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川上 貴資. "光合成酸素発生中心CaMn4O5 クラスターでのMn-OH とMn=O 構造間の相対安定性 −hybrid DFT 法を越えてLPNO-CC, DMRG CAS, MR-DFT 法へ−." Ensemble 20.4 234-237