Consistent schemes for non-adiabatic dynamics derived from partial linearized density matrix propagation

Mapping quantum-classical Liouville equation: Projectors and trajectories

(2012) Aaron Kelly et al.   JOURNAL OF CHEMICAL PHYSICS

Nonadiabatic dynamics in open quantum-classical systems: Forward-backward trajectory solution

(2012) Chang-Yu Hsieh et al.   JOURNAL OF CHEMICAL PHYSICS

Semi-classical path integral non-adiabatic dynamics: a partial linearized classical mapping Hamiltonian approach

(2012) Pengfei Huo et al.   MOLECULAR PHYSICS

Surface hopping with Ehrenfest excited potential

(2011) Sean A. Fischer et al.   JOURNAL OF CHEMICAL PHYSICS

Communication: Partial linearized density matrix dynamics for dissipative, non-adiabatic quantum evolution

(2011) Pengfei Huo et al.   JOURNAL OF CHEMICAL PHYSICS

A new approach to decoherence and momentum rescaling in the surface hopping algorithm

(2011) Joseph E. Subotnik et al.   JOURNAL OF CHEMICAL PHYSICS

Simultaneous-trajectory surface hopping: A parameter-free algorithm for implementing decoherence in nonadiabatic dynamics

(2011) Neil Shenvi et al.   JOURNAL OF CHEMICAL PHYSICS

On the Interpretation of Quantum Coherent Beats Observed in Two-Dimensional Electronic Spectra of Photosynthetic Light Harvesting Complexes

(2011) Akihito Ishizaki et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Linearized approximations for condensed phase non-adiabatic dynamics: Multi-layered baths and Brownian dynamics implementation

(2010) P. Huo et al.   CHEMICAL PHYSICS

Effect of correlation of local fluctuations on exciton coherence

(2010) Xin Chen et al.   JOURNAL OF CHEMICAL PHYSICS

Iterative linearized density matrix propagation for modeling coherent excitation energy transfer in photosynthetic light harvesting

(2010) P. Huo et al.   JOURNAL OF CHEMICAL PHYSICS

Augmented Ehrenfest dynamics yields a rate for surface hopping

(2010) Joseph E. Subotnik   JOURNAL OF CHEMICAL PHYSICS

Semiclassical Description of Electronic Excitation Population Transfer in a Model Photosynthetic System

(2010) Guohua Tao et al.   Journal of Physical Chemistry Letters

Mapping approach for quantum-classical time correlation functions

(2009) Ali Nassimi et al.   CANADIAN JOURNAL OF CHEMISTRY

Linearization approximations and Liouville quantum–classical dynamics

(2009) Sara Bonella et al.   CHEMICAL PHYSICS LETTERS

Semiclassical description of vibrational quantum coherence in a three dimensional I[sub 2]Ar[sub n] (n≤6) cluster: A forward-backward initial value representation implementation

(2009) Guohua Tao et al.   JOURNAL OF CHEMICAL PHYSICS

Quantum initial condition sampling for linearized density matrix dynamics: Vibrational pure dephasing of iodine in krypton matrices

(2008) Z. Ma et al.   JOURNAL OF CHEMICAL PHYSICS

Iterative linearized approach to nonadiabatic dynamics

(2008) E. R. Dunkel et al.   JOURNAL OF CHEMICAL PHYSICS

Trotter-Based Simulation of Quantum-Classical Dynamics†

(2007) Dónal Mac Kernan et al.   JOURNAL OF PHYSICAL CHEMISTRY B