[CPMD-list] Request for input file
Juerg Hutter
hutter at pci.unizh.ch
Thu Apr 14 14:41:33 CEST 2005
Hi
there are many input and output files available on the
cpmd.org webpage. Go to the download area and there
to the contrib folder. The cpmd-test files has the inputs.
regards
Juerg Hutter
----------------------------------------------------------
Juerg Hutter Phone : ++41 1 635 4491
Physical Chemistry Institute FAX : ++41 1 635 6838
University of Zurich E-mail: hutter at pci.unizh.ch
Winterthurerstrasse 190
CH-8057 Zurich, Switzerland
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On Mon, 4 Apr 2005, Utpal Sarkar wrote:
> Dear CPMD users,
> I am begginer of the CPMD code. I have installed it. I also have
> the manual but I could not understand how to run this code. Or in brief I if anybody
> help me providing a prototype example of the input file, it will be very helpful for me.
> I, say, want to see the excited states of HCHO molecule using DFT methods.
> So how can I proceed? Then how will I define the input files?
> Any type of help is highly appreciated.
> Regards
> Utpal
>
>
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