Direkt zum Inhalt

Brinkmann, Christian ; Eckert, Hellmut ; Wilmer, Dirk ; Vogel, Michael ; Schmedt auf der Günne, Jörn ; Hofbauer, Wilfried ; Rau, Franz ; Pfitzner, Arno

Re-entrant phase transition of the crystalline ion conductor Ag₇P₃S₁₁

Article

Brinkmann, Christian, Eckert, Hellmut, Wilmer, Dirk, Vogel, Michael, Schmedt auf der Günne, Jörn, Hofbauer, Wilfried, Rau, Franz and Pfitzner, Arno (2004) Re-entrant phase transition of the crystalline ion conductor Ag₇P₃S₁₁. Solid State Sciences (6), pp. 1077-1088.

DOI to cite this document: 10.5283/epub.11797


Abstract

A highly unusual structural evolution has been observed in temperature dependent studies of the fast ion conductor Ag7P3S11, using X-ray diffraction, Raman scattering, P-31 and Ag-109 NMR spectroscopy, and electrical conductivity measurements. At 205 K the high-temperature gamma-phase (space group C2/c) undergoes a phase transition to an intermediate beta-phase of different symmetry. At a ...

A highly unusual structural evolution has been observed in temperature dependent studies of the fast ion conductor Ag7P3S11, using X-ray diffraction, Raman scattering, P-31 and Ag-109 NMR spectroscopy, and electrical conductivity measurements. At 205 K the high-temperature gamma-phase (space group C2/c) undergoes a phase transition to an intermediate beta-phase of different symmetry. At a temperature near 130 K another phase transition is observed resulting in the formation of an ordered low-temperature alpha-modification crystallizing in the same space group as the gamma-phase. Restoration of the high-temperature-phase symmetry in the low-temperature phase is unambiguously confirmed by single-crystal X-ray structure determination and 31 p solid state NMR peak multiplicities. The re-entrant phase behavior is further supported by temperature dependent electrical conductivity measurements, which reveal that the activation energies of the dc conductivity for the alpha- and gamma-phases are identical and significantly lower compared to those measured in the beta-phase. Although the beta- to gamma-phase transition is associated with a change in enthalpy, those observables reflecting silver ion dynamics show no discontinuities at the phase transition temperature. The high-temperature gamma-phase crystallizes in the monoclinic system, space group C2/c (No. 15), a = 23.999(2) Angstrom, b = 6.3621(3) Angstrom, c 24.909(2) Angstrom, beta=110.926(7)degrees R = 0.0318 (300 K). The low-temperature ce-phase is isostructural with a = 24.090(1) Angstrom, b = 6.3400(3) Angstrom, c = 24.581 (1) Angstrom, beta = 110.870(6)degrees, R = 0.0317 (120 K). Contrary to the situation in gamma-Ag7P3S11, all the silver atoms are well-localized in the a-phase. (C) 2004 Elsevier SAS. All rights reserved.



Involved Institutions


Details

Item typeArticle
Journal or Publication TitleSolid State Sciences
PublisherELSEVIER SCIENCE BV
Place of PublicationAMSTERDAM
Number of Issue or Book Chapter6
Page Rangepp. 1077-1088
Date2004
Date of publication23 Dec 2009 11:36
InstitutionsChemistry and Pharmacy > Institut für Anorganische Chemie > Chair Prof. Dr. Arno Pfitzner
Identification Number
ValueType
10.1016/j.solidstatesciences.2004.04.020DOI
KeywordsSOLID-STATE NMR; AG-P-S; ROCHELLE SALT; SPECTRA; DIFFUSION; BEHAVIOR; SYSTEM;
Dewey Decimal Classification500 Science > 540 Chemistry & allied sciences
StatusPublished
RefereedYes, this version has been refereed
Created at the University of RegensburgUnknown
URN of the UB Regensburgurn:nbn:de:bvb:355-epub-117973
Item ID11797

Export bibliographical data

Owner only: item control page

nach oben