Spin density in the CoCl42− ion

G.S. Chandler; R. Phillips

doi:10.1016/0009-2614(80)80532-X

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Journal article

Peer reviewed

Spin density in the CoCl42− ion

G.S. Chandler and R. Phillips

Chemical Physics Letters, Vol.75(2), pp.363-369

1980

DOI: https://doi.org/10.1016/0009-2614(80)80532-X

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Abstract

Unrestricted and restricted Hartree-Fock calculations for the tetrachlorocobaltate(II) ion ICoCl42−) are presented. The spin density distributions from these calculations are compared with polarized neutron diffraction results through spin density plots and a population analysis.

Details

Title: Spin density in the CoCl42− ion
Authors/Creators: G.S. Chandler (Author/Creator) - The University of Western Australia
R. Phillips (Author/Creator) - The University of Western Australia
Publication Details: Chemical Physics Letters, Vol.75(2), pp.363-369
Publisher: Elsevier
Identifiers: 991005540112007891
Murdoch Affiliation: Murdoch University
Language: English
Resource Type: Journal article

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Citation topics: 2 Chemistry; 2.78 Photoluminescence; 2.78.1575 Crystal- And Ligand-Field Theory
Web Of Science research areas: Chemistry, Physical; Physics, Atomic, Molecular & Chemical
ESI research areas: Chemistry