fewest switches surface hopping 1 (Q6775432)
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original fewest switches surface hopping trajectories for quantum-classical dynamics
- Molecular Dynamics with Quantum Transitions
- Trajectory Surface Hopping
| Language | Label | Description | Also known as |
|---|---|---|---|
| English | fewest switches surface hopping 1 |
original fewest switches surface hopping trajectories for quantum-classical dynamics |
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Statements
The trajectories for the heavy particle(s) are propagated on a single potential energy surface (PES) of the light particle(s), but they are allowed to change surface, especially near regions of large nonadiabatic couplings.
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