Large nonadiabatic quantum molecular dynamics simulations on parallel computers

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Publication:743328

DOI10.1016/J.CPC.2012.08.001zbMATH Open1296.81182OpenAlexW2170627388MaRDI QIDQ743328FDOQ743328


Authors: F. Shimojo, Satoshi Ohmura, Weiwei Mou, Rajiv K. Kalia, Aiichiro Nakano, Priya Vashishta Edit this on Wikidata


Publication date: 24 September 2014

Published in: Computer Physics Communications (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1016/j.cpc.2012.08.001




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