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| 基本情報 |
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| 氏名 |
坂根 弦太 |
| 氏名（カナ） |
ｻｶﾈ ｹﾞﾝﾀ |
| 氏名（英語） |
Sakane Genta |
| 所属 |
教育推進機構 基盤教育ｾﾝﾀｰ 科学技術教育部門 |
| 職名 |
教授 |
| researchmap研究者コード |
1000194578 |
| researchmap機関 |
岡山理科大学 |
人工光合成を目指したMn4CaO5クラスターおよびその関連構造を有したMn二核錯体の電子状態
マンガン, 混合金属キュバン型クラスター錯体, DV-Xα法
There are many unknown and complicated mechanisms in a photosynthesis by plants, because the photosynthesis should be done by many complicated organelles in the chloroplast. We investigate the mechanism of the catalytic decomposition of a water by a organelle Photo System II (PS II) in a chloroplast, whose crystal structure has been reported up to now. Through the study of revealing the mechanism of the decomposition of a water in a plant by a theoretical approach, it is expected to obtain the way how to make the novel hydrogen evolution catalyst. It makes the theoretical basis for making the hydrogen evolution catalyst and efficient decomposition of water to elucidate the processes performed by the electronic state calculation. We also calculate the similar catalyst in order to compare the electronic structures and the mechanisms of the decomposition of a water by means of DV-Xα molecular orbital calculation.
Bulletin of the Society for Discrete Variational Xα
The Society for Discrete Variational Xα
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