Concepedia

Predicting the performance of oxidation catalysts using descriptor models

Neetika Madaan, N. Raveendran Shiju, Gadi Rothenberg

Catalysis Science & Technology · 2015 · 37 citations · 30 references

Open access

Concepts

Mixed Oxide CatalystsChemical EngineeringCatalytic MaterialEngineeringExperimental ValidationIndustrial CatalysisOxidation CatalystsHeterogeneous CatalysisSimple Heuristic ModelsCatalysisComputational ChemistryChemistryHydrogenCatalyst PreparationCatalytic ProcessChemical KineticsCatalyst Activation

Abstract

Mix & match: we show that combining simple heuristic models with experimental validation is an effective method for optimising supported mixed oxide catalysts.

References

30

Introduction to Solid State Physics

C. Kittel, Heng Fan · American Journal of Physics · 1957 · 22.4K citations

Engineering, Physics, Solid State Physics +6

Effective ionic radii in oxides and fluorides

R. D. Shannon, C. T. Prewitt · Acta Crystallographica Section B · 1969 · 8.5K citations

Materials Science, Inorganic Chemistry, Solid-state Ionic +6

Introduction to solid state physics

Journal of the Franklin Institute · 1956 · 7.2K citations

Engineering, Physics, Condensed Matter Physics +6

Metal–Organic Frameworks: Opportunities for Catalysis

David Farrusseng, Sónia Aguado, Catherine Pinel · Angewandte Chemie International Edition · 2009 · 1.9K citations

Inorganic Chemistry, Chemical Engineering, Engineering +11

Estimation of Electronegativity Values of Elements in Different Valence States

Keyan Li, Dongfeng Xue · The Journal of Physical Chemistry A · 2006 · 816 citations

Materials Science, Engineering, Physics +15