Hybrid exchange–correlation functionals for van der Waals TiSe2 material: Parametrization versus a posteriori D3 dispersion corrections-Reference-Cited by-同舟云学术

Hybrid exchange–correlation functionals for van der Waals TiSe2 material: Parametrization versus a posteriori D3 dispersion corrections

Published:2022-11 Issue: Volume:214 Page:111672
ISSN:0927-0256
Container-title:Computational Materials Science
language:en
Short-container-title:Computational Materials Science

Author:

de Lazaro Sergio Ricardo,Rosa Guilherme Bonifácio,Ribeiro Renan Augusto Pontes,Lacerda Luis Henrique da Silveira,Oliveira Marisa Carvalho de,Longo Elson

Funder

Fundação de Amparo à Pesquisa do Estado de São Paulo

Coordenação de Aperfeiçoamento de Pessoal de Nível Superior

Conselho Nacional de Desenvolvimento Científico e Tecnológico

Fundação Araucária

Publisher

Elsevier BV

Subject

Computational Mathematics,General Physics and Astronomy,Mechanics of Materials,General Materials Science,General Chemistry,General Computer Science

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