Published September 1, 2023 | Version v0.1
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Plane waves versus correlation-consistent basis sets: A comparison of MP2 non-covalent interaction energies in the complete basis set limit

Authors/Creators

  • 1. Ecole Polytechnique Fédérale de Lausanne
  • 2. Universität Wien

Description

Files

README.md

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Additional details

Related works

Is continued by
https://github.com/lcbc-epfl (URL)

Funding

Swiss National Science Foundation
Next-Generation Multiscale Molecular Dynamics: Promoting Computational Chemistry with Artificial Intelligence 200020_185092