about
Valence electronic structure of cobalt phthalocyanine from an optimally tuned range-separated hybrid functional.Antiferromagnetic vs. non-magnetic ε phase of solid oxygen. Periodic density functional theory studies using a localized atomic basis set and the role of exact exchange.DFT investigation of the effect of spin-orbit coupling on the NMR shifts in paramagnetic solids
P2860
description
im Juli 2016 veröffentlichter wissenschaftlicher Artikel
@de
wetenschappelijk artikel
@nl
наукова стаття, опублікована в липні 2016
@uk
name
Does DFT+U mimic hybrid density functionals?
@en
Does DFT+U mimic hybrid density functionals?
@nl
type
label
Does DFT+U mimic hybrid density functionals?
@en
Does DFT+U mimic hybrid density functionals?
@nl
prefLabel
Does DFT+U mimic hybrid density functionals?
@en
Does DFT+U mimic hybrid density functionals?
@nl
P2860
P1476
Does DFT+U mimic hybrid density functionals?
@en
P2093
Pragya Verma
P2860
P2888
P356
10.1007/S00214-016-1927-4
P577
2016-07-08T00:00:00Z