mirror of https://github.com/phonopy/phono3py.git
293 B
293 B
Example to create force constants using MLPs by pypolymlp
This is an example to follow the documentation
https://phonopy.github.io/phono3py/pypolymlp.html.
phono3py_params.yaml
can be also generated by
% python make_phono3py_params.py ../NaCl-rd/phono3py_params_NaCl.yaml.xz