دنبال کردن
Sophya Garashchuk
Sophya Garashchuk
رابطه نامشخص
ایمیل تأیید شده در chem.sc.edu
عنوان
نقل شده توسط
نقل شده توسط
سال
Semiclassical calculation of chemical reaction dynamics via wavepacket correlation functions
DJ Tannor, S Garashchuk
Annual Review of Physical Chemistry 51 (1), 553-600, 2000
1232000
Wave packet correlation function approach to H2 (ν)+ H→ H+ H2 (ν′): semiclassical implementation
S Garashchuk, D Tannor
Chemical physics letters 262 (3-4), 477-485, 1996
1161996
Connecting wires: photoinduced electronic structure modulation in metal–organic frameworks
EA Dolgopolova, VA Galitskiy, CR Martin, HN Gregory, BJ Yarbrough, ...
Journal of the American Chemical Society 141 (13), 5350-5358, 2019
1032019
Energy conserving approximations to the quantum potential: Dynamics with linearized quantum force
S Garashchuk, VA Rassolov
The Journal of chemical physics 120 (3), 1181-1190, 2004
912004
Semiclassical dynamics based on quantum trajectories
S Garashchuk, VA Rassolov
Chemical physics letters 364 (5-6), 562-567, 2002
852002
Geminal model chemistry II. Perturbative corrections
VA Rassolov, F Xu, S Garashchuk
The Journal of chemical physics 120 (22), 10385-10394, 2004
822004
Quasirandom distributed Gaussian bases for bound problems
S Garashchuk, JC Light
The Journal of Chemical Physics 114 (9), 3929-3939, 2001
722001
Quantum dynamics with Bohmian trajectories: energy conserving approximation to the quantum potential
S Garashchuk, VA Rassolov
Chemical physics letters 376 (3-4), 358-363, 2003
702003
Quantum trajectories
PK Chattaraj
CRC Press, 2016
692016
Semiclassical approach to the hydrogen-exchange reaction Reactive and transition-state dynamics
S Garashchuk, F Grossmann, D Tannor
Journal of the Chemical Society, Faraday Transactions 93 (5), 781-789, 1997
661997
Semiclassical dynamics with quantum trajectories: Formulation and comparison with the semiclassical initial value representation propagator
S Garashchuk, VA Rassolov
The Journal of chemical physics 118 (6), 2482-2490, 2003
602003
Bohmian dynamics on subspaces using linearized quantum force
VA Rassolov, S Garashchuk
The Journal of chemical physics 120 (15), 6815-6825, 2004
572004
Semiclassical nonadiabatic dynamics with quantum trajectories
VA Rassolov, S Garashchuk
Physical Review A—Atomic, Molecular, and Optical Physics 71 (3), 032511, 2005
472005
The Schrödinger equation with friction from the quantum trajectory perspective
S Garashchuk, V Dixit, B Gu, J Mazzuca
The Journal of chemical physics 138 (5), 2013
442013
Stack the Bowls: Tailoring the Electronic Structure of Corannulene‐Integrated Crystalline Materials
AM Rice, EA Dolgopolova, BJ Yarbrough, GA Leith, CR Martin, ...
Angewandte Chemie International Edition 57 (35), 11310-11315, 2018
432018
Modified quantum trajectory dynamics using a mixed wave function representation
S Garashchuk, VA Rassolov
The Journal of chemical physics 121 (18), 8711-8715, 2004
402004
Quantum trajectory dynamics in arbitrary coordinates
VA Rassolov, S Garashchuk, GC Schatz
The Journal of Physical Chemistry A 110 (16), 5530-5536, 2006
392006
Computational complexity in quantum chemistry
VA Rassolov, S Garashchuk
Chemical Physics Letters 464 (4-6), 262-264, 2008
362008
Semiclassical nonadiabatic dynamics based on quantum trajectories for the O (P3, D1)+ H2 system
S Garashchuk, VA Rassolov, GC Schatz
The Journal of chemical physics 124 (24), 2006
362006
Quantum dynamics with gaussian bases defined by the quantum trajectories
B Gu, S Garashchuk
The Journal of Physical Chemistry A 120 (19), 3023-3031, 2016
352016
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مقاله‌ها 1–20