Jerry L. Whitten
Affiliations: | North Carolina State University, Raleigh, NC |
Area:
Condensed Matter PhysicsGoogle:
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Publications
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Whitten JL. (2022) Correction of residual errors in configuration interaction electronic structure calculations. The Journal of Chemical Physics. 157: 124101 |
Whitten JL. (2020) Estimates of electron correlation based on density expansions. The Journal of Chemical Physics. 153: 244103 |
Whitten JL. (2019) Prediction of many-electron wavefunctions using atomic potentials: extended basis sets and molecular dissociation. Physical Chemistry Chemical Physics : Pccp. 21: 21541-21548 |
Whitten JL. (2019) Prediction of many-electron wavefunctions using atomic potentials: Refinements and extensions to transition metals and large systems. Journal of Chemical Physics. 150: 34107 |
Whitten JL. (2019) Prediction of many-electron wavefunctions using atomic potentials: extended basis sets and molecular dissociation Physical Chemistry Chemical Physics. 21: 21541-21548 |
Nazari F, Whitten JL. (2017) Prediction of many-electron wavefunctions using atomic potentials Journal of Chemical Physics. 146: 194109-194109 |
Whitten JL. (2017) Electron correlation by polarization of interacting densities Journal of Chemical Physics. 146: 64113 |
Papas BN, Whitten JL. (2016) Adsorption of copper on a γ-alumina support Surface Science. 651: 22-27 |
Petsalakis ID, Theodorakopoulos G, Whitten J. (2015) Electronic structure and spectra of (Cu2O)n–H2O complexes Physical Chemistry Chemical Physics. 17: 428-433 |
Papas BN, Petsalakis ID, Theodorakopoulos G, et al. (2014) CI and DFT Studies of the Adsorption of the Nerve Agent Sarin on Surfaces Journal of Physical Chemistry C. 118: 23042-23048 |