Optimizing Nitrogen Reduction Reaction on Nitrides: A Computational Study on Crystallographic Orientation
Matthías Gudmundsson, Viktor Ellingsson, Egill Skúlason, Younes Abghoui
Topics & Concepts
CatalysisDensity functional theoryFacet (psychology)NitrogenCrystalliteAdsorptionDecompositionMaterials scienceNitrideChemistryAmmonia productionNanotechnologyChemical engineeringComputational chemistryCrystallographyPhysical chemistryOrganic chemistryPsychologyEngineeringBig Five personality traitsSocial psychologyPersonalityLayer (electronics)Ammonia Synthesis and Nitrogen ReductionCatalytic Processes in Materials ScienceNanomaterials for catalytic reactions