Keyphrases
Structural Effect
100%
Generalized Gradient Approximation
100%
Electronic Effect
100%
Magnetic Properties
33%
Magnetic Coupling
33%
Non-separable
33%
Gradient Approximation
33%
3d Electrons
33%
Exchange Integral
33%
Coulomb Integral
33%
Ethanol
16%
Electronic Structure
16%
Electronic Properties
16%
Metal-organic Frameworks (MOFs)
16%
Structural Properties
16%
Antiferromagnetic
16%
Fe(III)
16%
Oxo Ligands
16%
Metal Center
16%
Periodic Boundary Conditions
16%
Kohn-Sham Density Functional Theory
16%
Exchange-correlation Functionals
16%
Powder X-ray Diffraction
16%
Exchange Interaction
16%
Magnetic Susceptibility Measurement
16%
Infrared Spectra
16%
Computational Results
16%
Coupling Parameter
16%
Ethane
16%
Vibrational Properties
16%
Cluster Model
16%
X-ray Diffraction Structure
16%
Charge Balance
16%
Hydroxo Ligand
16%
Metal Oxidation
16%
1,4-benzenedicarboxylate
16%
Coupling Behavior
16%
Metal Addition
16%
Infrared Powder
16%
Structural Dependence
16%
Chemistry
Generalized Gradient Approximation
100%
Nitrous Oxide
100%
electronics
100%
Magnetic Property
33%
Metal Organic Framework
16%
Electronic State
16%
Density Functional Theory
16%
Antiferromagnetic
16%
Periodic Boundary Condition
16%
Electronic Property
16%
Exchange Interaction
16%
Magnetic Susceptibility Measurement
16%
Powder X-Ray Diffractometry
16%
Cluster Model
16%
Infrared Radiation
16%
Material Science
Magnetic Property
100%
Density
50%
Electronic Property
50%
Metal-Organic Framework
50%
Magnetic Susceptibility
50%
Powder X-Ray Diffraction
50%
Oxidant
50%
Physics
Nitrous Oxide
100%
Generalized Gradient Approximation
100%
Magnetic Property
33%
Powder X-Ray Diffraction
16%
Periodic Boundary Condition
16%
Metal Organic Framework
16%
Magnetic Permeability
16%
Infrared Radiation
16%
Density Functional Theory
16%
Chemical Engineering
Metal-Organic Frameworks
100%