Method to extract anharmonic force constants from first principles calculations
Author:
Publisher
American Physical Society (APS)
Subject
Condensed Matter Physics,Electronic, Optical and Magnetic Materials
Link
http://harvest.aps.org/v2/journals/articles/10.1103/PhysRevB.77.144112/fulltext
Reference24 articles.
1. Green’s-function approach to linear response in solids
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3. Ab InitioForce Constants of GaAs: A New Approach to Calculation of Phonons and Dielectric Properties
4. First-Principles Determination of the Soft Mode in CubicZrO2
5. Determination of the elastic tensor in low-symmetry structures
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