Auto test: to do list

Jump to bottom

Han Wang edited this page Jun 5, 2020 · 8 revisions

For the implementation, one should do : 0. Clearly know the input/output of the function/class. How to handle exceptions.

Finish coding
Provide Unittest
Provide Document: what does the user provide in each section of the parameter file (json format)

common.py make_* run_* post_*

Property

EOS
Elastic
Vacancy
Interstitial
Surface

Interaction:

VASP
DEEPMD_LMP
MEAM_LMP