[Pw_forum] Frozen atomic coordinates on phonon calculations:references
d.tiana at bath.ac.uk
Wed Oct 31 09:53:57 CET 2012
web of science
> Dear all,
> Could anyone indicate me a published paper using/testing frozen atomic
> coordinates on phonon calculations (nat_todo option in QE)?
> Thanks in advance.
> Ant?nio M. Da Silva Jr. (PhD student)
> Nucleus of studies in computational chemistry (NEQC)
> Department of Chemistry
> Federal *University of Juiz de Fora* (UFJF) - Brazil
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