Landau–Zener type surface hopping algorithms

Model approach for low-energy inelastic atomic collisions and application to Al+H and Al++H−

(2013) Andrey K. Belyaev   PHYSICAL REVIEW A

Propagation of Quantum Expectations with Husimi Functions

(2013) Johannes Keller et al.   SIAM JOURNAL ON APPLIED MATHEMATICS

Role of Conical Intersections in Molecular Spectroscopy and Photoinduced Chemical Dynamics

(2012) Wolfgang Domcke et al.   Annual Review of Physical Chemistry

Nonlinear dimensionality reduction for nonadiabatic dynamics: The influence of conical intersection topography on population transfer rates

(2012) Aaron M. Virshup et al.   JOURNAL OF CHEMICAL PHYSICS

Perspective: Nonadiabatic dynamics theory

(2012) John C. Tully   JOURNAL OF CHEMICAL PHYSICS

Single switch surface hopping for molecular quantum dynamics

(2011) Clotilde Fermanian-Kammerer et al.   JOURNAL OF MATHEMATICAL CHEMISTRY

Nonadiabatic nuclear dynamics of atomic collisions based on branching classical trajectories

(2011) Andrey K. Belyaev et al.   PHYSICAL REVIEW A

Cross sections for low-energy inelastic H+Na collisions

(2010) A. K. Belyaev et al.   PHYSICAL REVIEW A

Computing Expectation Values for Molecular Quantum Dynamics

(2010) Caroline Lasser et al.   SIAM JOURNAL ON SCIENTIFIC COMPUTING

Approximate switching algorithms for trajectory surface hopping

(2008) E. Fabiano et al.   CHEMICAL PHYSICS

Single switch surface hopping for a model of pyrazine

(2008) Caroline Lasser et al.   JOURNAL OF CHEMICAL PHYSICS

Single switch surface hopping for molecular dynamics with transitions

(2008) Clotilde Fermanian Kammerer et al.   JOURNAL OF CHEMICAL PHYSICS

Monte Carlo sampling of Wigner functions and surface hopping quantum dynamics

(2008) Susanna Kube et al.   JOURNAL OF COMPUTATIONAL PHYSICS

Propagation through Generic Level Crossings: A Surface Hopping Semigroup

(2008) Clotilde Fermanian Kammerer et al.   SIAM JOURNAL ON MATHEMATICAL ANALYSIS