The patent badge is an abbreviated version of the USPTO patent document. The patent badge does contain a link to the full patent document.

The patent badge is an abbreviated version of the USPTO patent document. The patent badge covers the following: Patent number, Date patent was issued, Date patent was filed, Title of the patent, Applicant, Inventor, Assignee, Attorney firm, Primary examiner, Assistant examiner, CPCs, and Abstract. The patent badge does contain a link to the full patent document (in Adobe Acrobat format, aka pdf). To download or print any patent click here.

Date of Patent:
Feb. 08, 2011

Filed:

Sep. 21, 2004
Applicants:

Toshikazu Takada, Tokyo, JP;

Jun-ichi Yamamoto, Tokyo, JP;

Kazuto Nakata, Tokyo, JP;

Inventors:

Toshikazu Takada, Tokyo, JP;

Jun-ichi Yamamoto, Tokyo, JP;

Kazuto Nakata, Tokyo, JP;

Assignee:

NEC Soft, Ltd., Tokyo, JP;

Attorney:
Primary Examiner:
Int. Cl.
CPC ...
G06G 7/48 (2006.01); G06G 7/58 (2006.01); G01N 33/48 (2006.01); G01N 31/00 (2006.01);
U.S. Cl.
CPC ...
Abstract

A method for executing calculation of the Hartree-Fock method in a molecular orbital method by a distributed memory parallel computing system includes the steps of: using a computer cluster made up of a plurality of computers; dividing a density matrix into multiple density submatrixes and distributing them to the individual computers and storing therein; and executing calculation processes such as two-electron integration or the like relating to density submatrixes in each computer while sequentially transferring the multiple density submatrixes between the multiple computers.


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