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Updated: Jul 18, 2025

Vibrational Spectra of a N719-Chromophore/Titania Interface from Empirical-Potential Molecular-Dynamics Simulation, Solvated by a Room Temperature Ionic Liquid
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Vibrational Spectra of a N719-Chromophore/Titania Interface from Empirical-Potential Molecular-Dynamics Simulation, Solvated by a Room Temperature Ionic Liquid

Published on: January 25, 2020

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NCCN-H2碰撞的4D潜在能量表面:在星际温度下p-H2和o-H2的旋转动力学

Apoorv Kushwaha1, T J Dhilip Kumar1

  • 1Quantum Dynamics Lab, Department of Chemistry Indian Institute of Technology Ropar, Rupnagar 140001, India.

The Journal of chemical physics
|August 21, 2023
PubMed
概括

这项研究计算了NCCN与 (H2) 分子相碰撞的旋转激发率. 奥托-H2 (o-H2) 碰撞的发生率高于对H2 (p-H2) 碰撞的发生率,其近似值与准确计算有很大差异.

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