The incommensurate structure of K3In(PO4)2

被引:14
作者
Arakcheeva, A
Chapuis, G [1 ]
Petrícek, V
Dusek, M
Schönleber, A
机构
[1] Univ Lausanne, Inst Cristallog, BSP Dorigny, CH-1015 Lausanne, Switzerland
[2] RAS, AA Baikov Met Inst, Moscow 119991, Russia
[3] Acad Sci Czech Republic, Inst Phys, Prague 18221, Czech Republic
来源
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE | 2003年 / 59卷
关键词
D O I
10.1107/S0108768102021195
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
The incommensurately modulated structure of K3In(PO4)(2) has been solved and refined. The origin of the modulation relates to the ordering of K cations within the hexagonal close packing of the PO4 anions. The driving forces for the modulation of the other cations are In-P and K-P interactions. The modulation of O atoms of rigid PO4 units follows the cations in order to stabilize the InO6 octahedron. It is shown that the previously published three-dimensional structure rerned from powder diffraction data obtained at room temperature is an average structure. Therefore the incommensurately modulated phase of K3In(PO4)(2) is the only one that has been unequivocally identired at room temperature. The origin of the modulation is discussed in comparison with the structures of Na3InP2, alpha- and beta-Na3In(PO4)(2), Na3Fe(PO4)(2) and Rb3In(PO4)(2).
引用
收藏
页码:17 / 27
页数:11
相关论文
共 11 条
[1]  
[Anonymous], JANA2000 STRUCTURE D
[2]   CRYSTAL-STRUCTURE OF TRISODIUM TECTO-DIPHOSPHIDOINDATE, NA3INP2 [J].
BLASE, W ;
CORDIER, G ;
SOMER, M .
ZEITSCHRIFT FUR KRISTALLOGRAPHIE, 1991, 195 (1-2) :119-120
[3]   The glaserite-like structure of double sodium and iron phosphate Na3Fe(PO4)2 [J].
Morozov, VA ;
Lazoryak, BI ;
Malakho, AP ;
Pokholok, KV ;
Polyakov, SN ;
Terekhina, TP .
JOURNAL OF SOLID STATE CHEMISTRY, 2001, 160 (02) :377-381
[4]   COMPOUNDS WITH SIS2 ISOELECTRONIC ANION-1-INFINITY[ALX4/2(3-)] AND ANION-1-INFINITY[INP4/2(3-)] - SYNTHESIS, CRYSTAL-STRUCTURES AND VIBRATIONAL-SPECTRA OF NA3[ALX2],K2NA[ALX2] AND K3[INP2] (X = P, AS) [J].
OHSE, L ;
SOMER, M ;
BLASE, W ;
CORDIER, G .
ZEITSCHRIFT FUR NATURFORSCHUNG SECTION B-A JOURNAL OF CHEMICAL SCIENCES, 1993, 48 (08) :1027-1034
[5]  
*OXF DIFFR LTD, 2001, CRYSA SOFTW SYST VER
[6]  
PEARSON WB, 1972, CRYSTAL CHEM PHYSICS
[7]   ON THE USE OF CRENEL FUNCTIONS FOR OCCUPATIONALLY MODULATED STRUCTURES [J].
PETRICEK, V ;
VANDERLEE, A ;
EVAIN, M .
ACTA CRYSTALLOGRAPHICA SECTION A, 1995, 51 :529-535
[8]   X-RAY-ANALYSIS OF THE INCOMMENSURATE MODULATION IN THE 2-2-1-2 BI-SR-CA-CU-O SUPERCONDUCTOR INCLUDING THE OXYGEN-ATOMS [J].
PETRICEK, V ;
GAO, Y ;
LEE, P ;
COPPENS, P .
PHYSICAL REVIEW B, 1990, 42 (01) :387-392
[9]   NADA -: a computer program for the simultaneous refinement of orientation matrix and modulation vector(s) [J].
Schönleber, A ;
Meyer, M ;
Chapuis, G .
JOURNAL OF APPLIED CRYSTALLOGRAPHY, 2001, 34 :777-779
[10]   Structure of polymorphous modifications of double sodium and indium phosphate [J].
Zhizhin, MG ;
Morozov, VA ;
Bobylev, AP ;
Popov, AM ;
Spiridonov, FM ;
Komissarova, LN ;
Lazoryak, BI .
JOURNAL OF SOLID STATE CHEMISTRY, 2000, 149 (01) :99-106