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Updated: Jan 16, 2026

Excitonic Hamiltonians for Calculating Optical Absorption Spectra and Optoelectronic Properties of Molecular Aggregates and Solids
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对RbHe电子激发状态的理论研究

A Lecoeur1, E Hochard1, J Douady1

  • 1Normandie Univ, ENSICAEN, UNICAEN, CEA, CNRS, CIMAP, UMR 6252, BP 5133, F-14070 Caen Cedex 05, France. gervais@ganil.fr.

Physical chemistry chemical physics : PCCP
|January 15, 2026
PubMed
概括

初始模型核心极化潜力 (AIM-CPP) 准确地预测了RbHe分子的电子状态和潜在能量曲线. 这种计算方法显示了对研究分子激发状态和ro-振动性质的可靠性.

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