An Egorov theorem for avoided crossings of eigenvalue surfaces
From MaRDI portal
Publication:2362797
Abstract: We study nuclear propagation through avoided crossings of electron energy levels. We construct a surface hopping semigroup, which gives an Egorov-type description of the dynamics. The underlying time-dependent Schroedinger equation has a two-by-two matrix-valued potential, whose eigenvalue surfaces have an avoided crossing. Using microlocal normal forms reminiscent of the Landau-Zener problem, we prove convergence to the true solution in the semi-classical limit.
Recommendations
- Propagation through Generic Level Crossings: A Surface Hopping Semigroup
- scientific article; zbMATH DE number 1552587
- An Eulerian surface hopping method for the Schrödinger equation with conical crossings
- scientific article; zbMATH DE number 2135382
- Propagation through conical crossings: An asymptotic semigroup
Cites work
- A kinetic model for the transport of electrons in a graphene layer
- A Landau-Zener formula for non-degenerated involutive codimension 3 crossings
- Adiabatic decoupling and time-dependent Born-Oppenheimer theory
- Classification and normal forms for avoided crossings of quantum-mechanical energy levels
- Determination of non-adiabatic scattering wave functions in a Born-Oppenheimer model
- Homogenization limits and Wigner transforms
- scientific article; zbMATH DE number 3969124 (Why is no real title available?)
- scientific article; zbMATH DE number 1161956 (Why is no real title available?)
- scientific article; zbMATH DE number 2135382 (Why is no real title available?)
- Mesures semi-classiques et croisement de modes
- Molecular propagation through electron energy level crossings
- MOLECULAR PROPAGATION THROUGH SMALL AVOIDED CROSSINGS OF ELECTRON ENERGY LEVELS
- Nonadiabatic transitions through tilted avoided crossings
- Normal forms for conical intersections in quantum chemistry
- Propagation through conical crossings: An asymptotic semigroup
- Propagation through Generic Level Crossings: A Surface Hopping Semigroup
- Single switch surface hopping for molecular quantum dynamics
- Superadiabatic transitions in quantum molecular dynamics
- The level crossing problem in semi-classical analysis. I: The symmetric class.
- Twisted pseudodifferential calculus and application to the quantum evolution of molecules
Cited in
(17)- A kinetic model for the transport of electrons in a graphene layer
- Mathematical methods in quantum chemistry. Abstracts from the workshop held March 18--24, 2018
- Wavepackets in inhomogeneous periodic media: propagation through a one-dimensional band crossing
- Landau-Zener formula in a ``non-adiabatic regime for avoided crossings
- Propagation of wave packets for systems presenting codimension one crossings
- Coherent electronic transport in periodic crystals
- Adiabatic and non-adiabatic evolution of wave packets and applications to initial value representations
- Quantum evolution and sub-Laplacian operators on groups of Heisenberg type
- Effective mass theorems with Bloch modes crossings
- An Eulerian surface hopping method for the Schrödinger equation with conical crossings
- Propagation through Generic Level Crossings: A Surface Hopping Semigroup
- scientific article; zbMATH DE number 1552587 (Why is no real title available?)
- Nonadiabatic transitions in multiple dimensions
- Propagation through conical crossings: An asymptotic semigroup
- Observable Error Bounds of the Time-Splitting Scheme for Quantum-Classical Molecular Dynamics
- Computing quantum dynamics in the semiclassical regime
- Propagation of coherent states through conical intersections
This page was built for publication: An Egorov theorem for avoided crossings of eigenvalue surfaces
Report a bug (only for logged in users!)Click here to report a bug for this page (MaRDI item Q2362797)
