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5 documents ordered by : Date Title first author name document type Submit date

Local Exchange Potentials for Electronic Structure Calculations Cances E., Stoltz G., Scuseria G. E., Staroverov V. N., Davidson E. R. Mathematics in Action 2, 1 (2009) 1-42 [hal-00186926 - version 1]

On Kohn-Sham models with LDA and GGA exchange-correlation functionals Anantharaman A., Cancès E. [inria-00325660 - version 1] (29/09/2008)

An efficient sampling algorithm for variational Monte Carlo Scemama A., Lelievre T., Stoltz G., Cancès E., Caffarel M. The Journal of Chemical Physics 125 (2006) 114105 [hal-00180163 - version 1]

Computing electronic structures: a new multiconfiguration approach for excited states Cancès E., Galicher H., Lewin M. Journal of Computational Physics 212 (2006) 73--98 [hal-00093538 - version 1]

Optimisation numérique et contrôle optimal : applications en chimie moléculaire Ben Haj Yedder A. Ecole des Ponts ParisTech (2002-12-13), Le Bris Claude (Dir.) [tel-00005677 - version 1]