Adsorption of water on UO2 (111) surface: Density functional theory calculations

References

Page 1

	Year	Citations
Generalized Gradient Approximation Made Simple John P. Perdew, Kieron Burke, Matthias Ernzerhof Physical Review Letters Numerical AnalysisEngineeringMachine LearningVariational AnalysisSimple Gga	1996	203.9K
Efficient iterative schemes for<i>ab initio</i>total-energy calculations using a plane-wave basis set Georg Kresse, J. Furthmüller Physical review. B, Condensed matter Numerical AnalysisEngineeringComputational ChemistryEnergy MinimizationEfficient Iterative Schemes	1996	116.1K
<i>Ab initio</i>molecular dynamics for liquid metals Georg Kresse, J. Häfner Physical review. B, Condensed matter Quantum LiquidLiquid MetalsEngineeringPhysicsNatural Sciences	1993	43.6K
Finite Elastic Strain of Cubic Crystals Francis Birch Physical Review EngineeringMechanical EngineeringFinite Elastic StrainContinuum MechanicElasticity (Physics)	1947	6.2K
The structure and properties of water Journal of Molecular Structure Water-rock InteractionHydrogen-bonded LiquidWater TreatmentWater QualityChemistry	1970	2.9K
Dipole correction for surface supercell calculations Lennart Bengtsson Physical review. B, Condensed matter EngineeringArtificial Electric FieldComputational ChemistryPeriodic SupercellChemistry	1999	2K
The Structure and Properties of Water J. B. Hasted Physics Bulletin D. EisenbergPhysicsNatural SciencesWater-rock InteractionHydrogen-bonded Liquid	1969	1.8K
The stability of ionic crystal surfaces P. Tasker Journal of Physics C Solid State Physics Materials ScienceIonic Crystal SurfacesType 1Solid-state IonicEngineering	1979	1.8K
Redox properties of water on the oxidized and reduced surfaces of CeO2 Michael A. Henderson, Craig L. Perkins, Mark Engelhard, Surface Science Oxygen Reduction ReactionChemical EngineeringEngineeringOxidation ResistanceReduced Surfaces	2003	421
Mixed Dissociative and Molecular Adsorption of Water on the Rutile (110) Surface Philip J. D. Lindan, N. M. Harrison, M. J. Gillan Physical Review Letters EngineeringChemistryMixed DissociativeIntermolecular HydrogenChemical Engineering	1998	326

Page 1