화학공학소재연구정보센터
검색결과 : 93건
No. Article
1 Theoretical Study of Gas-Phase Unimolecular Decomposition of Simulants of the Nerve Agent VX
Shan X, Sambrook MR, Clary DC
Journal of Physical Chemistry A, 123(1), 59, 2019
2 New Developments in Semiclassical Transition-State Theory
Shang X, Burd TAH, Clary DC
Journal of Physical Chemistry A, 123(22), 4639, 2019
3 Tunnelling and the kinetic isotope effect in CH3 + CH4 -> CH4 + CH3: An application of semiclassical transition state theory
Burd TAH, Shan X, Clary DC
Chemical Physics Letters, 693, 88, 2018
4 A Combined Theoretical and Experimental Study of Sarin (GB) Decomposition at High Temperatures
Shan X, Vincent JC, Kirkpatrick S, Walker MD, Sambrook MR, Clary DC
Journal of Physical Chemistry A, 121(33), 6200, 2017
5 Quantum dynamics in the smallest water droplet
Clary DC
Science, 351(6279), 1268, 2016
6 Reduced-Dimensionality Semiclassical Transition State Theory: Application to Hydrogen Atom Abstraction and Exchange Reactions of Hydrocarbons
Greene SM, Shan X, Clary DC
Journal of Physical Chemistry A, 119(50), 12015, 2015
7 Quantum Dynamics of the Abstraction Reaction of H with Cyclopropane
Shan X, Clary DC
Journal of Physical Chemistry A, 118(43), 10134, 2014
8 Crossed-beam and reduced dimensionality studies of the state-to-state integral cross sections of the Cl + HCD3(v) -> HCl(v') + CD3 reaction
Shan X, Remmert SM, Clary DC, Zhang BL, Liu KP
Chemical Physics Letters, 587, 88, 2013
9 Historical perspective on: "Semiclassical trajectory approach to photoisomerisation" by A Warshel and M. Karplus [Chem. Phys. Lett. 32 (1) (1975) 11-17]
Clary DC
Chemical Physics Letters, 589, 67, 2013
10 100 Years of Atomic Theory
Clary DC
Science, 341(6143), 244, 2013