articleTop 1% cited
Density functional theory studies of the structure and electronic structure of pure and defective low index surfaces of ceria
Surface Science · 2005 · Vol. 576(1-3) · pp. 217–229
Michael Nolan(Trinity College Dublin)Sonja Grigoleit(Trinity College Dublin)Dean C. Sayle(Cranfield University)Stephen C. Parker(University of Bath)Graeme W. Watson✉(Trinity College Dublin)
Catalytic Processes in Materials ScienceRadioactive element chemistry and processingElectronic and Structural Properties of OxidesDensity functional theoryCeriumElectronic structureValence (chemistry)Density of statesCharge densitySurface statesFermi levelVacancy defectChemistry
Funding
- Enterprise Ireland
- American Chemical Society Petroleum Research Fund
- Engineering and Physical Sciences Research Council
Citations
766
FWCI
12.85
field-weighted impact
References
50
Percentile
99%
vs. same field & year
Citations per year
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From ultrasoft pseudopotentials to the projector augmented-wave method
Physical review. B, Condensed matter · 1999 · 81,446 citations
Electron-energy-loss spectra and the structural stability of nickel oxide: An LSDA+U study
Physical review. B, Condensed matter · 1998 · 14,431 citations
Electron spectroscopy of single crystal and polycrystalline cerium oxide surfaces
Surface Science · 1998 · 971 citations
The Structures of C–Ce2O3+δ, Ce7O12, and Ce11O20
Journal of Solid State Chemistry · 1999 · 346 citations
Computer modeling of surfaces and defects on cerium dioxide
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