An Element-Based Generalized Coordination Number for Predicting the Oxygen Binding Energy on Pt<sub>3</sub>M (M = Co, Ni, or Cu) Alloy Nanoparticles
Yūsuke Nanba, Michihisa Koyama
Abstract
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Topics & Concepts
Binding energyCoordination numberAdsorptionNanoparticleDensity functional theoryOxygenAlloyLigand (biochemistry)ChemistryMaterials scienceComputational chemistryCrystallographyPhysical chemistryAtomic physicsNanotechnologyPhysicsMetallurgyIonOrganic chemistryReceptorBiochemistryElectrocatalysts for Energy ConversionMachine Learning in Materials ScienceFuel Cells and Related Materials