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Evangelos Voyiatzis 6f07564a92 Create README
2021-03-16 13:13:45 +01:00
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README
Create README
2021-03-16 13:13:45 +01:00

README 

conversion of lammps scripts to python code using PyLammps interface

Example for elastic.py 
python elastic.py Au.data EAM_Dynamo_Ackland_1987_Au__MO_754413982908_000 Au