hello,
I'm going to achieve the best kpoint and cut-off for my system. I got results
but I do'nt know, What is the best choice for K-point and cut -off?
I attached the file and please help me,
thanks in advance.?
Farzad Molani,
Ph.D Student,
Department of Theoretical Physical Chemistry,
K. N. Toosi University of Technology,
Tehran, Iran.
Tel.: 009891 4442 3308
Tel.: 009821 2306 4280
Fax: 009821 2285 3650
Web: http://www.chem.kntu.ac.ir/~sjalili:/
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