I know the command for producing
cube including Rho (PP) . Would you please let me know how can I get the
wave function in cube format.
?
> On Sat, Feb 16, 2013 at 12:58 PM,
<nazari at iasbs.ac.ir> wrote:
>> Dear All ,
>>
Is it possible a cube file which is containing psi in cube format is
>> produced in quantum esperesso. I mean something similar to the
following
>> in
>> CPMD:
>> (Real
space ) cpmd2cube.x -halfmesh -psi WAVEFUNCTION.2
>
>
yes.
>
>>
>> Regards
>>
Fariba Nazari
>> IASBS
>>
>>
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> Dr. Axel Kohlmeyer akohlmey at gmail.com
http://goo.gl/1wk0
> International Centre for Theoretical
Physics, Trieste. Italy.
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