Keyphrases
Open-shell
100%
Transition Metal Complexes
100%
Hartree-Fock
100%
Spin Density
100%
Transition Theory
100%
Molecular Orbital Theory
100%
Hyperfine Interactions
50%
Molecular Orbital
50%
One-center
50%
Wave Function
25%
Magnetic Properties
25%
Variational
25%
Near-zero
25%
Matrix Elements
25%
Perovskite
25%
Number of Factors
25%
Clustering Methods
25%
Neutron
25%
Radial Distribution
25%
Angular Momentum
25%
Superexchange
25%
Antiferromagnetic
25%
Molecular Orbital Calculations
25%
All-electron
25%
Ni2+
25%
Comparison Experiment
25%
Molecular Clusters
25%
Self-consistent Field Methods
25%
LCAO Method
25%
Magnetic Form Factor
25%
Crystal Field
25%
Configuration Interaction Calculations
25%
Free Ions
25%
Triatomic
25%
Transition Metal Salts
25%
Core Orbitals
25%
Crystal Field Splitting
25%
Physical Review
25%
Crystalline Environment
25%
Scattering Angle
25%
Molecular Hamiltonian
25%
Splitting Parameter
25%
Zero Scattering
25%
Center Method
25%
Chemistry
Ab Initio Calculation
100%
Transition Metal
100%
Metal Ion
100%
Hyperfine Interaction
66%
Molecular Orbital
66%
Magnetic Property
33%
Antiferromagnetic
33%
Hartree-Fock Calculation
33%
LCAO Calculation
33%
Magnetic Form Factor
33%
Molecular Orbital Method
33%
Crystal Field Splitting
33%
Crystal Field
33%
Configuration Interaction
33%
Angular Momentum
33%
Molecular Cluster
33%
Wave Function
33%
Material Science
Transition Metal
100%
Density
100%
Magnetic Property
25%