Computational Study of Analogues of the Uranyl Ion Containing the −NUN− Unit: Density Functional Theory Calculations on UO22+, UON+, UN2, UO(NPH3)3+, U(NPH3)24+, [UCl4{NPR3}2] (R = H, Me), and [UOCl4{NP(C6H5)3}]--Reference-Cited by-同舟云学术

Computational Study of Analogues of the Uranyl Ion Containing the −NUN− Unit: Density Functional Theory Calculations on UO22+, UON+, UN2, UO(NPH3)3+, U(NPH3)24+, [UCl4{NPR3}2] (R = H, Me), and [UOCl4{NP(C6H5)3}]-

Published:2000-11-28 Issue:26 Volume:39 Page:6009-6017
ISSN:0020-1669
Container-title:Inorganic Chemistry
language:en
Short-container-title:Inorg. Chem.

Author:

Kaltsoyannis Nikolas¹

Affiliation:

1. Department of Chemistry, University College London, 20 Gordon Street, London WC1H 0AJ, U.K.

Publisher

American Chemical Society (ACS)

Subject

Inorganic Chemistry,Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/ic000891b

Reference47 articles.

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

2. Density functional calculations on actinide compounds: Survey of recent progress and application to [UO2X4]2? (X=F, Cl, OH) and AnF6 (An=U, Np, Pu)

3. Relativistic effects in structural chemistry

4. Relativistic effects in inorganic and organometallic chemistry

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