Crystal structure of a superionic conductor, Li7P3S11

被引:355
作者
Yamane, Hisanori
Shibata, Masatoshi
Shimane, Yukio
Junke, Tadanori
Seino, Yoshikatsu
Adams, Stefan
Minami, Keilchi
Hayashi, Akitoshi
Tatsumisago, Masahiro
机构
[1] Tohoku Univ, Inst Multidisciplinary Res Adv Mat, Aoba Ku, Sendai, Miyagi 9808577, Japan
[2] Idemitsu Kosan Co Ltd, Cent Res Labs, Funct Mat Lab, Chiba 2990293, Japan
[3] Natl Univ Singapore, Fac Engn, Dept Mat Sci & Engn, Singapore 117574, Singapore
[4] Osaka Prefecture Univ, Dept Appl Chem, Osaka 5998531, Japan
关键词
lithium ion conductor; lithium phosphorous sulfide; glass ceramics; crystal structure;
D O I
10.1016/j.ssi.2007.05.020
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
A synchrotron X-ray powder diffraction pattern was measured for a lithium superionic conductor, Li7P3S11 It, which has a high conductivity of 3.2 x 10(-3) S em- 1 at room temperature and a low activation energy of 12 U mol- 1 [Mizuno et al., Solid State Ionics, vol. 177 (2006) 272 1]. The crystal structure was solved by a direct space global optimization technique and refined by the Rietveld method. The compound crystallizes in a triclinic cell, space group P- 1, alpha = 12.5009(3) A, beta = 6.03160(17) A, gamma - 12.5303(3) A, o(= 102.845(3)degrees, 113.2024(18)degrees, 74.467(3)degrees. PS4 tetrahedra and P2S7 ditetrahedra are contained in the structure and Li ions are situated between them. (c) 2007 Elsevier B.V. All rights reserved.
引用
收藏
页码:1163 / 1167
页数:5
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