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Updated: Aug 16, 2025

Excitonic Hamiltonians for Calculating Optical Absorption Spectra and Optoelectronic Properties of Molecular Aggregates and Solids
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Ground- and Excited-State Dipole Moments and Oscillator Strengths of Full Configuration Interaction Quality

Yann Damour1, Raúl Quintero-Monsebaiz1, Michel Caffarel1

  • 1Laboratoire de Chimie et Physique Quantiques (UMR 5626), Université de Toulouse, CNRS, UPS, 31062 Toulouse, France.

Journal of Chemical Theory and Computation
|December 22, 2022
PubMed

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