Open Access
Ab initiophonon dispersion in crystalline naphthalene using van der Waals density functionals
Author(s) -
Florian Brown-Altvater,
Tonatiuh Rangel,
Jeffrey B. Neaton
Publication year - 2016
Publication title -
physical review. b./physical review. b
Language(s) - German
Resource type - Journals
SCImago Journal Rank - 1.78
H-Index - 465
eISSN - 2469-9969
pISSN - 2469-9950
DOI - 10.1103/physrevb.93.195206
Subject(s) - phonon , van der waals force , density functional theory , materials science , brillouin zone , raman spectroscopy , intermolecular force , condensed matter physics , ab initio , ab initio quantum chemistry methods , graphene , local density approximation , molecular physics , physics , computational chemistry , chemistry , nanotechnology , molecule , quantum mechanics