Pair-hopping characteristic of lithium diffusive motion in Li-doped β-phase manganese phthalocyanine

Pair-hopping characteristic of lithium diffusive motion in Li-doped β-phase manganese phthalocyanine

We report a first-principles molecular dynamics study on Li-doped beta-phase manganese phthalocyanine (MnPc). Four electronegative sites next to pyrrole-bridging nitrogen atoms in single MnPc were characterized by analyzing electrostatic potentials. In one-dimensional stacked MnPc, six binding sites...

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書目詳細資料
Main Authors:	Du, Xiaosong, Li, Qunxiang, Chen, Ying, Su, Haibin, Yang, Jinlong
其他作者:	School of Materials Science & Engineering
格式:	Article
語言:	English
出版:	2011
主題:	DRNTU::Engineering::Materials
在線閱讀:	https://hdl.handle.net/10356/93619 http://hdl.handle.net/10220/7427
標簽:	添加標簽沒有標簽, 成為第一個標記此記錄!
機構:	Nanyang Technological University
語言:	English

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