Computerized implementation of higher-order electron-correlation methods and their linear-scaling divide-and-conquer

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Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
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Masahiko Nakano1, Takeshi Yoshikawa1, So Hirata2,3

  • 1Department of Chemistry and Biochemistry, School of Advanced Science and Engineering, Waseda University, Tokyo, 169-8555, Japan.

Journal of Computational Chemistry
|August 11, 2017
PubMed

Keywords:
divide-and-conquer methodelectron-correlation theorylinear-scalingtensor contraction engine

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