Proton transfer reaction

The Proton Transfer Reaction in the Binary Cluster of Ammonia and Methanol

氨和甲醇团簇中的质子转移反应

A Theoretical Study of Excited-State Proton Transfer Reaction of Salicylic Acid and Its Solvent Effect

水杨酸激发态质子转移反应及其溶剂效应的理论研究

Their hydrolysis constant and degree of hydrolysis are calculated by free energy change of proton transfer reaction .

用其质子传递反应的自由能变，计算了水解常数和水解度。

Study on detection of benzene in water using proton transfer reaction mass spectrometry with a glow discharge ion source

辉光放电离子源质子转移反应质谱对水中苯的分析方法研究

A Theoretical Study of Proton Transfer Reaction and Spectroscopic Properties of 2 - ( 2 ' - Hydroxyphenyl ) benzoimidazoIe

2-（2′-羟基苯基）苯并咪唑的质子转移反应和光谱性质的理论研究

All the re - sults show that the water-assisted proton transfer reaction of 2-hydroxyimidazole could occur easily in gas phase and water and they could be observed easily experimentally .

综合气相和水相的计算结果，2-羟基咪唑水助催化的质子迁移反应较易进行，且在水溶液中进行容易，可以很容易被实验观察到。

Potential energy profile and tunnel effect correction were obtained by using this sophisticated energy profile . The rate constant of this proton transfer reaction was calculated to be 7.4 × 10 ~ ( 11 ) s ( - 1 ) .

根据从以上计算结果拟合的抛物线势，求出质子转移的隧道效应校正系数为19.9，然后由过渡状态理论计算了此反应的比速常数为7.4×10~（11）s~（-1）。

MO can increase the burning rate of GAP / AN propellant due to promoting the proton transfer reaction of AN decomposition . The burning rate modifier MO is an effective material to increase the burning rate and decrease burning rate pressure exponent of GAP / AN propellant .

用热分析方法筛选出了GAP／AN推进剂有效的燃速调节剂MO，它能促进硝酸铵热分解过程中质子转移反应，因而使GAP／AN推进剂燃速提高。

The whole process of the polymerization included nucleophilic addition , proton transfer and step reaction polymerization .

整个过程为亲核加成-质子转移-逐步聚合过程。

The calculated results revealed that the most energetically favorable path is channel b4 and suggested that the water molecule plays as a proton transfer intermediate in the reaction .

计算结果表明路径b4是最优的反应通道，并且水分子在反应过程中起到的质子转移媒介的作用。