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Updated: May 15, 2025

Isolating Free Carbenes, their Mixed Dimers and Organic Radicals
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Isolating Free Carbenes, their Mixed Dimers and Organic Radicals

Published on: April 19, 2019

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乙烯基基离子和中性的激发电子状态之间的关系-一个计算分析

Anna M Weidlich1, Andreas Dreuw1

  • 1Interdisciplinary Center for Scientific Computing, Ruprecht-Karls University, Heidelberg, Germany.

Journal of computational chemistry
|April 8, 2025
PubMed
概括

本研究使用先进的计算方法研究了乙烯基离子基的电子吸收光谱. 研究结果表明,这些的兴奋状态类似于中性,但包括单独占用的分子轨道激发的新状态.

关键词:
这是一个ADCADC ADC.亚酸是一种酸盐.兴奋的状态 兴奋的状态开放外系统是一个开放外系统.激进的化物.

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