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3.3.6 JPMGC

In the magnetism calculation(NSPIN=2,4), JPMGC=1 is specified when calculating convergence of an electron state by assuming paramagnetism compulsorily.

磁性計算(NSPIN=2,4)の時に、強制的に常磁性を仮定して電子状態の収束 を計算するときにJPMGC=1を指定する。


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Copyright (C), Tatsuki Oda (oda@cphys.s.kanazawa-u.ac.jp, Kanazawa University)