Repositorios 1

Molecular orbitals Chemical bonds 8 Electronic structure 8 chemistry 8 Configuration interactions 6 Density functional theory 6 Expectation values 6 Molecular dynamics 6 Natural orbitals 6 Slater determinants 6 Wave functions 6 article 6 Absorption spectroscopy 4 Algorithms 4 Binding energy 4 Change of basis 4 Complexation 4 Covalently bonded 4 Crystal atomic structure 4 Electron localization function 4 Electrons 4 Electrospinning 4 Hydrogen bonds 4 Localization procedure 4 Localized molecular orbitals 4 Magnetic Resonance Spectroscopy 4 Magnetic moments 4 Models, Chemical 4 Molecular modeling 4 Molecular structure 4