[Pw_forum] How to generate a pp which is 3/4 of itself using virtual.x

Jun Dai jdai3 at mail.ustc.edu.cn
Sun Oct 18 18:04:17 CEST 2009


Dear Q-E users;

I have a system has 38 oxygen atoms whoes occupation is 3/4, so i want to genrate a new O pp which is 3/4 of itself, 

can someone give some suggestions on how to do it, thanks in advance.

 

Jun DAI

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Ph.D. Candidate,
Hefei National Laboratory For Physical Sciences at the Microscale,
University of Science and Technology of China,
Hefei, Anhui, 230026,
People's Republic of China
Tel.: 86-551-3606428
Fax.: 86-551-3602969
E-mail: jdai3 at mail.ustc.edu.cn
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