个人简介
M.B.A. Coursework Business Administration University of Oklahoma, Michael Price College of Business 1998-1999
Ph.D. Chemical Physics University of Minnesota 1995
B.S. Chemistry Eastern Washington University 1990
研究领域
Physical
Computational Chemistry
Research in the Wilson group focuses on the development and understanding of computational chemistry methodology and the application of this methodology to examine interesting problems in a wide range of areas including materials science, transition metal chemistry, and environmental chemistry.
近期论文
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“Low Valency in the Lanthanides: a Theoretical Study of LnF (Ln=Nd, Lu)”, George Schoendorff and Angela K. Wilson, J. Chem. Phys., accepted (5/27/14).
“MR-ccCA: A Route for Accurate Ground and Excited State Potential Energy Curves and Spectroscopic Properties for Third-Row Molecules”, Christopher South and Angela K. Wilson, Comp. Theor. Chem., DOI: 10.1016/j.comptc.2014.04.013. (invited)
"High Potential Perfluorinated Phthalocyanine-Fullerene Dyads: Formation and Photoinduced Electron Transfer Studies”, Sushanta K. Das, Andrew Mahler, Angela K. Wilson, and Francis D’Souza, ChemPhysChem, DOI: 10.1002/cphc.201402118.
“Computational Studies of Xenopus Laevis Inhibitor of kappaB Kinase-Beta”, Michael Jones, Cong Liu, and Angela K. Wilson, J. Chem. Info. Mod., 54, 562 (2014).
“Electron Transfer Studies of High Potential Zinc Porphyrin-fullerene Supramolecular Dyads”, Sushana K. Das, Baiyun Song, Andrew Mahler, Vladimir Nesterov, Angela K. Wilson, Osama Ito, and Francis D’Souza, J. Phys. Chem. C, 118, 3994 (2014).
“Solv-ccCA: Implicit Solvation and the correlation consistent Composite Approach for the Determination of pKa”, Amanda G. Riojas and Angela K. Wilson, J. Chem. Theor. Comput., 10, 1500 (2014).
“Explicitly Correlated Methods within the ccCA Methodology”, Andrew Mahler and Angela K. Wilson, J. Chem. Theor. Chem., 9, 1402 (2013).
“Spectroscopic Properties of Arx-Zn and Arx-Ag+ (x=1,2) van der Waals complexes”, Gbenga A. Oyedepo, Charles Peterson, and Angela K. Wilson, J. Chem. Phys., 138, 104116 (2013).
“Bonding Properties of Selenium-Carbon Complexes: Computational Modeling of H3CSEH, H2CSe, HOCSeH, H2CSeO, SeC, and HCSeOH”, John J. Determan and Angela K. Wilson, Comp. Theor. Chem., 1017, 41 (2013).
“C-O Bond Cleavage of Dimethyl Ether by Transition Metal Ions: A Systematic Study on Catalytic Properties of Metals and Performance of DFT Functionals”, Cong Liu, Charles Peterson, and Angela K. Wilson, J. Phys. Chem. A, 117, 5140 (2013).
“Complete Basis Set Limits of Local Second-Order Møller-Plesset Perturbation Theory”, Kameron R. Jorgensen, Vinay V. Ramasesh, Sonja Hannibal, Nathan J. DeYonker, and Angela K. Wilson, Mol. Phys., 111, 1178-1189 (2013).
“Cooperative Carbon Capture Capabilities in Multivariate MOFs Decorated with Amino Acid Side Chains: A Computational Study”, Michael L. Drummond, Thomas R. Cundari, and Angela K. Wilson, J. Phys. Chem., 117, 14717-14722 (2013). DOI: 10.1021/jp4053538.
“Performance of Density Functional Theory for Second Row (4d) Transition Metal Thermochemistry”, Marie Laury and Angela K. Wilson, J. Chem. Theor. Comp., 9, 3939-3946 (2013).
“A Neoteric Neodymium Model: Electronic Ground and Excited State Analysis of NdF2+”, George Schoendorff, Christopher South, and Angela K. Wilson, J. Phys. Chem. A, 117, 10881-10888 (2013). (cover article)
“Periodic Trends in 3d Metal Mediated CO2 Activation”, Cong Liu, Thomas R. Cundari, and Angela K. Wilson, in Applications of Molecular Modeling to Challenges in Clean Energy, Ed. George Fitzgerald, Chap. 5, pg. 67-88, 2013, (ACS Symposium Series, 2013).
"Toward Accurate Theoretical Thermochemistry of First Row Transition Metal Complexes", Wanyi Jiang, Nathan DeYonker, John Determan, and Angela K. Wilson, J. Phys. Chem. A 116, 870 (2012). (cover article)
"Multireference Character for 3d Transition Metal-Containing Molecules", Wanyi Jiang, Nathan DeYounker, and Angela K. Wilson, J. Chem. Theor. Comp. 8, 460 (2012). (cover article)
"The Importance of Secondary Structure in Determining CO2-Protein Binding Patterns", Michael L. Drummond, Angela K. Wilson, and Thomas R. Cundari, J. Mol. Mod. 18, 2527 (2012).
"CO2 Reduction on Transition Metal (Fe, Co, Ni, and Cu) Surfaces: In Comparison with Homogeneous Catalysis", Cong Liu, Thomas R. Cundari, and Angela K. Wilson, J. Phys. Chem. C 116, 5681 (2012).
"Carbon Dioxide Migration Pathways in Proteins", Michael L. Drummond, Angela K. Wilson, and Thomas R. Cundari, J. Phys. Chem. Lett. 3, 830 (2012).