Relativistic effects on the electronic structure and chemical bonding of UF6-Reference-Cited by-同舟云学术

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Relativistic effects on the electronic structure and chemical bonding of UF6

Published:1993-11 Issue:9 Volume:99 Page:6810-6817
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

Onoe Jun,Takeuchi Kazuo,Nakamatsu Hirohide,Mukoyama Takeshi,Sekine Rika,Kim Bong‐Il,Adachi Hirohiko

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.465824

Reference30 articles.

1. Relativistic Quantum Chemistry

2. The electronic structure of actinide-containing molecules: a challenge to applied quantum chemistry

3. Discrete-variational Dirac-Slater calculation on XPS for the valence levels of UF6

4. Theoretical study on the UV excited states of UF6 using the discrete-variational Dirac—Slater calculation method

5. Theoretical calculations of the electronic structure and optical transitions of UF6 and UF5

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1. Inter-configuration fluctuation for 5f electrons in uranium hexafluoride: A many-body study;Computational and Theoretical Chemistry;2023-02

2. Mixed 5f atomic configurations in two polymorphic forms of uranium pentafluoride;Chemical Physics Letters;2022-01

3. Revisiting UF6, NpF6 and PuF6 for bonding and molecular surface analysis within density functional theory: Comparative study at the different theory levels with the same basis set;Polyhedron;2021-11

4. Charge densities in actinide compounds: strategies for data reduction and model building;IUCrJ;2019-08-07

5. Probing the electronic structures of low oxidation-state uranium fluoride molecules UFx− (x = 2−4);The Journal of Chemical Physics;2013-12-28

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