Anataselike Grain Boundary Structure in Rutile Titanium Dioxide
Georg Schusteritsch, Ryo Ishikawa, A. R. Elmaslmane, Kazutoshi Inoue, Keith P. McKenna, Yuichi Ikuhara, Chris J. Pickard
Abstract
and showcase how the atomic structure of even complex internal interfaces can be accurately determined using a combined theoretical and experimental approach.
Topics & Concepts
Grain boundaryRutileAnataseMaterials scienceNanoscopic scaleCrystalliteChemical physicsAtomic unitsNanotechnologyChemistryMicrostructureMetallurgyPhysicsQuantum mechanicsCatalysisBiochemistryOrganic chemistryPhotocatalysisElectronic and Structural Properties of OxidesQuantum Dots Synthesis And PropertiesCopper-based nanomaterials and applications