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Implementation of Laplace Transformed MP2 for Periodic Systems With Numerical Atomic Orbitals

Honghui Shang1, Jinlong Yang2

  • 1State Key Laboratory of Computer Architecture, Institute of Computing Technology, Chinese Academy of Sciences, Beijing, China.

Frontiers in Chemistry
|November 26, 2020
PubMed

Keywords:
Hartree–FockMP2NAOperiodic systemreal-space

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