Engineering & Materials Science
Density functional theory
100%
Transition metals
98%
Carrier concentration
94%
Kinetic energy
70%
Discrete Fourier transforms
48%
Decomposition
48%
Vacancies
30%
Interfacial energy
27%
Electrons
22%
Ions
20%
Elastic moduli
18%
Physics & Astronomy
functionals
62%
transition metals
55%
flux density
53%
kinetic energy
53%
density functional theory
51%
decomposition
50%
orbitals
47%
pseudopotentials
44%
energy of formation
23%
surface energy
21%
modulus of elasticity
17%
predictions
11%
ions
10%
electrons
9%
interactions
8%
Chemical Compounds
Kinetic Energy
77%
Electron Density
61%
Pseudopotential
56%
Transition Element
48%
Decomposition
43%
Density Functional Theory
41%
Face-Centered Cubic Crystal System
23%
Interfacial Energy
21%
Error
16%
Alloy
15%
Energy
10%