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Updated: Apr 28, 2026

Excitonic Hamiltonians for Calculating Optical Absorption Spectra and Optoelectronic Properties of Molecular Aggregates and Solids
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Modeling Triplet Excited-State Energy Transfer (TEET) via Multistate Density Functional Theory with Nonorthogonal

Jiali Gao1,2,3, Kai Chen1, Chenyu Liu1

  • 1Department of Chemistry and Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota55455, United States.

Journal of Chemical Theory and Computation
|April 27, 2026
PubMed

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