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Surface hopping
The Landau-Zener Transition and the Surface Hopping Method for the 2D Dirac Equation for Graphene
Performance of Trajectory Surface Hopping Method in the Treatment of Ultrafast Intersystem Crossing Dynamics
Lecture 6: Introduction to Surface Hopping and to Sharc
Molecular Dynamics Beyond the Born-Oppenheimer Approximation: Mixed Quantum–Classical Approaches
Frozen Gaussian Approximation with Surface Hopping for Mixed Quantum-Classical Dynamics: a Mathematical Justification of Fewest Switches Surface Hopping Algorithms
Surface Hopping Dynamics with Direct Semiempirical Solution of the Electronic Problem. Maurizio Persico Universit`A Di Pisa Dipa
Surface Hopping from the Perspective of Quantumв
An Eulerian Surface Hopping Method for the Schrödinger Equation With
Nonadiabatic Dynamics at Metal Surfaces: Fewest Switches Surface Hopping with Electronic Relaxation Arxiv:2009.11261V1 [Physics
Surface Hopping Dynamics with DFT Excited States
Modern Theoretical Approaches to Modeling the Excited-State Intramolecular Proton Transfer: an Overview
Assessing the Performance of Trajectory Surface Hopping Methods: Ultrafast Internal Conversion in Pyrazine
Towards a Mathematical Understanding of Surface Hopping Methods
Landau-Zener Type Surface Hopping Algorithms
Modeling Nonadiabatic Dynamics at Molecule-Metal Interfaces
Detailed Balance in Ehrenfest Mixed Quantum-Classical Dynamics
Nonadiabatic Molecular Dynamics
Surface Hopping Without Momentum Jumps: a Quantum Trajectory-Based Approach to Nonadiabatic Dynamics
Top View
Surface Hopping Dynamics Using a Locally Diabatic Formalism: Charge Transfer in the Ethylene Dimer Cation and Excited State Dyna
Velocity Adjustment in Surface Hopping: Ethylene As a Case Study of the Maximum Error Caused by Direction Choice Mario Barbatti
Frozen Gaussian Approximation with Surface Hopping: a Stochastic Semiclassical Algorithm for High Dimensional Schrödinger Equations
Molecular Dynamics Beyond the Born-Oppenheimer Approximation: Mixed Quantum–Classical Approaches
TDDFT + Molecular Dynamics I
Arxiv:1606.05365V3 [Physics.Chem-Ph]
Strong Influence of Decoherence Corrections and Momentum Rescaling in Surface Hopping Dynamics of Transition Metal Complexes
Trajectory Surface Hopping for Nonadiabatic Dynamics of Resonances
Non-Adiabatic Dynamics in Mixed Quantum-Classical Systems
Understanding Surface Hopping Algorithms and Their Applications in Condensed Phase Systems
Nonadiabatic Dynamics of Cycloparaphenylenes with TD-DFTB Surface Hopping Ljiljana Stojanovic, Saadullah G
Decoherence-Induced Surface Hopping
Arxiv:1902.05115V1 [Physics.Chem-Ph] 13 Feb 2019 Htectdmlclsi Antcfils Emake We fields
An Eulerian Surface Hopping Method for the Schrodinger¨ Equation with Conical Crossings∗
Path Integral Molecular Dynamics (With Surface Hopping)
Multi-State Trajectory Approach to Non-Adiabatic Dynamics: General Formalism and the Active State Trajectory Approximation
Nonadiabatic Dynamics: Mean-Field and Surface Hopping
Trajectory-Based Nonadiabatic Molecular Dynamics Reminder From
Molecular Dynamics with Electronic Transitions John C
A Tutorial for NEWTON-X
Analysis of the Trajectory Surface Hopping Method from the Markov State Model Perspective
Analysis of a Surface Hopping Expansion That Includes Hops in Classically Forbidden Regions ⇑ Michael F
A Diabatic Surface Hopping Algorithm Based on Time Dependent Perturbation Theory and Semiclassical Analysis
Fewest Switches Surface Hopping in Liouville Space † ‡ † Linjun Wang,*, Andrew E
NEWTON-X a Package for Newtonian Dynamics Close to the Crossing Seam
Surface Hopping Without Momentum Jumps: a Quantum- Trajectory-Based Approach to Nonadiabatic Dynamics