首页> 外文OA文献 >An investigation of one- versus two-dimensional semiclassical transition state theory for H atom abstraction and exchange reactions

【2h】

An investigation of one- versus two-dimensional semiclassical transition state theory for H atom abstraction and exchange reactions

机译：HATOM抽象和交换反应的二维半半半透转化状态理论的调查

代理获取

本网站仅为用户提供外文OA文献查询和代理获取服务，本网站没有原文。下单后我们将采用程序或人工为您竭诚获取高质量的原文，但由于OA文献来源多样且变更频繁，仍可能出现获取不到、文献不完整或与标题不符等情况，如果获取不到我们将提供退款服务。请知悉。

页面导航

著录项
引文网络
相似文献
相关主题

著录项

作者
Samuel M. Greene; Xiao Shan; David C. Clary;
展开▼
作者单位

展开▼
年度 2016
总页数
原文格式 PDF
正文语种
中图分类

相似文献

外文文献
中文文献
专利

1. An investigation of one-versus two-dimensional semiclassical transition state theory for H atom abstraction and exchange reactions [J] . Greene Samuel M., Shan Xiao, Clary David C. The Journal of Chemical Physics . 2016,第8期

机译：关于氢原子抽象和交换反应的一维二维半经典过渡态理论的研究
2. Reduced-Dimensionality Semiclassical Transition State Theory: Application to Hydrogen Atom Abstraction and Exchange Reactions of Hydrocarbons [J] . Greene Samuel M., Shan Xiao, Clary David C. The journal of physical chemistry, A. Molecules, spectroscopy, kinetics, environment, & general theory . 2015,第50期

机译：降维半经典过渡态理论：在氢原子提取和碳氢化合物交换反应中的应用
3. Computational Kinetics by Variational Transition-State Theory with Semiclassical Multidimensional Tunneling: Direct Dynamics Rate Constants for the Abstraction of H from CH3OH by Triplet Oxygen Atoms [J] . Meana-Paneda Ruben, Xu Xuefei, Ma He, The journal of physical chemistry, A. Molecules, spectroscopy, kinetics, environment, & general theory . 2017,第8期

机译：分析转换状态理论与半透明多维隧道的计算动力学：三联氧原子从CH3OH抽取H的直接动力速率常数
4. Automated transition state theory calculations of abstraction reactions by hydroperoxyl, compared to literature model values [C] . Nathan Harms, Belinda Slakman, Jason Cain, US Combustion Meeting . 2017

机译：与文献模型值相比，水质过渡氧基的自动化转变状态理论计算
5. Energy partitioning in polyatomic chemical reactions: Quantum state resolved studies of highly exothermic atom abstraction reactions from molecules in the gas phase and at the gas-liquid interface. [D] . Zolot, Alexander M. 2009

机译：多原子化学反应中的能量分配：量子态分解研究，涉及气相和气液界面中分子的高度放热原子提取反应。
6. Computational Kinetics by Variational Transition State Theory with Semiclassical Multidimensional Tunneling: Direct Dynamics Rate Constants for the Abstraction of H from CH3OH by Triplet Oxygen Atoms [O] . Rubén Meana-Pañeda, Xuefei Xu, He Ma, -1

机译：基于半经典多维隧穿的变分过渡态理论的计算动力学：三重态氧原子从CH3OH提取H的直接动力学速率常数
7. Direct Combined ab Initio/Transition State Theory Study of the Kinetics of the Abstraction Reactions of Halogenated Methanes with Hydrogen Atoms [O] . -1

机译：直接组合AB初始/过渡状态理论研究卤化甲烷与氢原子的抽象反应动力学
8. Proof of the Absence of Modulated Phase Transition and Spin Density Wave Phase Transition in One- and Two-Dimensional Systems [R] . Ruibao, T., Fucho, P. 1980

机译：一维和二维系统中调制相变和自旋密度波相变的证明

An investigation of one- versus two-dimensional semiclassical transition state theory for H atom abstraction and exchange reactions

著录项

引文网络

相似文献

相关主题

期刊订阅