Fast automatically differentiable matrix functions and applications in molecular simulations

Torabi, T., Gutleb, T.S. orcid.org/0000-0002-8239-2372 and Ortner, C. (2025) Fast automatically differentiable matrix functions and applications in molecular simulations. Computer Physics Communications, 317. 109832. ISSN: 0010-4655

Metadata

Item Type: Article
Authors/Creators:
Copyright, Publisher and Additional Information:

© 2025 The Author(s). Published by Elsevier B.V. This is an open access article under the CC BY-NC-ND license (http://creativecommons.org/licenses/by-nc-nd/4.0/).

Dates:
  • Accepted: 26 August 2025
  • Published (online): 9 September 2025
  • Published: December 2025
Institution: The University of Leeds
Academic Units: The University of Leeds > Faculty of Engineering & Physical Sciences (Leeds) > School of Computing (Leeds)
Depositing User: Symplectic Publications
Date Deposited: 12 Sep 2025 11:04
Last Modified: 12 Sep 2025 11:04
Status: Published
Publisher: Elsevier
Identification Number: 10.1016/j.cpc.2025.109832
Open Archives Initiative ID (OAI ID):

Export

Statistics