[Pw_forum] Please help me

Axel Kohlmeyer akohlmey at gmail.com
Tue Nov 1 03:16:34 CET 2011


2011/10/31 陶鹏 <ptao10b at imr.ac.cn>:
> Dear all,
>
> I just met a strange problem when using "dynmat.x" at K point. The supercell of graphene contains 6 carbon atoms which have 18 vibrating modes. All of them are available in the file "gg.dynK".
>
> However, if I apply the "dynmat.x" on "gg.dynK", the screen displayed like this:

as it should. this is not how you use dynmat.x
please read the documentation.

axel.

>
> forrtl: severe (24): end-of-file during read, unit 5, file stdin, line 442, position 0
> Image              PC                Routine            Line        Source
> dynmat.x           0000000000A865AD  Unknown               Unknown  Unknown
> dynmat.x           0000000000A850B5  Unknown               Unknown  Unknown
> dynmat.x           0000000000A1B719  Unknown               Unknown  Unknown
> dynmat.x           00000000009B45CF  Unknown               Unknown  Unknown
> dynmat.x           00000000009B3E02  Unknown               Unknown  Unknown
> dynmat.x           00000000009E6B66  Unknown               Unknown  Unknown
> dynmat.x           000000000043ADC1  Unknown               Unknown  Unknown
> dynmat.x           000000000043AA6C  Unknown               Unknown  Unknown
> libc.so.6          00002AD76A9EE184  Unknown               Unknown  Unknown
> dynmat.x           000000000043A999  Unknown               Unknown  Unknown
>
> Could someone tell me how to do? Thanks.
>
> Yours,
> Plato
>
>
>
>
>
>
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>



-- 
Dr. Axel Kohlmeyer
akohlmey at gmail.com  http://goo.gl/1wk0

College of Science and Technology
Temple University, Philadelphia PA, USA.



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