Keyphrases
Surface Energy
100%
Crystal Defects
100%
Energy Density
100%
Density Functional Theory
100%
Theory Application
100%
Crystalline Surface
100%
Defect Energy
75%
Formation Energy
50%
Total Energy
50%
Gallium Arsenide
25%
Hexagonal Close-packed
25%
(100) Surfaces
25%
Density Method
25%
Surface Point
25%
(110) Surface
25%
Surface Zone
25%
Defect Region
25%
Integration Algorithm
25%
Supercells
25%
Atomic Energy
25%
Monovacancy
25%
Energy Density Formalism
25%
Weighted Integration
25%
Gauge Transformation
25%
Vienna Ab Initio Simulation Package
25%
Norm-conserving Pseudopotentials
25%
Ultra-soft Pseudo-potential
25%
Projector Augmented Wave Method
25%
Spatial Energy
25%
Material Science
Density
100%
Energy Density
100%
Surface (Surface Science)
100%
Surface Energy
60%
Gallium Arsenide
20%
Point Defect
20%
Ab Initio Simulation
20%
Chemistry
Density Functional Theory
100%
Interfacial Energy
100%
formation
66%
Crystal Point Defect
33%
Pseudopotential
33%
Nuclear Energy
33%