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First-principle investigation on stability of Co-doped spinel λ-Mn4−xCoxO8

✍ Scribed by Huang, Ke-long ;Chen, Chun-an ;Liu, Su-qin ;Luo, Qiong ;Liu, Zhi-guo


Book ID
107506580
Publisher
Chinese Electronic Periodical Services
Year
2007
Tongue
English
Weight
290 KB
Volume
14
Category
Article
ISSN
1005-9784

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The effect of cation doping on spinel Li
✍ Siqi Shi; Chuying Ouyang; Ding-sheng Wang; Liquan Chen; Xuejie Huang 📂 Article 📅 2003 🏛 Elsevier Science 🌐 English ⚖ 195 KB

The effect of the cation doping on the electronic structure of spinel LiM y Mn 22y O 4 (M ¼ Cr, Mn, Fe, Co and Ni) has been calculated by first-principles. Our calculation shows that new M-3d bands emerge in the density of states compared with that in LiMn 2 O 4 . Simultaneously, the new O-2p bands