Study of a smooth interpolation between Hirshfeld and iterative Hirshfeld population analyses
Javier Carmona‐Espíndola, José L. Gázquez
Topics & Concepts
ChemistryInterpolation (computer graphics)Atoms in moleculesDipoleAtomic chargeFunction (biology)Electron densityMoleculeAtomic physicsComputational chemistryElectronQuantum mechanicsClassical mechanicsPhysicsEvolutionary biologyMotion (physics)Organic chemistryBiologyAdvanced Chemical Physics StudiesChemical Thermodynamics and Molecular StructureCrystallography and molecular interactions