Four-index integral transformation exploiting symmetry

DOI10.1016/J.CPC.2004.01.008zbMath1196.81293OpenAlexW2067260125MaRDI QIDQ709698

Umpei Nagashima, Shigeyoshi Yamamoto

Publication date: 18 October 2010

Published in: Computer Physics Communications (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1016/j.cpc.2004.01.008

zbMATH Keywords

sparsitytwo-electron integralpoint groupelectron repulsion integralfour-index integral transformationsymmetry adaptation

Mathematics Subject Classification ID

Computational methods for problems pertaining to quantum theory (81-08) Molecular physics (81V55)

Cites Work

• The iterative calculation of a few of the lowest eigenvalues and corresponding eigenvectors of large real-symmetric matrices
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