Concepedia
2019 · 3.4K citations · 0 references
Natural SciencesChemistryPhysicsComputational ChemistryCrystal StructureSolid State PhysicsAb Initio MethodsCrystal LatticeCrystal SymmetryCrystallographyElectronic Band StructureMolecular Orbital TheoryBasis-set ConvergenceElectronic Structure DeterminationPlane-wave Basis Sets