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Semi-Empirical Force-Field Model for the Ti(1−x)Al(x)N (0 ≤ x ≤ 1) System
We present a modified embedded atom method (MEAM) semi-empirical force-field model for the Ti(1−x)Al(x)N (0 ≤ x ≤ 1) alloy system. The MEAM parameters, determined via an adaptive simulated-annealing (ASA) minimization scheme, optimize the model’s predictions with respect to 0 K equilibrium volumes,...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
MDPI
2019
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6356630/ https://www.ncbi.nlm.nih.gov/pubmed/30634593 http://dx.doi.org/10.3390/ma12020215 |