array(1) { ["lab"]=> string(4) "1074" } Molecular Reaction Dynamics by Theory | 论文 | 重庆大学 | LabXing

Molecular Reaction Dynamics by Theory

简介 Dynamics/Spectroscopy/Kinetics/Mechanisms

大学 重庆大学 / 化学化工学院
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Tunneling Facilitated Dissociation toH+CO2inHOCO−Photodetachment

2012
期刊 Physical Review Letters
作者 Jianyi Ma · Jun Li · Hua Guo

A theoretical search for stable bent and linear structures of low-lying electronic states of the titanium dioxide (TiO2) molecule

2011
期刊 RSC Advances

Computational Study of the Reaction Mechanism of the Methylperoxy Self-Reaction

2011
期刊 The Journal of Physical Chemistry A

Experiment and kinetics simulation on the pyrolysis of n-decane

2011
期刊 Acta Physico-Chimica Sinica 有全文

Pyrolysis mechanism of hydrocarbon fuels and kinetic modeling

2010
期刊 Acta Chimica Sinica 有全文

Symmetry forbidden vibronic spectra and internal conversion in benzene

2010
期刊 Physical Chemistry Chemical Physics

Unimolecular decomposition mechanism of vinyl alcohol by computational study

2010
期刊 Theoretical Chemistry Accounts

Solvent reorganization energy of electron transfer by a modified ellipsoidal cavity model

2007
期刊 Journal of Molecular Structure: THEOCHEM
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