Calculating phase diagrams using PANDAT and panengine
PANDAT adopts the same concept of ZPF to trace the phase boundaries. Moreover, at each point on a phase boundary, PANDAT also checks the stability of the phase equilibrium by calculating the lowest Gibbs energy of each phase. If some phases are more stable than the current phase equilibrium, then th...
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Published in: | JOM (1989) Vol. 55; no. 12; pp. 48 - 51 |
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Main Authors: | , , , , , , , |
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01-12-2003
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Abstract | PANDAT adopts the same concept of ZPF to trace the phase boundaries. Moreover, at each point on a phase boundary, PANDAT also checks the stability of the phase equilibrium by calculating the lowest Gibbs energy of each phase. If some phases are more stable than the current phase equilibrium, then the current calculated phase equilibrium is not stable and that calculation is abandoned. When this is the case, a phase equilibrium involving new phases is calculated. |
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AbstractList | PANDAT adopts the same concept of ZPF to trace the phase boundaries. Moreover, at each point on a phase boundary, PANDAT also checks the stability of the phase equilibrium by calculating the lowest Gibbs energy of each phase. If some phases are more stable than the current phase equilibrium, then the current calculated phase equilibrium is not stable and that calculation is abandoned. When this is the case, a phase equilibrium involving new phases is calculated. |
Author | Xie, F. -Y. Chen, S. -L. Daniel, S. Zhang, F. Schmid-Fetzer, R. Oates, W. A. Yan, X. -Y. Chang, Y. A. |
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Cites_doi | 10.1016/0364-5916(77)90004-9 10.1016/0364-5916(82)90004-9 10.1515/zpch-1908-6314 10.1007/BF02670272 10.1016/S1359-6454(01)00431-1 10.1016/0364-5916(83)90019-6 10.1016/0364-5916(85)90021-5 10.1016/0364-5916(78)90006-8 10.1016/S0921-5093(03)00056-X 10.1016/S1359-6454(98)00372-3 10.1051/jcp/1993900421 10.1515/zpch-1908-6417 10.1361/105497101770332910 10.1016/S0925-8388(00)01469-9 |
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Copyright | Copyright Minerals, Metals & Materials Society Dec 2003 |
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Snippet | PANDAT adopts the same concept of ZPF to trace the phase boundaries. Moreover, at each point on a phase boundary, PANDAT also checks the stability of the phase... |
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Title | Calculating phase diagrams using PANDAT and panengine |
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