Engineering
Functionals
100%
Structure Calculation
100%
Adsorption Energy
100%
Bulk Material
66%
Two-Dimensional Materials
66%
2D Material
66%
Electronic Excitation
33%
Production of Methanol
33%
Promising Candidate
33%
Computational Time
33%
Ground State Energy
33%
Genetic Algorithm
33%
Good Agreement
33%
Convergence Performance
33%
Methane
33%
Computational Cost
33%
Ionization Potential
33%
Accurate Calculation
33%
Experimental Value
33%
Chemistry
Density Functional Theory
100%
Electronic State
100%
Two-Dimensional Material
80%
Adsorption Energy
60%
Electron Affinity
20%
Methane
20%
Transition Metal Oxide
20%
Production of Methanol
20%
Ground State
20%
Electronic Excitation
20%
Surface Chemistry
20%
Ionization Potential
20%
Coulomb Potential
20%
Material Science
Electronic Structure Calculation
100%
Two-Dimensional Material
100%
Surface Science
25%
Transition Metal Oxide
25%
Catalysis
25%
Computational Materials Science
25%