结晶学
八面体
中子衍射
负热膨胀
化学
热膨胀
单晶
镧系元素
分子
晶体结构
X射线晶体学
Crystal(编程语言)
衍射
材料科学
离子
物理
光学
有机化学
冶金
程序设计语言
计算机科学
作者
Samuel G. Duyker,Gregory J. Halder,Peter D. Southon,David J. Price,Alison J. Edwards,Vanessa K. Peterson,Cameron J. Kepert
出处
期刊:Chemical Science
[The Royal Society of Chemistry]
日期:2014-06-04
卷期号:5 (9): 3409-3409
被引量:23
摘要
The structures of the AxLnM(CN)6·nH2O (A = Li, Na, K; Ln = La–Lu, Y; M = Co, Fe; x = 0, 1; 0 ≤ n ≤ 5) cyanide frameworks, their thermal expansion behaviour, and their transformations upon dehydration are explored using X-ray and neutron single crystal diffraction and X-ray powder diffraction. Modification from positive to negative thermal expansion in the LnCo(CN)6·nH2O phases is achieved by removal of the guest water molecules. Most notable is the unprecedented flexibility demonstrated by the “coiling” of KLnFe(CN)6·nH2O frameworks upon their dehydration, wherein the lanthanoid coordination geometry reversibly converts from a 9-coordinate tri-capped trigonal prism to a 6-coordinate octahedron via a single-crystal-to-single-crystal process, accompanied by a large (14–16%) decrease in unit cell volume.
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