[DFTB-Plus-User] How to plot density of spin ?

Cedric Crespos cedric.crespos at u-bordeaux.fr
Thu Jan 29 12:04:07 CET 2026


Dear all, 
could you please tell us if it is possible to visualize any density of spin out of a spin-polarized DFTB+ calculations. We are interested by representing the spin density map after adsorption of an hydrogen atom onto graphene sheet. 
Many thanks for any helps 
Best 
Cedric 

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Dr CEDRIC CRESPOS 
cedric.crespos at u-bordeaux.fr 
Phone: +33 (0)5 40 00 63 10 

Institut des Sciences Moléculaires / Groupe de Chimie Theorique 
CNRS UMR 5255 / Universite de Bordeaux 
351 Cours de la Liberation, F-33405 TALENCE CEDEX - FRANCE 
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Responsable MASTER CHIMIE / UNIVERSITE DE BORDEAUX 
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