A perturbation-method-based post-processing for the planewave discretization of Kohn

A perturbation-method-based post-processing for the planewave discretization of Kohn–Sham models

Published:2016-02 Issue: Volume:307 Page:446-459
ISSN:0021-9991
Container-title:Journal of Computational Physics
language:en
Short-container-title:Journal of Computational Physics

Author:

Cancès Eric,Dusson Geneviève,Maday Yvon,Stamm Benjamin,Vohralík Martin

Funder

French National Research Agency

Investissements d'avenir program

ANR

Publisher

Elsevier BV

Subject

Computer Science Applications,Physics and Astronomy (miscellaneous),Applied Mathematics,Computational Mathematics,Modelling and Simulation,Numerical Analysis

Reference20 articles.

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4. Computational quantum chemistry: a primer;Cancès,2003

5. E. Cancès, G. Dusson, Y. Maday, B. Stamm, M. Vohralík, On the use of the perturbation method in planewave numerical simulations of linear and non linear Schrödinger equations, in preparation.

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