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Table B.4
Calculated thermochemical values of Bromley’s (TiO2)3.
| T | S° | [− G° − H°(Tr)] /T | H° − H°(Tr) | ΔfH° | ΔfG° |
| K | J mol-1 K-1 | J mol-1 K-1 | kJ mol-1 | kJ mol-1 | kJ mol-1 |
|
|
|||||
| 0 | 0.000 | Infinite | –28.116 | –1747.136 | –1747.136 |
| 100 | 302.668 | 526.022 | –22.792 | –1752.207 | –1728.003 |
| 200 | 369.132 | 430.261 | –12.973 | –1756.871 | –1701.871 |
| 298.15 | 421.551 | 417.923 | 0.000 | –1759.559 | –1674.238 |
| 300 | 422.434 | 417.914 | 0.268 | –1759.594 | –1673.705 |
| 400 | 467.181 | 423.832 | 15.869 | –1760.745 | –1644.865 |
| 500 | 505.335 | 435.576 | 32.989 | –1761.024 | –1615.851 |
| 600 | 538.324 | 449.266 | 51.095 | –1760.874 | –1586.827 |
| 700 | 567.232 | 463.415 | 69.857 | –1760.541 | –1557.843 |
| 800 | 592.877 | 477.403 | 89.065 | –1760.116 | –1528.914 |
| 900 | 615.872 | 490.955 | 108.591 | –1759.781 | –1500.038 |
| 1000 | 636.692 | 503.965 | 128.353 | –1759.768 | –1471.181 |
| 1100 | 655.690 | 516.401 | 148.288 | –1760.305 | –1442.301 |
| 1200 | 673.152 | 528.269 | 168.358 | –1773.367 | –1412.989 |
| 1300 | 689.303 | 539.593 | 188.535 | –1772.879 | –1382.979 |
| 1400 | 704.315 | 550.400 | 208.793 | –1772.637 | –1352.992 |
| 1500 | 718.338 | 560.726 | 229.119 | –1772.686 | –1323.020 |
| 1600 | 731.494 | 570.602 | 249.504 | –1773.068 | –1293.035 |
| 1700 | 743.878 | 580.060 | 269.933 | –1773.834 | –1263.015 |
| 1800 | 755.578 | 589.131 | 290.401 | –1775.019 | –1232.926 |
| 1900 | 766.662 | 597.842 | 310.901 | –1776.684 | –1202.774 |
| 2000 | 777.191 | 606.215 | 331.430 | –1822.917 | –1171.147 |
| 2100 | 787.220 | 614.278 | 351.982 | –1827.894 | –1138.439 |
| 2200 | 796.790 | 622.048 | 372.556 | –1832.917 | –1105.496 |
| 2300 | 805.945 | 629.546 | 393.150 | –1837.985 | –1072.315 |
| 2400 | 814.716 | 636.790 | 413.758 | –1843.108 | –1038.910 |
| 2500 | 823.133 | 643.794 | 434.378 | –1848.284 | –1005.304 |
| 2600 | 831.226 | 650.574 | 455.015 | –1853.508 | –971.471 |
| 2700 | 839.017 | 657.144 | 475.659 | –1858.784 | –937.453 |
| 2800 | 846.530 | 663.516 | 496.314 | –1864.115 | –903.235 |
| 2900 | 853.781 | 669.700 | 516.979 | –1869.493 | –868.815 |
| 3000 | 860.789 | 675.707 | 537.652 | –1874.922 | –834.223 |
| 3100 | 867.570 | 681.548 | 558.331 | –1880.401 | –799.443 |
| 3200 | 874.138 | 687.231 | 579.017 | –1885.929 | –764.488 |
| 3300 | 880.506 | 692.763 | 599.711 | –1891.499 | –729.348 |
| 3400 | 886.685 | 698.152 | 620.408 | –1897.119 | –694.054 |
| 3500 | 892.686 | 703.406 | 641.113 | –1902.772 | –658.583 |
| 3600 | 898.520 | 708.531 | 661.820 | –1908.477 | –622.958 |
| 3700 | 904.194 | 713.533 | 682.530 | –3141.515 | –563.805 |
| 3800 | 909.719 | 718.419 | 703.248 | –3143.591 | –494.102 |
| 3900 | 915.100 | 723.192 | 723.966 | –3145.871 | –424.351 |
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