Molecular Modelling

Queries about input and output files, running specific calculations, etc.


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obanks
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Molecular Modelling

#1 Post by obanks » Thu Jul 23, 2015 7:43 pm

does anyone know of any drawing or modelling programs that can
save in files that are compatible with or can be opened by VASP?
I currently have Gaussview and Sybill, but cannot save files in
a compatible format. Thanks

Neutrino

Re: Molecular Modelling

#2 Post by Neutrino » Mon Jul 27, 2015 5:41 pm

Hi obanks,

VESTA can open POSCAR, CONTCAR, CHGCAR and can save files in POSCAR format.


http://jp-minerals.org/vesta/en/


Mostafa

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