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Cover Feature: Isoprene Reactivity on Water Surfaces from ab initio QM/MM Molecular Dynamics Simulations (ChemPhysChem 20/2020)
ChemPhysChem ( IF 2.9 ) Pub Date : 2020-10-19 , DOI: 10.1002/cphc.202000813
Marilia T. C. Martins‐Costa 1 , Manuel F. Ruiz‐López 1
Affiliation  

The Cover Feature illustrates the adsorption of isoprene, a common volatile organic compound produced by many plants, on the surface of a cloud water droplet. Reactivity on water is shown to be different from reactivity in the gas phase thanks to combined quantum/classical molecular dynamics simulations. More information can be found in the Article by Marilia T. C. Martins‐Costa and Manuel F. Ruiz‐López.
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中文翻译:

封面人物:从头开始的QM / MM分子动力学模拟(ChemPhysChem 20/2020),异戊二烯在水表面的反应性

覆盖特征说明了异戊二烯(一种由许多植物产生的常见挥发性有机化合物)在云状水滴表面的吸附。由于结合了量子/经典分子动力学模拟,水的反应性与气相的反应性不同。可以在Marilia T. C. Martins-Costa和Manuel F.Ruiz-López的文章中找到更多信息。
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更新日期:2020-10-19
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