Effects of All-Electron Basis Sets and the Scalar Relativistic Corrections in the Structure and Electronic Properties of Niobium Clusters
Author:
Affiliation:
1. Departamento de Física, Universidade Federal do Espírito Santo, 29075-910 Vitória, Brazil
2. Departamento de Física, Universidade Federal de Roraima, 69310-000 Boa Vista, Brazil
Funder
Funda??o Estadual de Amparo ? Pesquisa do Estado do Esp?rito Santo
Coordena??o de Aperfei?oamento de Pessoal de N?vel Superior
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.7b04600
Reference43 articles.
1. Density-functional study of niobium clusters
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3. Structural characterization of niobium-cluster anions from density-functional calculations
4. Many low-lying isomers of the cationic and neutral niobium trimer and tetramer
5. Atomic and electronic structures of niobium clusters
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