Keyphrases
Cluster Model
100%
Reaction Energy
100%
Mixed Metal Oxides
100%
Electron Distribution
83%
Mean Absolute Deviation
83%
Energy Value
50%
Range-separated Functional
33%
Hybrid Functional
33%
B3LYP-D3
33%
PBE0
33%
TPSSh
33%
PBE-D3
33%
MN15
33%
Electronic Structure
16%
Chemical Composition
16%
Compositional Structure
16%
Pseudo Jahn-Teller Effect
16%
Exact Exchange
16%
CCSD(T)
16%
Selective Oxidation
16%
DFT Method
16%
Oxidation Catalyst
16%
GGA Functionals
16%
Meta-GGA Functional
16%
Opposite Problem
16%
Local Lattice Structure
16%
Chemistry
Density Functional Theory
100%
Electron Configuration
100%
Cluster Model
100%
Mixed Metal Oxide
100%
Calorific Value
60%
DFT-B3LYP Calculation
40%
Phase Composition
20%
Electronic State
20%
Crystal System
20%
Jahn-Teller Effect
20%
CCSD
20%
Selective Oxidation
20%
Transition Metals
20%
Material Science
Metal Oxide
100%
Electronic Structure
50%
Transition Metal
50%
Crystal Structure
50%
Selective Oxidation
50%
Agricultural and Biological Sciences