Results 301 to 307 of about 10,862,879 (307)

Libxc: A Library of Exchange and Correlation Functionals for Density Functional Theory

Computer Physics Communications, 2012
Tobias Burnus, Miguel A. L. Marques, Micael J. T. Oliveira   +2 more
exaly  

Perspective: Fundamental Aspects of Time-Dependent Density Functional Theory

Journal of Chemical Physics, 2016
Neepa Maitra
exaly  

Geometries and Properties of Excited States in the Gas Phase and in Solution: Theory and Application of a Time-Dependent Density Functional Theory Polarizable Continuum Model

Journal of Chemical Physics, 2006
Vincenzo Barone, Michael J Frisch, Benedetta Mennucci   +2 more
exaly  

Toward Ab Initio Density Functional Theory for Nuclei

Progress in Particle and Nuclear Physics, 2010
Lucas Platter, R J Furnstahl
exaly  

Density Functional Theory

1990
Reiner M. Dreizler, Eberhard K. U. Gross
openaire   +1 more source

Density functional theory

Coordination Chemistry Reviews, 1998
openaire   +1 more source

Density Functional Theory

2008
openaire   +1 more source