| ##################################################################### | |
| ###### CALCULATION OF THE CONFIGURATIONAL ENTHALPY AND ENTROPY ###### | |
| ##################################################################### | |
| *****DATA PROVIDED BY THE USER*************************************** | |
| 49152.77, | Enthalpy of fusion H_m (Jmol–1) |
| 107.90, | Entropy of fusion S_m (Jmol–1) |
| 325.23, | Glass transition temperature T_g (K) |
| 200.00, | T_0, start temperature for the linear fit below T_g (K) |
| 310.00, | Final temperature for the linear fit below T_g (K) |
| 330.00, | Start temperature for the linear fit above T_g (K) |
| 455.57, | Melting point T_m (K) |
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