화학공학소재연구정보센터
검색결과 : 16건
No. Article
1 Sampling Phase Space Dividing Surfaces Constructed from Normally Hyperbolic Invariant Manifolds (NHIMs)
Ezra GS, Wiggins S
Journal of Physical Chemistry A, 122(42), 8354, 2018
2 Empirical Classification of Trajectory Data: An Opportunity for the Use of Machine Learning in Molecular Dynamics
Carpenter BK, Ezra GS, Farantos SC, Kramer ZC, Wiggins S
Journal of Physical Chemistry B, 122(13), 3230, 2018
3 Toward Understanding the Roaming Mechanism in H plus MgH -> Mg plus HH Reaction
Mauguiere FAL, Collins P, Stamatiadis S, Li A, Ezra GS, Farantos SC, Kramer ZC, Carpenter BK, Wiggins S, Guo H
Journal of Physical Chemistry A, 120(27), 5145, 2016
4 Reaction Path Bifurcation in an Electrocyclic Reaction: Ring-Opening of the Cyclopropyl Radical
Kramer ZC, Carpenter BK, Ezra GS, Wiggins S
Journal of Physical Chemistry A, 119(25), 6611, 2015
5 Multiple transition states and roaming in ion-molecule reactions: A phase space perspective
Mauguiere FAL, Collins P, Ezra GS, Farantos SC, Wiggins S
Chemical Physics Letters, 592, 282, 2014
6 Quantum state reconstruction for rigid rotors
Deshpande SA, Ezra GS
Chemical Physics Letters, 440(4-6), 341, 2007
7 Semiclassical IVR approach to rotational excitation of non-polar diatomic molecules by non-resonant laser pulses
Arango CA, Kennerly WW, Ezra GS
Chemical Physics Letters, 420(4-6), 296, 2006
8 Quantum monodromy for diatomic molecules in combined electrostatic and pulsed nonresonant laser fields
Arango CA, Kennerly WW, Ezra GS
Chemical Physics Letters, 392(4-6), 486, 2004
9 Semiclassical calculation of the vibrational echo
Noid WG, Ezra GS, Loring RF
Journal of Chemical Physics, 120(3), 1491, 2004
10 Vibrational echoes: Dephasing, rephasing, and the stability of classical trajectories
Noid WG, Ezra GS, Loring RF
Journal of Physical Chemistry B, 108(21), 6536, 2004