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Phonopy

  • Openness:3 ★★★
  • Document quality:3 ★★★

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.

Information
Last Update:2021/03/05

Official site

https://atztogo.github.io/phonopy/

License

New BSD License (from version 1.3)
Availability Linux (Ubuntu, Fedora, etc.); Mac OS X
Core Developers Atsushi Togo (Center for the Promotion of Interdisciplinary Education and Research, Kyoto University)
Target substance/model Crystals
Physical quantities that can be computed Phonon scattering, state density, specific heat, Grueneisen constant, etc.
Methodology Phonon scattering
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