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Updated: Jun 21, 2025

Excitonic Hamiltonians for Calculating Optical Absorption Spectra and Optoelectronic Properties of Molecular Aggregates and Solids
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纯电双极和混合第一个超极化的三维表示:修改的单元球体表示

Andrea Bonvicini1, Benoît Champagne1

  • 1Theoretical Chemistry Laboratory, Unit of Theoretical and Structural Physical Chemistry, Namur Institute of Structured Matter, University of Namur, Namur, Belgium.

Journal of computational chemistry
|July 11, 2024
PubMed
概括

修改的单元球体表示 (mUSR) 为可视化分子超极化提供了一个新的计算工具. 这种方法增强了对超雷利散射光学活动光谱学中奇拉信号的理解.

关键词:
在HRS中,HRS是HRS.在HRS-OAA中.电动二极管 - 电动二极管电动四极体的电动四极体电磁波是一种电磁波.第一个是超极化性.不能减小的笛卡尔张量.一个磁双极的磁性双极.结构与财产之间的关系.三维表示的三维表示.

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