Tim Heaton-Burgess, Ph.D. - Publications
Affiliations: | 2009 | Chemistry | Duke University, Durham, NC |
Area:
quantum mechanical simulations of biological systems and nanostructuresYear | Citation | Score | |||
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2010 | Heaton-Burgess T, Yang W. Structural manifestation of the delocalization error of density functional approximations: C(4N+2) rings and C(20) bowl, cage, and ring isomers. The Journal of Chemical Physics. 132: 234113. PMID 20572695 DOI: 10.1063/1.3445266 | 0.462 | |||
2008 | Heaton-Burgess T, Yang W. Optimized effective potentials from arbitrary basis sets. The Journal of Chemical Physics. 129: 194102. PMID 19026040 DOI: 10.1063/1.2982799 | 0.547 | |||
2008 | Heaton-Burgess T, Cohen AJ, Yang W, Davidson ER. Size extensivity of the direct optimized effective potential method. The Journal of Chemical Physics. 128: 114702. PMID 18361596 DOI: 10.1063/1.2877129 | 0.519 | |||
2007 | Bulat FA, Heaton-Burgess T, Cohen AJ, Yang W. Optimized effective potentials from electron densities in finite basis sets. The Journal of Chemical Physics. 127: 174101. PMID 17994801 DOI: 10.1063/1.2800021 | 0.59 | |||
2007 | Heaton-Burgess T, Bulat FA, Yang W. Optimized effective potentials in finite basis sets. Physical Review Letters. 98: 256401. PMID 17678039 DOI: 10.1103/Physrevlett.98.256401 | 0.579 | |||
2007 | Heaton-Burgess T, Ayers P, Yang W. Spin-potential functional formalism for current-carrying noncollinear magnetic systems. Physical Review Letters. 98: 036403. PMID 17358702 DOI: 10.1103/Physrevlett.98.036403 | 0.499 | |||
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