화학공학소재연구정보센터
검색결과 : 14건
No. Article
1 Quantum Dynamics Study of the C(D-1) + HD Reaction on the (a)over-tilde(1)A ' and (b)over-tilde(1)A '' Potential Energy Surfaces
Wu YN, Cao JW, Bian WS
Journal of Physical Chemistry A, 124(5), 801, 2020
2 Efficient Quantum Mechanical Calculations of Mode-Specific Tunneling Splittings upon Fundamental Excitation in the Dimer of Formic Acid
Liu H, Cao JW, Bian WS
Journal of Physical Chemistry A, 124(32), 6536, 2020
3 Quasiclassical Trajectory Study of the C(D-1) + H-2 -> CH plus H Reaction on a New Global ab Initio Potential Energy Surface
Wu Y, Zhang CF, Cao JW, Bian WS
Journal of Physical Chemistry A, 118(24), 4235, 2014
4 The Effect of Explicit Solvent on Photodegradation of Decabromodiphenyl Ether in Toluene: Insights from Theoretical Study
Pan L, Bian WS, Zhang JX
Journal of Physical Chemistry A, 117(25), 5291, 2013
5 Extensive Theoretical Study on Various Low-Lying Electronic States of Silicon Monochloride Cation Including Spin-Orbit Coupling
Liu K, Yu L, Bian WS
Journal of Physical Chemistry A, 113(9), 1678, 2009
6 A theoretical study of the reaction of O(P-3) with isobutene
Zhao HM, Bian WS, Liu K
Journal of Physical Chemistry A, 110(25), 7858, 2006
7 Theoretical study of rate constants and kinetic isotope effects for reactions in the ClH2 system using variational transition state theory
Wang MH, Bian WS
Chemical Physics Letters, 391(4-6), 354, 2004
8 Accurate and highly efficient calculation of the highly excited pure OH stretching resonances of O(D-1)HCl, using a combination of methods
Bian WS, Poirier B
Journal of Chemical Physics, 121(10), 4467, 2004
9 Theoretical investigation of the reaction of Co+ with OCS
Liu CB, Zhang DJ, Bian WS
Journal of Physical Chemistry A, 107(41), 8618, 2003
10 Theoretical study of the reactivity of Fe+ toward OCS
Zhang DJ, Liu CB, Bian WS
Journal of Physical Chemistry A, 107(42), 8955, 2003