microsolvation相关论文
The reaction mechanism of the aminolysis of alkanesulfmyl chloride (and fluoride) have been investigated theoretically f......
Microsolvated F-(H2O)+CH3I SN2 Reaction Dynamics.An Insight into the Suppressed Formation of Solvate
Microsolvation offers a bottom-up approach to investigate details of how solute-solvent interactions affect chemical......
In order to understand the microsolvation of salts in water,we investigated a series of salt-water clusters using ph......
Single hydration of the gas phase F-+CH3I→ I-+CH3F reaction allows to probe solvent effects on a fundamental nucleophil......
密度功能的理论(DFT ) 计算为中立、两性离子的 glycine-(CH3OH ) 的结构被报导 n 在哪儿 n = 16。有 16 个甲醇分子的中立、两性......
Microsolvation of glycine in methanol clusters is explored by the use of DFT calculation method. The lowest energy confo......
