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待辦事項 #31851
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MPI-parallelization of the HF

啟用日期: 2013-08-08 09:53 最後更新: 2013-08-08 15:47

回報者:
mikiya_fujii
負責人:
mikiya_fujii
類型:
特色請求
狀態:
關閉
元件:
(無)
里程碑:
ver0.3.0 (closed)
優先權:
6
嚴重程度:
6
處理結果:
修正
檔案:
無

細節

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).

Ticket History (3/4 Histories)

2013-08-08 09:53 Updated by: mikiya_fujii
  • New Ticket "MPI-parallelization of the HF" created
2013-08-08 14:30 Updated by: mikiya_fujii
  • 處理結果 Update from 無 to 修正
  • Ticket Close date is changed to 2013-08-08 14:30
  • 狀態 Update from 開啟 to 關閉
評語

fixed at r1462

2013-08-08 15:45 Updated by: mikiya_fujii
  • 處理結果 Update from 修正 to 無
  • 狀態 Update from 關閉 to 開啟
評語

reopen to optimize more.

2013-08-08 15:47 Updated by: mikiya_fujii
  • 處理結果 Update from 無 to 修正
  • Ticket Close date is changed to 2013-08-08 15:47
  • 狀態 Update from 開啟 to 關閉
評語

fixed at r1463

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