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Extensive theoretical study on electronically excited states and predissociation mechanisms of sulfu
期刊名称:Journal of Computational Chemistry
时间:0
页码:1577-1588
语言:英文
相关项目:基于化学反应高维、耦合势能面的态-态动力学
作者:
Bian Wensheng|Yu Le|
同期刊论文项目
基于化学反应高维、耦合势能面的态-态动力学
期刊论文 29
会议论文 13
同项目期刊论文
化学反应的高精度从头算势能面
Anharmonic RRKM Calculation for the Dissociation of (H2O)(2)H+ and Its Deuterated Species (D2O)(2)D+
Double Ionization of Nitrogen from Multiple Orbitals
Photodissociation and photoisomerization dynamics of CH2=CHCHO in solution
Efficient quantum calculation of the vibrational states of acetylene
A theoretical study on the reaction mechanisms of O(3P)+l-butene
Competitive reaction pathways of C2Cl3 + NO via four-membered ring and bicyclic ring intermediates
Kinetic study on the H+SiH4 abstraction reaction using an ab initio potential energy surface
New ab Initio Potential Energy Surfaces for the Renner-Teller Coupled 1 1 A' and 1 1 A'' States of C
Photodissociation of acryloyl chloride in the gas phase
丙烯酰氯分子的气相光解动力学
Accurate Quantum Dynamics Study on the Resonance Decay of Vinylidene
Accurate quantum mechanical study of the Renner-Teller effect in the singlet CH2
Quasiclassical trajectory study of the SiH4+H -> SiH3+H-2 reaction on a global 12-dimensional ab
Reaction Mechanisms of C2Cl3 + NO2 via Nitro and Nitrite Adducts
Reaction of C2HCl2+O2: Combined TR-FTIR Spectroscopy and Electronic Structure
Reaction Mechanisms of a Photo-Induced [1,3] Sigmatropic Rearrangement via a Nonadiabatic Pathway
Adiabatic and Nonadiabatic Reaction Pathways of the O(3P) with Propyne
Reaction of C2HCl2+O-2: Combined TR-FTIR Spectroscopy and Electronic Structure
Time-Resolved FTIR Study on the Reaction of CHCl2 with NO2
Full-dimensional quantum dynamics study of vinylidene-acetylene isomerization: A scheme using the no