[Pw_forum] monoclinic system number of atom generated is incorrect

[Lori 91]

Dear Paolo 
Just another thing for example how to define it for a monoclinic structure 
Thanks really a lot
Dearly
Lorenzo 

Inviato da iPhone

> Il giorno 11 giu 2016, alle ore 09:39, Lori 91 <lorechimica91 at hotmail.it> ha scritto:
> 
> Dear Paolo i wish know how to define the lattice vector to put in CELL_PARAMETERS I wish to know how to calculate v1 v2 and v3 because I have read tha pwscf input documentation but I don't understand how to define them 
> Thanks a lot 
> Lorenzo 
> 
> Inviato da iPhone
> 
>>> Il giorno 11 giu 2016, alle ore 08:44, Paolo Giannozzi <p.giannozzi at gmail.com> ha scritto:
>>> 
>>> On Wed, Jun 8, 2016 at 9:08 PM, Lorenzo Donà <lorechimica91 at hotmail.it> wrote:
>>> 
>>> where or how can i find the Bravais lattice vectors for a system??
>> 
>> what do you mean? they aren't uniquely defined. The specific choice
>> done by QE is described in the input documentation and reprinted on
>> output.
>> 
>> -- 
>> Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
>> Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
>> Phone +39-0432-558216, fax +39-0432-558222
>> 
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> 
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