SEARCH Articles Figures Tables Absolutely localized molecular orbital Antisymmetrization and Localized Molecular Orbitals Basis localized atomic-like orbitals Beyond Two-Body Interaction Fragment-Localized Kohn-Sham Orbitals via a Singles-CI Procedure Canonical molecular orbitals and localized functions Chemical localized orbitals Combining the Localized Electron and Molecular Orbital Models Delocalization tails of natural localized molecular orbitals Edmiston-Ruedenberg localization molecular orbitals Equivalent localized orbitals Ethylene localized orbitals Ethylene, atomic orbital model localized bonds Formaldehyde, dipole moment localized orbital Fragment Localized Kohn-Sham orbitals Full-potential local orbital method H2 and localized orbitals Hartree-Fock orbitals, localized Individual Gauge for Localized Orbitals Individual gauge for localized molecular orbitals Individual gauge for localized orbitals (IGLO Individual gauge localized orbitals Kohn-Sham orbitals and potentials for beryllium by means of local scaling transformations Local minimum, 339------------------------Localized Molecular Orbitals Local orbital moments Local orbitals Local orbitals Local orbitals general Local-orbital method Localization of molecular orbitals within the RHF method Localization of orbitals Localized Molecular Orbitals Localized Molecular Orbitals Theory Localized Orbitals for Valence Bands LCAO approximation Localized atomic orbitals Localized bond orbital Localized bond orbitals Localized electron model hybrid orbitals Localized electron orbital models Localized electron orbitals Localized functions molecular ‘orbitals Localized gaussian orbitals Localized molecular orbital Localized molecular orbital model Localized molecular orbital/generalized valence Localized molecular orbitals , definition Localized molecular orbitals amplitudes Localized molecular orbitals anionic group, determination Localized molecular orbitals central Localized molecular orbitals different criteria Localized molecular orbitals electric moments Localized molecular orbitals limitations Localized molecular orbitals localization Localized molecular orbitals lone-pair Localized molecular orbitals many electron correlation effects Localized molecular orbitals methods Localized molecular orbitals multipole Localized molecular orbitals occupied Localized molecular orbitals separation Localized molecular orbitals valence bonds Localized molecular orbitals, semiempirical Localized orbital approach Localized orbital locator Localized orbital methods Localized orbital model Localized orbital transformation Localized orbital-local origin Localized orbital-local origin method Localized orbital/local origin chemical shifts Localized orbital/local origin correlation Localized orbital/local origin theory Localized orbitals Edmiston-Ruedenberg Localized orbitals Pipek-Mezey Localized orbitals from delocalized wavefunctions Localized orbitals, local origin Localized orbitals, local origin LORG) method Localized orbitals, local origin resonance Localized orbitals. Population analysis Molecular orbital localization Molecular orbital model combining with localized Molecular orbitals combined with localized Molecular orbitals diatomic molecules localized Molecular orbitals localized orthogonal Natural localized molecular orbital Natural localized molecular orbital NLMO) Natural localized molecular orbital occupied Natural localized molecular orbitals Natural localized orbitals Non-localized molecular orbitals Orbital local-scaling transformation Orbital localization Orbital localization Orbital localized Orbital localized Orbital most localized Orbital vs. Density Electronic Localization in Bonding Orbitals energy-localized Orbitals localization methods Orbitals localized electron model Orbitals localized, electric moments Perturbation configuration interaction using localized orbitals Perturbative Configuration Interaction using Localized Orbitals Perturbative Configuration Interaction with Localized Orbitals Semi-localized orbital Strictly local bond orbitals Strictly localized bond orbital Strictly localized orbitals Symmetry molecular orbitals, local Symmetry of Localized Crystalline Orbitals. Wannier Functions The Localized Orbitals of a CH2 Group The localized molecular orbital (LMO) model VB Wave Functions with Localized Atomic Orbitals Valence Bond Methods Based on Localized Orbitals Valence Bond Self-Consistent Field Method with Localized Orbitals Water localized orbitals Wave function analysis localized molecular orbitals