Dynamical matrices, Born effective charges, dielectric permittivity tensors, and interatomic force constants from density-functional perturbation theory

American Physical Society (APS) - Tập 55 Số 16 - Trang 10355-10368
Xavier Gonze1, Changyol Lee2
1Unitéde Physico-Chimie et de Physique des Matériaux, UniversitéCatholique de Louvain, B-1348 Louvain-la-Neuve, Belgium
2Department of Physics, Ewha Womans University, Seoul 120-750, South Korea

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