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Updated: Jul 6, 2025

Developing Photosensitizer-Cobaloxime Hybrids for Solar-Driven H2 Production in Aqueous Aerobic Conditions
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4a,4b-二二 → cis-stilbene光转换:TD-DFT/DFT研究中的一个.

Elizaveta V Savchenko1, Victor V Kostjukov2

  • 1Sevastopol State University, Universitetskaya Str., 33, Sevastopol, 299053, Crimea, Ukraine.

Journal of molecular modeling
|January 6, 2024
PubMed
概括

乙甲素 (DHP) 转化为碳基基基物种 (CS) 的光转化揭示了为什么C4a-C4b键不能重构. 增加的库伦排斥和不足的电子结合在CS放松过程中阻止了结合回收.

关键词:
4a,4b-二二二二二二二二二二二二二二二二二二二二二二二二二二二二二二二二二二二二二二二二二这是一种Cis-stilbene.电子密度 电子密度 电子密度照片转换 照片转换放松 放松 放松这是TD-DFTT.

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