The mechanism of the reduction of [AnO2]2+ (An = U, Np, Pu) in aqueous solution, and by Fe(ii) containing proteins and mineral surfaces, probed by DFT calculations-Reference-Cited by-同舟云学术

The mechanism of the reduction of [AnO2]2+ (An = U, Np, Pu) in aqueous solution, and by Fe(ii) containing proteins and mineral surfaces, probed by DFT calculations

Published:2011 Issue:42 Volume:40 Page:11156
ISSN:1477-9226
Container-title:Dalton Transactions
language:en
Short-container-title:Dalton Trans.

Author:

Sundararajan Mahesh,Assary Rajeev S.,Hillier Ian H.,Vaughan David J.

Publisher

Royal Society of Chemistry (RSC)

Subject

Inorganic Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2011/DT/C1DT10700C

Reference35 articles.

1. The geometric structures, vibrational frequencies and redox properties of the actinyl coordination complexes ([AnO2(L)n]m; An = U, Pu, Np; L = H2O, Cl−, CO32−, CH3CO2−, OH−) in aqueous solution, studied by density functional theory methods

2. Ab Initio Quantum Chemical Calculations on Uranyl UO22+, Plutonyl PuO22+, and Their Nitrates and Sulfates

3. Density functional theory investigation of the geometric and electronic structures of [UO2(H2O)m(OH)n]2−n(n + m = 5)

4. Theoretical Actinide Molecular Science

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