A Master-Worker Type Eigensolver for Molecular Orbital Computations

Tetsuya Sakurai, Yoshihisa Kodaki, Hiroto Tadano, Hiroaki Umeda, Yuichi Inadomi, Toshio Watanabe, Umpei Nagashima. A Master-Worker Type Eigensolver for Molecular Orbital Computations. In Bo Kågström, Erik Elmroth, Jack Dongarra, Jerzy Wasniewski, editors, Applied Parallel Computing. State of the Art in Scientific Computing, 8th International Workshop, PARA 2006, Umeå, Sweden, June 18-21, 2006, Revised Selected Papers. Volume 4699 of Lecture Notes in Computer Science, pages 617-625, Springer, 2006. [doi]

Abstract

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