kim-api  2.1.4-git+v2.1.3-git-1-g7847914a.GNU
An Application Programming Interface (API) for the Knowledgebase of Interatomic Models (KIM).
Alchemy_PbAu.in
Go to the documentation of this file.
1 if "${alchemy_mapping} == Pb" then &
2  "pair_coeff ${alchemy_curr_type} ${alchemy_curr_type} 0.8589880 2.6014200 10.4057000" &
3 elif "${alchemy_mapping} == Au" &
4  "pair_coeff ${alchemy_curr_type} ${alchemy_curr_type} 2.3058000 2.4232400 9.6929800"
5 
6 next alchemy_curr_type
7 next alchemy_mapping
8 jump SELF