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Updated: Jul 19, 2026

High Resolution Phonon-assisted Quasi-resonance Fluorescence Spectroscopy
10:40

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デロカライズされたディニトロアロマティックラジカルアニオンの光学スペクトルが再検討された

Stephen F Nelsen1, Michael N Weaver, Jeffrey I Zink

  • 1Department of Chemistry, University of Wisconsin, 1101 University Avenue, Madison, Wisconsin 53706-1396, USA. nelsen@chem.wisc.edu

Journal of the American Chemical Society
|July 28, 2005
PubMed
まとめ

光学スペクトルは,9つのディニトロアロマティックラジカルアニオンで非局所的な電荷を明らかにします. UB3LYPの計算は電子トランジションを正確に予測し,これらの化合物のTD-DFTを上回ります.

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