381471

442.740032 402.9

vanadium dioxide V2O4 1500 -1319.581684 -917.3167857

2370.642904 2236

vanadium (V) oxide V2O5 943 -1421.150289 -1150.649619

3648.284078 3458

trivanadium pentaoxide V3O5 298.15 -1803 -1803

2502.734945 2502.734945

tungsten (IV) oxide WO2 1500 -533.8840918 -323.9778349

1563.041703 1509.8

tungsten (VI) oxide WO3 1500 -764.0966708 -467.9824964

818.2503182 781.1

strontium oxide SrO 1500 -561.4174122 -446.854051

-101.9052476 43.437847

tantalum (V) oxide Ta2O5 1500 -1911.071905 -1407.632918

2178.51923 2012

terbium (iii,iv) oxide Tb4O7 298.15 -3531.296 -3531.296

482.540923 482.540923

technetium trioxide TcO3 298.15 -461.0768 -461.0768

1121.270189 1121.270189

tellurium dioxide TeO2 298.15 -270.3 -270.3

2353.793978 2353.793978

thorium (IV) oxide ThO2 298.15 -1169.2 -1169.2

-342.906022 -342.906022

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titanium (II) oxide TiO 1500 -513.2927847 -403.0930498

42.4686349 -940.4

titanium (IV) oxide TiO2 500 -883.2939001 -845.9186971

514.8122777 500.2439087

rutile TiO2 1500 -889.4338422 -676.4762762

496.3924514 443.6

titanium (III) oxide Ti2O3 1500 -1433.872798 -1110.103826

148.474191 128

titanium (iii,iv) oxide Ti3O5 1500 -2317.364367 -1783.00366

959.641844 839

rhenium (VI) oxide ReO3 298.15 -532.6232 -532.6232

1049.723789 1049.723789

rhenium heptoxide Re2O7 298.15 -1066 -1066

7878.428923 7878.428923

ruthenium (VIII) oxide RuO4 298.15 -152.2 -152.2

5872.787956 5872.787956

sulfur trioxide SO3 298.15 -374.2 -374.2

1208.146989 1208.146989

antimony (III,V) oxide Sb2O4 298.15 -795.7968 -795.7968

3941.997556 3941.997556

antimony (V) oxide Sb2O5 298.15 -829.2 -829.2

5424.134945 5424.134945

scandium oxide Sc2O3 298.15 -1819.4 -1819.4

-237.053011 -237.053011

silicon dioxide (alpha quartz) SiO2 847 -856.4703764 -764.6555254

595.2828488 528.0334238

silicon dioxide (cristobalite) SiO2 1500 -854.5360861 -679.6213528

601.0857197 506.3

samarium (III) oxide Sm2O3 298.15 -1734.6 -1734.6

-152.253011 -152.253011

tin (II) oxide SnO 505.118 -251.9144896 -232.2959321

826.6035202 820.1122037

tin (IV) oxide SnO2 505.118 -515.8310916 -472.9934253

1617.200703 1615.019724

lead oxide PbO 500 -189.2981566 -169.2722151

1014.452519 1011.183355

lead (II) oxide (litharge) PbO 298.15 -188.9 -188.9

1015.646989 1015.646989

lead (IV) oxide PbO2 500 -215.42672 -175.9342441

2518.413818 2510.197268

promethium (III) oxide Pm2O3 298.15 -861.904 -861.904

720.442989 720.442989

manganese (ii,iii) oxide Mn3O4 298.15 -1283.2 -1283.2

2479.787956 2479.787956

molybdenum (IV) oxide MoO2 1500 -532.0390938 -323.0720331

1568.576697 1514.9

molybdenum oxide MoO3 1074 -668.1177849 -475.4601445

914.2292041 875

nitrogen pentoxide N2O5 298.15 113.9 113.9

8253.434945 8092.97563

lithium oxide Li2O 453.7 -562.1204273 -542.7698104

-104.0142929 -95.3094312

lithium peroxide Li2O2 453.7 -570.9850245 -538.5888888

1451.738905 1450.233334

lutetium oxide Lu2O3 298.15 -1789 -1789

-206.653011 -206.653011

magnesium oxide MgO 800 -568.9612481 -515.0207188

-124.5367553 -119.0621564

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manganese (II) oxide MnO 298.15 -362.9 -362.9

