Matlab codes used to generate the figures in the paper 'Fermi's golden rule: its derivation and breakdown by an ideal model', Eur. J. Phys. 37 065406 (2016)
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Updated
Feb 5, 2024 - MATLAB
Matlab codes used to generate the figures in the paper 'Fermi's golden rule: its derivation and breakdown by an ideal model', Eur. J. Phys. 37 065406 (2016)
C++ code to compute electron trajectories in molecular orbitals using spin-dependent quantum hydrodynamics
Quantum dynamics engine for one- and two-dimensional systems
Matlab codes used to generate the figures in the paper 'Cusps in the quench dynamics of a Bloch state', EPL 114, 60001 (2016)
Fast and simple way to electronic structure methods.
Speeding up quantum dissipative dynamics of open systems with kernel methods
Matlab codes used to generate the figures in the paper 'Nonsmooth and level-resolved dynamics illustrated with the tight binding model', arXiv:1404.4280
Matlab codes used to generate the figures in the paper 'Sudden jumps and plateaus in the quench dynamics of a Bloch state', EPL 116, 10008 (2016)
Website of the (Molecular) Quantum Dynamics Lab at Haverford College
Practical session for the Quantum Dynamics course of the "Atomistic and Multiscale Computational Modelling" Master Degree. Course 2022-2023.
Generate Kinetic Energy Operators (KEO) with curvilinear coordinates (z-matrix, polyspherical ...)
How to use VCHam - a program to calculate the vibronic coupling Hamiltonian.
Science tools for quantum mechanics implemented mainly with PYTHON.
Code and data for our paper in JPCL "One-Shot Trajectory Learning of Open Quantum Systems Dynamics" https://doi.org/10.1021/acs.jpclett.2c01242
This module enables to use potentials extracted from the literature. It has the following features: * One or several degrees of freedom * One or several electronic states * For each electronic state, the energy, gradient and hessian can be obtained in the diabatic or adiabatic representations
A python package for Gaussian wave packet dynamics
Gutzwiller state for the Bose-Hubbard model, with complex and site-dependent coefficients
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