A density functional theory and neutron diffraction study of the ambient condition properties of sub-stoichiometric yttrium hydride
Vedant Mehta, Sven C. Vogel, Aditya Shivprasad, Erik Luther, David A. Andersson, D.V. Rao, Dan Kotlyar, B. Clausen, M. Cooper
Topics & Concepts
Neutron diffractionMaterials scienceStoichiometryLattice constantYttriumHydrideDensity functional theoryVacancy defectCrystallographyPhase (matter)ThermodynamicsCondensed matter physicsDiffractionChemistryCrystal structureMetalMetallurgyPhysical chemistryComputational chemistryPhysicsOrganic chemistryOxideOpticsNuclear Materials and PropertiesHydrogen Storage and MaterialsFusion materials and technologies