Modeling exact exchange potential in spherically confined atoms

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Excitonic Hamiltonians for Calculating Optical Absorption Spectra and Optoelectronic Properties of Molecular Aggregates and Solids
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Excitonic Hamiltonians for Calculating Optical Absorption Spectra and Optoelectronic Properties of Molecular Aggregates and Solids

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Sergei F Vyboishchikov1

  • 1Departament de Química, Institut de Química Computacional i Catàlisi, Universitat de Girona, 17071, Girona, Spain.

Journal of Computational Chemistry
|August 11, 2015
PubMed

Keywords:
Hartree-Fock theoryconfined atomsdensity-functional theoryelectron densityexact exchange

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