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Thermal Decomposition of NH2OH and Subsequent Reactions: Ab Initio Transition State Theory and Reflected Shock Tube Experiments

机译：NH2OH的热分解及后续反应：从头算过渡态理论与反射激波管实验

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L. B. Harding; B. Ruscic; R. Sivaramakrishnan; N. K. Srinivasan; M. -c. Su; J. V. Michael;
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年度 2009
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1. Thermal Decomposition of NH_2OH and Subsequent Reactions: Ab Initio Transition StateTheory and Reflected Shock Tube Experiments [J] . S. J. Klippenstein, L. B. Harding, B. Ruscic, The journal of physical chemistry, A. Molecules, spectroscopy, kinetics, environment, & general theory . 2009,第38期

机译：NH_2OH的热分解及后续反应：从头算过渡态理论和反射激波管实验
2. Rate Constants for the Thermal Decomposition of Ethanol and Its Bimolecular Reactions with OH and D: Reflected Shock Tube and Theoretical Studies [J] . R. Sivaramakrishnan, M.-C. Su, J. V. Michael, The journal of physical chemistry, A. Molecules, spectroscopy, kinetics, environment, & general theory . 2010,第35期

机译：乙醇的热分解速率常数及其与OH和D的双分子反应：反射激波管和理论研究
3. Reactions of 1-naphthyl radicals with ethylene. Single pulse shock tube experiments, quantum chemical, transition state theory, and multiwell calculations [J] . Lifshitz A, Tamburu C, Dubnikova F The journal of physical chemistry, A. Molecules, spectroscopy, kinetics, environment, & general theory . 2008,第5期

机译：1-萘基与乙烯的反应。单脉冲冲击管实验，量子化学，过渡态理论和多孔计算
4. Thermal decomposition of haloethanols: single pulse shock tube and ab initio studies [C] . B. Rajakumar, K.P.J. Reddy, E. Arunan International Symposium on Shock Waves; 20040711-16; Beijing(CN) . 2004

机译：卤代乙醇的热分解：单脉冲激波管和从头算研究
5. Shock tube studies of thermal decomposition reactions using ultraviolet absorption spectroscopy. [D] . Oehlschlaeger, Matthew A. 2005

机译：使用紫外线吸收光谱对热分解反应进行冲击管研究。
6. Comparison of Free Energy Surfaces Calculations from Ab Initio Molecular Dynamic Simulations at the Example of Two Transition Metal Catalyzed Reactions [O] . Marc Brüssel, Philipp J. di Dio, Kilian Muñiz, 2011

机译：在两个过渡金属催化反应实例中从头算分子动力学模拟计算自由能表面的比较
7. Thermal Decomposition of 2-Fluoroethanol: Single Pulse Shock Tube and ab Initio Study [O] . -1

机译：2-氟乙醇的热分解：单脉冲冲击管和AB INITIO研究
8. Ab Initio Calculations for Some Decomposition Reactions of 1-Nitro-1-Propene. 1. Characterization of Reactant and Product States; Energetics [R] . Turner, A. G. 1986

机译：1-硝基-1-丙烯的一些分解反应的从头计算。 1.反应物和产物状态的表征;能量学

Thermal Decomposition of NH2OH and Subsequent Reactions: Ab Initio Transition State Theory and Reflected Shock Tube Experiments

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