Quantum-Dynamics-Hub/libra-code: HEOM in Libra
Alexey V. Akimov, B.L. Smith, Kosuke Sato, Wei Li, Xiang Ying Sun, Matthew Chan · Zenodo (CERN European Organization for Nuclear Research) · 2020
tsh, heom, and exact dynamics (on the grid) module are systematically organized in the libra_py/dyn the clean and tested HEOM module significantly improved the functionality of the exact quantum dynamics module Colbert-Miller DVR NBRA-LZ for TD-DFTB+ codes adopted MolSSI cookiecutter strategies for documenting and maintaining the code Although this release has added many features, we consider it a snapshot for the first official release of the HEOM module.