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Releases: hitliaomq/ELASTIC3rd

Add some command

18 Oct 00:51
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Improve the online documents. Elastic3rd manual
Add elastic3rd run and elastic3rd post command. Please use -h for detail help.

Strain-Energy Method for any symmetry

14 Jan 02:13
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Pre-release

Version 2.4.2

  • Support all classes of crystal, from cubic to triclinic
  • Support CASTEP (windows or linux, under Materials Studio) and VASP
  • Support Python2 and Python3
  • Support pip installation

Fix a bug

24 Dec 12:38
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Fix a bug Pre-release
Pre-release
1.1.1

Update README.md

ELASTIC3rd

24 Dec 10:33
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ELASTIC3rd Pre-release
Pre-release

Calculate the 3rd order elastic constant of crystal(now only support for cubic).