Stable and Efficient Linear Scaling First-Principles Molecular Dynamics for 10000+ Atoms

DOI Web Site 被引用文献10件参考文献28件

Michiaki Arita

Faculty of Science and Technology, Tokyo University of Science, 2641 Yamasaki, Noda, Chiba 278-8510, Japan
David R. Bowler

Department of Physics and Astronomy, University College London (UCL), Gower Street, London WC1E 6BT, U.K.
Tsuyoshi Miyazaki

Faculty of Science and Technology, Tokyo University of Science, 2641 Yamasaki, Noda, Chiba 278-8510, Japan

収録刊行物

Journal of Chemical Theory and Computation

Journal of Chemical Theory and Computation 10 (12), 5419-5425, 2014-11-21

American Chemical Society (ACS)