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3.4 An automatic seup of the number of orbitals and an occupation number, and specificaion of ionization calculation(軌道数および占有数の自動設定とイオン化計算の指定) 

${tnauto}  0  0  0              TNAUTO NUNOCC JION JESM


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