The Effect of Degrees of Inversion on the Electronic Structure of Spinel NiCo<sub>2</sub>O<sub>4</sub>: A Density Functional Theory Study
Tzu-Chien Chang, Yi‐Ting Lu, Chih‐Heng Lee, Jyoti Gupta, Laurence J. Hardwick, Chi‐Chang Hu, Hsin‐Yi Tiffany Chen
Abstract
for various applications.
Topics & Concepts
SpinelDensity functional theoryOctahedronTetrahedronElectronic structureMaterials scienceCharge densityCrystal structureCondensed matter physicsCrystallographyComputational chemistryChemistryPhysicsQuantum mechanicsMetallurgyMagnetic Properties and Synthesis of FerritesCopper-based nanomaterials and applicationsAdvanced Condensed Matter Physics