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Updated: May 12, 2025

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无处不在的振动特征的量子性质揭示了乙烯糖醇的量子性质

Apurba Nandi1, Riccardo Conte2, Priyanka Pandey3

  • 1Department of Physics and Materials Science, University of Luxembourg, L-1511 Luxembourg City, Luxembourg.

Journal of chemical theory and computation
|May 7, 2025
PubMed
概括

乙烯基醇的量子振动计算显示,精确的光谱分析,特别是OH和CH延伸,需要先进的量子方法,而不是更简单的近似方法.

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When Infrared (IR) radiation passes through a covalently bonded molecule, the bonds transition from lower to higher vibrational levels. The fundamental vibrational motions that result in infrared absorption can be classified as stretching or bending vibrations.
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