Re: [Pw_forum] task # 0 from grid_build : error # 16 non unifrom kpt grid

2015-06-02 Thread H.Y Geoffrey Tse
Hi Mulwa,

I checked, your grid is uniform so shouldnt be a problem.

Did you use the same number of processors to run both simulations?
Alternatively, try rename the file as scf.in when running the simulation?
Else, your k-grid size is too small to support many processors. try use less 
number, like, 4.

Best Regards,
Geoffrey Tse
Peking University, China

-原始邮件-
发件人:"Winfred Mulwa" <mulwawinf...@gmail.com>
发送时间:2015-06-02 16:22:14 (星期二)
收件人: "PWSCF Forum" <pw_forum@pwscf.org>
抄送:
主题: [Pw_forum] task # 0 from grid_build : error # 16 non unifrom kpt grid


Dear all,

I am doing an epislon.x calculation using eps.in input file attached and i get 
the above mentioned error. Please somebody help, how do i solve the error?

Kind regards

Mulwa Winfred.
D Phil Student, Computational Material Science Group,
University of the Free State - QwaQwa,

South Africa.
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[Pw_forum] task # 0 from grid_build : error # 16 non unifrom kpt grid

2015-06-02 Thread Winfred Mulwa
Dear all,
I am doing an epislon.x calculation using eps.in input file attached and i
get the above mentioned error. Please somebody help, how do i solve the
error?
Kind regards
Mulwa Winfred.
D Phil Student, Computational Material Science Group,
University of the Free State - QwaQwa,
South Africa.


eps.in
Description: Binary data


ana.scf.in
Description: Binary data


ana.scf.out
Description: Binary data
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