[Wien] Problem with XCrySDen for Electron Desity plot (Wien2k_18)
Víctor Luaña Cabal
victor at fluor.quimica.uniovi.es
Wed Jul 18 15:29:54 CEST 2018
* Dr. K. Balamurugan <kbala at nitt.edu> [2018-07-18 15:27:07 +0530]:
> Dear Wien2k Developers and Users,
>
> I could get Electron Density (ED) maps using w2web; but, while I tried to do
> the same using XCrySDen, I got the following issue allowing me not get a ED
> map.
>
Dr, Balamurugan,
Please, check critic2 in github. The code is open source and free, and
it can perform all kind of QTAIM tasks incuding, of course, Bader
analysis of the ED, and using wien2k and *many other* ED formats,
Best regards,
Víctor Luaña
--
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! Dr.Víctor Luaña, in silico chemist & prof. ! and owner of his silences.
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