Density Functional Studies on the Complexation and Spectroscopy of Uranyl Ligated with Acetonitrile and Acetone Derivatives-Reference-Cited by-同舟云学术

Density Functional Studies on the Complexation and Spectroscopy of Uranyl Ligated with Acetonitrile and Acetone Derivatives

Published:2009-07-02 Issue:45 Volume:113 Page:12525-12531
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Schoendorff George¹,Windus Theresa L.¹,de Jong Wibe A.¹

Affiliation:

1. Department of Chemistry, Iowa State University and Ames Laboratory, Ames Iowa 50011, and Environmental Molecular Sciences Laboratory, Pacific Northwest National Laboratory, P.O. Box 999, Richland, Washington 99352

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp9038623

Reference36 articles.

1. Theoretical Studies of the Properties and Solution Chemistry of AnO22+ and AnO2+ Aquo Complexes for An = U, Np, and Pu

2. Solvent Effects on Uranium(VI) Fluoride and Hydroxide Complexes Studied by EXAFS and Quantum Chemistry

3. Role of Solvation in the Reduction of the Uranyl Dication by Water: A Density Functional Study

4. Hydration of UO22+ and PuO22+

5. Theoretical Gibbs free energy study on UO2(H2O)n2+ and its hydrolysis products

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