Reference : Computational benchmarking for ultrafast electron dynamics: wavefunction methods vs d...
Scientific journals : Article
Physical, chemical, mathematical & earth Sciences : Physics
http://hdl.handle.net/2268/182319
Computational benchmarking for ultrafast electron dynamics: wavefunction methods vs density functional theory
English
Oliveira, Micael J. T. [> >]
Mignolet, Benoît mailto [Université de Liège > Département de chimie (sciences) > Laboratoire de chimie physique théorique >]
Kus, Tomasz [> >]
Papadopoulos, Theodoros A. [> >]
Remacle, Françoise mailto [Université de Liège > Département de chimie (sciences) > Laboratoire de chimie physique théorique >]
Verstraete, Matthieu mailto [Université de Liège > Département de physique > Physique des matériaux et nanostructures >]
2015
Journal of Chemical Theory and Computation
11
2221 − 2233
Yes
International
1549-9618
[en] Attochemistry ; direct time TD-DFT ; quantum chemistry
Theoretical Physical Chemistry, nanomat
Fonds de la Recherche Fondamentale Collective - FRFC, CECI
Atto second control of reactivity
http://hdl.handle.net/2268/182319
10.1021/acs.jctc.5b00167
http://dx.doi.org/10.1021/acs.jctc.5b00167

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