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Updated: Jun 11, 2025

Excitonic Hamiltonians for Calculating Optical Absorption Spectra and Optoelectronic Properties of Molecular Aggregates and Solids
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Tuning optoelectronic properties of indandione-based D-A materials by malononitrile group acceptors: A DFT and TD-DFT

Pankaj Kumar Kushwaha1, Sunil Kumar Srivastava2

  • 1Department of Physics, School of Physical Sciences, Mahatma Gandhi Central University, Motihari, East Champaran, Bihar, 845401, India.

Journal of Molecular Modeling
|September 30, 2024
PubMed
Abstract

Keywords:
D-A materialsDFTIndandioneMalononitrileOrganic solar cellPCETDM

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