Projector augmented-wave formulation of response to strain and electric-field perturbation within density functional perturbation theory
Author:
Funder
European Research Council
Horizon 2020
Publisher
American Physical Society (APS)
Link
http://harvest.aps.org/v2/journals/articles/10.1103/PhysRevB.99.094112/fulltext
Reference31 articles.
1. Elastic Constants of Crystals from Linear-Response Theory
2. Green’s-function approach to linear response in solids
3. Metric tensor formulation of strain in density-functional perturbation theory
4. Projector augmented-wave method
5. Implementation of the projector augmented-wave method in the ABINIT code: Application to the study of iron under pressure
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