Polarization 28 Polarizabilities 18 Density functional theory 16 article 16 chemistry 12 Molecular dynamics 10 Molecular polarizabilities 10 Tensors 10 chemical structure 10 Chiral discrimination 8 Computational methods 8 Hydrogen bonds 8 Molecular polarizability 8 Antioxidants 6 Approximation theory 6 Aqueous solvent effect 6 Atoms 6 DNA 6 Hydrogen Bonding 6 Isomers 6 Models, Chemical 6 Models, Molecular 6 Molecules 6 PCM model 6 Quantum Theory 6 Quantum theory 6 Stereochemistry 6 chemical model 6 priority journal 6 quantum theory 6