493.646989 493.646989

manganese (IV) oxide MnO2 298.15 -465.1 -465.1

1769.393978 1769.393978

potassium superoxide KO2 336.86 -240.6110985 -234.9316799

2442.860683 2435.20496

potassium oxide K2O 336.86 -322.1146663 -316.782815

616.0029901 619.651555

potassium peroxide K2O2 336.86 -429.7912283 -421.2098435

1875.320293 1876.37047

germanium (II) oxide GeO 298.15 -237.2 -237.2

870.746989 870.746989

germanium (IV) oxide GeO2 1210 -521.4294817 -348.4810987

1600.405533 1569.8

mercury (II) oxide HgO 629.839 -58.50624976 -23.31129979

1406.82824 1408.066101

cesium oxide Cs2O 298.15 -308.1 -308.1

658.046989 658.046989

copper (II) oxide CuO 1358 -128.3059718 -38.65822682

1197.429074 1268.02532

copper (I) oxide Cu2O 1358 -147.8974813 -70.75422027

1138.654545 1171.737339

dysprosium (III) oxide Dy2O3 298.15 -1771.5 -1771.5

-189.153011 -189.153011

erbium oxide Er2O3 298.15 -1808.7 -1808.7

-226.353011 -226.353011

europium oxide Eu2O3 298.15 -1556.8 -1556.8

25.546989 25.546989

trieuropium tetroxide Eu3O4 298.15 -2142 -2142

-96.612044 -96.612044

iron (II) oxide FeO 1500 -251.4393718 -179.8873092

828.0288736 749.5

iron (III) oxide Fe2O3 950 -743.5642445 -575.6439034

838.7827445 804.6

iron (ii,iii) oxide Fe3O4 900 -1017.490049 -823.8249417

3276.917809 3729.545679

calcium oxide CaO 716 -603.5168921 -559.9671873

-228.2036873 -227.9015619

cadmium oxide CdO 298.15 -228.7 -228.7

896.246989 896.246989

cerium (IV) oxide CeO2 298.15 -1024.6 -1024.6

90.893978 90.893978

cerium (III) oxide Ce2O3 298.15 -1706.2 -1706.2

-123.853011 -123.853011

cobalt (II) oxide CoO 1394 -213.9999478 -136.3002814

940.3471456 879.4

cobalt tetroxide Co3O4 1394 -794.9289314 -387.4685075

3944.601162 3873.7

chromium (VI) oxide CrO3 470 -506.3039947 -460.6683489

1076.042994 1067.331651

chromium (III) oxide Cr2O3 305 -1053.107072 -1051.192762

529.239917 528.807238

boron oxide B2O3 500 -1192.835815 -1139.216586

389.511174 380

barium oxide BaO 500 -520.3959472 -501.8327972

21.1591474 13.6

beryllium oxide BeO 1500 -579.0767367 -461.9557018

-154.8832211 -293

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berkelium dioxide BkO2 298.15 -923.4 -923.4

394.493978 394.493978

silver (II) oxide AgO 298.15 14.489192 14.489192

1625.814565 1625.814565

silver (I) oxide Ag2O 298.15 -11.2 -11.2

1548.746989 1516.655126

silver peroxide Ag2O2 298.15 27.6 27.6

3247.443996 3247.443996

aluminum oxide Al2O3 400 -1582.346989 -1550.255126 aluminum oxide (alpha) Al2O3 933.45 -1582.321998 -1384.688535 arsenic trioxide As2O3 357.78 -569.0595743 -554.9143109

1013.287415 1008.8

arsenic (V) oxide As2O5 298.15 -782.3 -782.3

5564.834945 5564.834945

germanium (II) oxide GeO 298.15 -237.2 -237.2

870.721998 870.721998

germanium (IV) oxide GeO2 1210 -521.4294817 -348.4810987

1600.355551 1722.556704

hafnium oxide HfO2 298.15 -1088.2 -1088.2

-99.956004 -99.956004

mercury (II) oxide HgO 629.839 -58.50624976 -23.31129979

1406.803249 1408.066101

Ho2O3 298.15 -1791.1 -1791.1

-208.778002 -208.778002

indium (III) oxide In2O3 298.15 -830.7 -830.7

751.621998 751.621998