[DFTB-Plus-User] latticeOpt_error

[Bálint Aradi]

Dear Keshtan,

indeed, this should not happen. Can you make an issue on GitHub, so that 
we can investigate?

Best regards,

Bálint


On 27.02.24 16:13, keshtan wrote:
> Hi,
> 
> 
> When I try to use LatticeOpt and set it to "LatticeOpt=Yes" in DFTB+ 
> code, I faced with the "Fortran runtime error: shape and target do not 
> conform". Typically, this error happen when an array or parameter is 
> improperly allocated or defined in a Fortran code. So, why did it happen 
> in DFTB+? Everything properly works if this command is set to 
> "LatticeOpt=No"
> 
> 
> Sincerely,
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> DFTB-Plus-User at mailman.zfn.uni-bremen.de
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-- 
Dr. Bálint Aradi
Bremen Center for Computational Materials Science, University of Bremen
http://www.bccms.uni-bremen.de/cms/people/b-aradi/


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