"Enabling Electronic Structure-Based Ab-Initio Molecular Dynamics ..."

Robert Schade et al. (2021)

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DOI: —

access: open

type: Informal or Other Publication

metadata version: 2021-10-14

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  - electronic edition @ arxiv.org (open access)
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  dblp key:
  - journals/corr/abs-2104-08245
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  - https://dblp.org/rec/journals/corr/abs-2104-08245
Robert Schade, Tobias Kenter, Hossam Elgabarty, Michael Lass, Ole Schütt, Alfio Lazzaro, Hans Pabst, Stephan Mohr, Jürg Hutter, Thomas D. Kühne, Christian Plessl:
Enabling Electronic Structure-Based Ab-Initio Molecular Dynamics Simulations with Hundreds of Millions of Atoms. CoRR abs/2104.08245 (2021)

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