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Updated: Aug 26, 2026

Excitonic Hamiltonians for Calculating Optical Absorption Spectra and Optoelectronic Properties of Molecular Aggregates and Solids
08:04

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

Published on: May 27, 2020

Electron localization functions obtained from X-ray constrained Hartree-Fock wavefunctions for molecular crystals of

Dylan Jayatilaka1, Daniel Grimwood

  • 1Chemistry, School of Biomedical and Chemical Sciences, University of Western Australia, Crawley 6009, Australia. dylan@theochem.uwa.edu.au

Acta Crystallographica. Section A, Foundations of Crystallography
|February 18, 2004
PubMed

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