Journal of Materials Chemistry A · 2019 · 26 citations · 41 references
Natural SciencesChemistryPhysicsCondensed Matter PhysicsPhysical ChemistrySolid State PhysicsCrystal ChemistryElectron-phonon InteractionsElectronic Band StructureElectronic Structure Of SolidsHydrogen AtomBand TheoryBarium TitanateHydride Ion ConductorsPolaron TheoryValence BandValence Band StructureValence Electron StructureValence Electronic Structure
The oxyhydride phase of barium titanate, BaTiO<sub>3−x</sub>H<sub>x</sub>, is a mixed hydride ion and electron conductor.
41
Generalized Gradient Approximation Made Simple
John P. Perdew, Kieron Burke, Matthias Ernzerhof · Physical Review Letters · 1996 · 211.5K citations · Full text
Natural Sciences, Chemistry, Physics +16
Projector augmented-wave method
Peter E. Blöchl · Physical review. B, Condensed matter · 1994 · 90.8K citations
Natural Sciences, Chemistry, Physics +17