The ABINIT Users Mailing List ( CLOSED )

["WANG Yuan Xu" <wang.yuanxu@nims.go.jp>]

Dear Abinit all users,

  For parallel run abinit purpose, the number of k points must be the 
multiple  of number of cpu. My supercomputer class is 16.
  So if I want to to do k points parallel run, the k points must the  16, 32 
....  I want to know how to get speical k points (such as 32, 64) in abinit.
   if I use kptopt =1 and ngkpt = 6 6 6, the k points is 18, the abinip can 
not be run correctly.     
   who can tell me ?
        

Best


WANG Yuan Xu
National Institute for Materials Science
Computational Materials Science Center
Namiki 1-1, Tsukuba 305-0044, Japan
Phone +81-29-8513354-8092; Fax +81-29-8541207
wang.yuanxu@nims.go.jp
2004-10-07