Phonopy 0.9.5.2 Pre v.2



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Description

Phonopy is an implementation of post-process phonon analyzer, which calculates crystal phonon properties from input information calculated by external codes, e.g., first-principles calculation code. Phonopy employs a real-space method. Phonopy calculates phonon frequencies from force constants. The force constants are obtained from atomic forces when an atom is slightly displaced in supercell (Parlinsk-Li-Kawasoe method). In practice, phonopy...
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  • Developer:Atsushi Togo
  • Downloads:61
  • Size:1.3 Mb
  • Price: Free

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System Requirements

Phonopy 0.9.5.2 Pre requires Mac OS X.

Phonopy 0.9.5.2 Pre v.2 Copyright

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