Structure and crystal chemistry of fluorite-related Bi38Mo7O78 from single crystal X-ray diffraction and ab initio calculations

Journal of Solid State Chemistry

Volumn 182, Issue 6, 2009, Pages 1312-1318

  Sharma, Neeraj ^a   Macquart, René B ^a,b   Christensen, Mogens ^b   Avdeev, Maxim ^b   Chen, Yu Sheng ^c   Ling, Chris D ^a,b  

^a UNIVERSITY OF SYDNEY   (Australia)

^b AUSTRALIAN NUCLEAR SCIENCE AND TECHNOLOGY ORGANISATION   (Australia)

^c ARGONNE NATIONAL LABORATORY   (United States)

Author keywords

Bismuth molybdenum oxide; Delta Bi2O3; Floating zone furnace; Oxide ion conduction; Single crystal X ray diffraction; Synchrotron

Indexed keywords

AB INITIO; AB INITIO ANALYSIS; AB INITIO CALCULATIONS; CHARGE BALANCES; DELTA-BI2O3; FLOATING ZONE FURNACE; FLOATING ZONES; OCTAHEDRAL COORDINATION; OCTAHEDRAL ENVIRONMENT; OXIDE ION CONDUCTION; SINGLE CRYSTAL X-RAY DIFFRACTION; SYNCHROTRON X RAY DIFFRACTION;

BISMUTH; CRYSTAL CHEMISTRY; CRYSTAL STRUCTURE; DENSITY FUNCTIONAL THEORY; DIFFRACTION; FLUORSPAR; FURNACES; IONS; MOLYBDENUM; MOLYBDENUM COMPOUNDS; SULFUR COMPOUNDS; SYNCHROTRONS; X RAY DIFFRACTION; X RAY DIFFRACTION ANALYSIS;

SINGLE CRYSTALS;

EID: 67349124820     PISSN: 00224596     EISSN: 1095726X     Source Type: Journal    
DOI: 10.1016/j.jssc.2009.02.030     Document Type: Article

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