Palavra-chave: POLAR TENSOR

CHLOROFORM INFRARED INTENSITY QUÍMICA QUANTICA DIFLUOROETHYLENE QTAIM METHYL FLUORIDE ATOMIC CHARGES CORE ELECTRON ENERGIES METHYLENE FLUORIDE MEAN DIPOLE MOMENT DERIVATIVES ALLENE INFRARED SPECTROSCOPY PRINCIPAL COMPONENT ANALYSIS CORE IONIZATION ENERGIES VIBRATIONAL INTENSITIES EFFECTIVE CHARGES MOLECULAR ORBITAL METHODS DIPOLE MOMENT DERIVATIVE IONIZATION ENERGY INFRARED INTENSITIES FLUOROSILANES ATOMIC POLAR TENSOR ELECTRONEGATIVITY UNIVERSAL BASIS SET