[Molds-dev] [molds] #31851: MPI-parallelization of the HF

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SourceForge Ticket System norep****@sourc*****
2013年 8月 8日 (木) 15:45:31 JST


#31851: MPI-parallelization of the HF

  Open Date: 2013-08-08 09:53
Last Update: 2013-08-08 15:45

URL for this Ticket:
    http://sourceforge.jp/ticket/browse.php?group_id=6231&tid=31851
RSS feed for this Ticket:
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Last Changes/Comment for this Ticket:
2013-08-08 15:45 Update by: mikiya_fujii

 * 状況 Update from 完了 to オープン.
 * 解決法 Update from 修正済み to なし.

Comment:

reopen to optimize more.

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Ticket Status:

      Reporter: mikiya_fujii
         Owner: mikiya_fujii
          Type: 機能リクエスト
        Status: オープン
      Priority: 6
     MileStone: ver0.3.0
     Component: (未割り当て)
      Severity: 6
    Resolution: なし
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Ticket details:

MPI-parallelization of the HF is needed because constructing the Fock matrix is one of hotspots in the ground state MD (maybe for opt also).

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