Effect of ionic polarizability on oxygen diffusion in δ-Bi2O3 from atomistic simulation

Ionics

Volumn 16, Issue 4, 2010, Pages 297-303

  Aidhy, Dilpuneet S ^a,c   Sinnott, Susan B ^a   Wachsman, Eric D ^b   Phillpot, Simon R ^a  

^a University of Florida   (United States)

^b UNIVERSITY OF MARYLAND   (United States)

^c Northwestern University   (United States)

Author keywords

Bismuth oxide; Diffusion; Fluorites; Ionic conductivities; Modeling

Indexed keywords

ATOMISTIC SIMULATIONS; BISMUTH OXIDE; BISMUTH OXIDES; CATION DOPANTS; CATION POLARIZABILITY; IONIC POLARIZABILITIES; LONE PAIR; MOLECULAR DYNAMICS SIMULATIONS; OXYGEN DIFFUSION; OXYGEN SITE; POLARIZABILITIES; SHELL MODELS;

BISMUTH; COMPUTER SIMULATION; DIFFUSION IN GASES; FLUORSPAR; IONIC CONDUCTIVITY; PHASE EQUILIBRIA; POLARIZATION; POSITIVE IONS;

OXYGEN;

EID: 77951880234     PISSN: 09477047     EISSN: 18620760     Source Type: Journal    
DOI: 10.1007/s11581-010-0430-5     Document Type: Article

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