Work

Dataset for: "Open source, GPU-Accelerated Hartree–Fock QM/MM Molecular Dynamics through the MiMiC Coupling of QUICK and GROMACS"

Year: 2026

Type: dataset

Source: Zenodo (CERN European Organization for Nuclear Research)

DOI: 10.5281/zenodo.23263023

Authors: Mohr, Hanna, Ippoliti, Emiliano, Rossetti, Giulia, Diaz, Sandra, Fahlke, Christoph, Merz, Kenneth M, Mandelli, Davide, Carloni, Paolo

Institutions: Forschungszentrum Jülich, RWTH Aachen University, Universitätsklinikum Aachen, Jülich Supercomputing Centre, Cleveland Clinic, Michigan State University

Topic: Advanced Chemical Physics Studies

Subfield: Atomic and Molecular Physics, and Optics

Field: Physics and Astronomy

Domain: Physical Sciences

Open Access status: green

OpenAlex ID: W7221565291

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