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M. Heidenreich et al.
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Adil Loya et al.
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Danny E. P. Vanpoucke et al.
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Steffen Grieshammer et al.
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Yi Wang et al.
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M. J. D. Rushton et al.
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Hyun Jun Ko et al.
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Pratik P. Dholabhai et al.
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M. A. Kovalenko et al.
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A. Otero-de-la-Roza et al.
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Takuto Kushi et al.
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Molecular dynamics simulation on ionic conduction process of oxygen in Ce1-xMxO2-x/2
C. W. Huang et al.
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Arif Ismail et al.
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Sebastien Le Roux et al.
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Bin Li et al.
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James Hooper et al.
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Marco Fronzi et al.
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Shobit Omar et al.
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D. Phelan et al.
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VESTA:: a three-dimensional visualization system for electronic and structural analysis
Koichi Momma et al.
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M. G. Chourashiya et al.
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Conductivity and structure features of Ce1-xGdxO2-delta solid electrolytes fabricated by compaction and sintering of weakly agglomerated nanopowders
V. V. Ivanov et al.
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Juarez L. F. Da Silva et al.
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Formation of the cerium orthovanadate CeVO4 : DFT+U study
Juarez L. F. Da Silva et al.
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DA Andersson et al.
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Bulk modulus of CeO2 and PrO2 -: An experimental and theoretical study
L Gerward et al.
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V Tsirelson et al.
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Oxygen migration in A2B2O7 pyrochlores
M Pirzada et al.
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Mechanical behaviour of ceramic oxygen ion-conducting membranes
A Atkinson et al.
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Appraisal of Ce1-yGdyO2-y/2 electrolytes for IT-SOFC operation at 500°C
BCH Steele
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Intrinsic and extrinsic oxygen diffusion and surface exchange reaction in cerium oxide
M Kamiya et al.
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