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オーダーN法DFT計算プログラムCONQUESTにおける局在軌道の最適化と応用計算
(Development and application of the optimization method for local orbitals in an O(N)-DFT code CONQUEST)

第8回分子科学討論会. September 21, 2014-September 24, 2014.

NIMS author(s)


Fulltext and dataset(s) on Materials Data Repository (MDR)


    Created at: 2017-01-08 03:28:39 +0900Updated at: 2017-07-10 21:55:48 +0900

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