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Last Update:2024/10/04
Phonon calculation for NaCl using Phonopy and Quantum ESPRESSO
1. Introduction Phonopy is a post-processing program for extracting phonon properties in combination with firs…続きを読む
Phonopy
Software to calculate physical quantities related to phonon in solids from result calculated using first principles calculation software. Results calculated from first principles calculation software such as VASP and Wien2k are used as an input.