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Alan E. Rask

机构:Sanden (Japan) · ORCID:0000-0002-2492-6962

发表论文 15 篇 · 总被引 1525 次 · h-index 6

代表论文

  • Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package (2021 · The Journal of Chemical Physics · 被引 1391)
  • Evaluation of full valence correlation energies and gradients (2019 · The Journal of Chemical Physics · 被引 36)
  • Parallel Implementation of the Density Matrix Renormalization Group Method Achieving a Quarter petaFLOPS Performance on a Single DGX-H100 GPU Node (2024 · Journal of Chemical Theory and Computation · 被引 32)
  • Mercury Magnetic Isotope Effect: A Plausible Photochemical Mechanism (2020 · The Journal of Physical Chemistry A · 被引 25)
  • Toward Full Configuration Interaction for Transition-Metal Complexes (2021 · The Journal of Physical Chemistry A · 被引 17)
  • The many-body electronic interactions of Fe(II)–porphyrin (2022 · The Journal of Chemical Physics · 被引 11)