[CPMD-list] (no subject)
kdong
kdong_bj at sina.com
Mon Jul 16 10:54:49 CEST 2007
Dear every CPMD user,
I already the trajectory file in NVE, and I think to use transition path sampling to explore the rare events in my system. But it is first time for me to use the method. I can download the TPS_SOURCE and TPS_SOURCE_CPMD codes, and I do not know to do with the input file. The TPS_SOURCE_CPMD can not be compiled normly.
who can give me some suggestions?
Best regards
2007-07-16 16:43:47
K. Dong
Institute of Process Engineering
Chinese Academy of Sciences (CAS)
Beijing 100080, China
Tel: 86-10-62550850
Mobile: 13811865926
Email: dongkun at home.ipe.ac.cn and kdong_bj at sina.com
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