Releases: hitliaomq/ELASTIC3rd
Releases · hitliaomq/ELASTIC3rd
Add some command
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
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
ELASTIC3rd
Calculate the 3rd order elastic constant of crystal(now only support for cubic).