-
openespf Public
A python toolkit for performing polarizable QM/MM simulations.
-
heom-lab Public
A Matlab implementation of the Hierarchical Equations of Motion (HEOM) method for modelling open system quantum dynamics.
-
openqp Public
Forked from huixrotllant/openqpThe main repository of Open Quantum Platform (OpenQP)
Fortran Other UpdatedNov 13, 2024 -
-
PyESPF Public
ElectroStatic Potential Fitted Direct Reaction Field and Mean-Field QM/MM simulation tools. An add-on using PySCF.
-
spinchem-lab Public
A set of Matlab tools for performing spin chemistry simulations.
-
-
lammps Public
Forked from lammps/lammpsPublic development project of the LAMMPS MD software package
C++ GNU General Public License v2.0 UpdatedJul 12, 2022 -
-
scspin Public
A repository for the scspin (semiclassical spin dynamics) code developed for performing semiclassical spin dynamics simulations of radical pair systems.
C++ MIT License UpdatedMar 5, 2021
{{ message }}