[Pw_forum] A question about PWscf
pzc at sjtu.edu.cn
pzc at sjtu.edu.cn
Sun Aug 22 08:48:41 CEST 2004
Hello,
I am a graduate student in Shanghai Jiaotong University. We are taking ab inito calculations now. And we need some information about your PWscf. In this software, how to constrain a relaxation to relax only in x,y direction and fix z direction unchanged? What parameters should be used in the input file?
Hope your respond, many thanks!
Panzic 22 Aug 2004
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