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CRC 1639 NuMeriQS
CRC 1639 NuMeriQS
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Frank Neese

Frank Neese

Professor of Theoretical Chemistry

MPI für Kohlenforschung

Latest

  • Response of a General Restricted Open-Shell Hartree-Fock Wave Function. I: Formalism, Analytic Gradients, and Electric and Magnetic Response Properties
  • Efficient Implementation of Approximate Fourth Order N-Electron Valence State Perturbation Theory
  • A perspective on the future of quantum chemical software: the example of the ORCA program package
  • Code generation in ORCA: progress, efficiency and tight integration
  • A02
  • C02

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CRC 1639 NuMeriQS

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