[Pw_forum] (no subject)
antonio.msj1 at gmail.com
Tue Oct 30 17:59:23 CET 2012
Could anyone indicate me a published paper using/testing frozen atomic
coordinates on phonon calculations (nat_todo option in QE)?
Thanks in advance.
Antônio M. Da Silva Jr. (PhD student)
Nucleus of studies in computational chemistry (NEQC)
Department of Chemistry
Federal *University of Juiz de Fora* (UFJF) - Brazil
-------------- next part --------------
An HTML attachment was scrubbed...
More information about the users