Ensamble Sampling for Lattice Dynamics
Computational investigation of anharmonic and temperature-dependent aspects of lattice dynamics requires, among other things, replication of the conditions of thermal equilibrium. [...]
| Main Authors: | , |
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| Format: | Article |
| Language: | English |
| Published: |
MDPI AG
2019-09-01
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| Series: | Proceedings |
| Subjects: | |
| Online Access: | https://www.mdpi.com/2504-3900/26/1/52 |
| Summary: | Computational investigation of anharmonic and temperature-dependent aspects of lattice dynamics requires, among other things, replication of the conditions of thermal equilibrium. [...] |
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| ISSN: | 2504-3900 |