Understanding the effect of the layer-to-layer distance on Li-intercalated graphite

Journal of Applied Physics

Volumn 111, Issue 12, 2012, Pages

  Xu, B ^a   Wu, M S ^a   Liu, G ^a   Ouyang, C Y ^a  

^a JIANGXI NORMAL UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

ANODE MATERIAL; D-SPACING; D-SPACING INCREASE; DIFFUSION ENERGY BARRIERS; FIRST-PRINCIPLES CALCULATION; LITHIUM ATOMS; LITHIUM DIFFUSION; LITHIUM IONS; LITHIUM-ION BATTERY; STACKING MODES;

ANODES; CALCULATIONS; DIFFUSION; DYNAMICS; ENERGY BARRIERS; GRAPHITE; LITHIUM ALLOYS;

LITHIUM;

EID: 84863515294     PISSN: 00218979     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4730969     Document Type: Article

References (19)

1. D. Guerard and A. Herold, Carbon 13, 337 (1975). 10.1016/0008-6223(75) 90040-8
2. J. E. Fischer, C. D. Fuerst, and C. K. Woo, Synth. Met. 7, 1 (1983). 10.1016/0379-6779(83)90076-0
3. J. R. Dahn, Phys. Rev. B 44, 9170 (1991). 10.1103/PhysRevB.44.9170
4. Z. Ogumi and M. Inaba, Bull. Chem. Soc. Jpn. 71, 521 (1998). 10.1246/bcsj.71.521
5. M. D. Levi, E. Markevich, and D. Aurbach, Electrochim. Acta 51, 98 (2005). 10.1016/j.electacta.2005.04.007
6. Y. NuLi, J. Yang, and Z. Jiang, J. Phys. Chem. Solids 67, 882 (2006). 10.1016/j.jpcs.2005.11.003
7. E. J. Yoo, J. Kim, E. Hosono, H. S. Zhou, T. Kudo, and I. Honma, Nano Lett. 8, 2277 (2008). 10.1021/nl800957b
8. K. Toyoura, Y. Koyama, A. Kuwabara, and I. Tanaka, J. Phys. Chem. C 114, 2375 (2010). 10.1021/jp910134u
9. J. S. Filhol, C. Combelles, R. Yazami, and M. L. Doublet, J. Phys. Chem. C 112, 3982 (2008). 10.1021/jp076597n
10. J. Yang, Y. Takeda, N. Imanishi, T. Ichikawa, and O. Yamamoto, Solid State Ionics 135, 175 (2000). 10.1016/S0167-2738(00)00361-1
11. G. Kresse and D. Joubert, Phys. Rev. B 59, 1758 (1999). 10.1103/PhysRevB.59.1758
12. G. Kresse and J. Furthmuller, Phys. Rev. B 54, 11169 (1999). 10.1103/PhysRevB.54.11169
13. G. Kresse and J. Furthmuller, Comput. Mater. Sci. 6, 15 (1996). 10.1016/0927-0256(96)00008-0
14. D. M. Ceperley and B. J. Alder, Phys. Rev. Lett. 45, 566 (1980). 10.1103/PhysRevLett.45.566
15. J. P. Perdew and A. Zunger, Phys. Rev. B 23, 5048 (1981). 10.1103/PhysRevB.23.5048
16. J. P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett. 77, 3865 (1996). 10.1103/PhysRevLett.77.3865
17. H. J. Monkhorst and J. D. Pack, Phys. Rev. B 13, 5188 (1976). 10.1103/PhysRevB.13.5188
18. K. R. Kganyago and P. E. Ngoepe, Phys. Rev. B 68, 205111 (2003). 10.1103/PhysRevB.68.205111
19. G. Henkelman, B. P. Uberuaga, and H. Jonsson, J. Chem. Phys. 113, 9901 (2000). 10.1063/1.1329672