[Pw_forum] integrated charge error

Pang Rui pang.r at sustc.edu.cn
Fri May 23 16:10:25 CEST 2014


Dear Filippo,
The GPU is NVIDIA Tesla C2050, I thinke the cluster is generally all
right. It belongs to a supercomputing center and I saw someone run GPU code
on it.
Regards Pangrui
On Thu, 22 May 2014 10:14:20 +0100, Filippo Spiga
<spiga.filippo at gmail.com>
wrote:
> Dear 庞瑞,
> 
> I am aware about a problem in one of the routines related to nspin=2 but
I
> did not have enough time in the past month to look at it. Are you using
a
> proper cluster or are you tryin to run your calculation using some
> commodity GPU (e.g. GTX or mobile GPU)?
> 
> Regards,
> F
> 
> 
> On May 14, 2014, at 1:08 PM, 庞瑞 <pang.r at sustc.edu.cn> wrote:
> 
>> QE-GPU-14.03.0+QE.5.02
>> On Wed, 14 May 2014 12:43:51 +0200, Paolo Giannozzi

>> <paolo.giannozzi at uniud.it> wrote:
>>> On Wed, 2014-05-14 at 18:02 +0800, 庞瑞 wrote:
>>> 
>>>> I used a GPU version pw.x
>>> 
>>> you used "which" GPU version?
>>> 
>>> P.
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> 
> --
> Mr. Filippo SPIGA, M.Sc.
> http://www.linkedin.com/in/filippospiga ~ skype: filippo.spiga
> 
> «Nobody will drive us out of Cantor's paradise.» ~ David Hilbert
> 
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