Engineering & Materials Science
Density functional theory
100%
Ground state
67%
Wave functions
61%
Excited states
37%
Hamiltonians
26%
Potential energy
24%
Discrete Fourier transforms
24%
Kinetic energy
23%
Computational methods
23%
Probability density function
21%
Derivatives
18%
Physics & Astronomy
self consistent fields
67%
density functional theory
51%
interactions
26%
determinants
23%
functionals
20%
eigenvectors
19%
wave functions
17%
ground state
14%
partitions
10%
potential energy
9%
energy transfer
9%
kinetic energy
8%
scalars
8%
orbitals
7%
optimization
7%
energy
6%
matrices
6%
excitation
5%
Chemical Compounds
Density Functional Theory
41%
Density Matrix
36%
Wave Function
31%
Ground State
21%
Electron Correlation Energy
18%
Kinetic Energy
15%
Hamiltonian
15%
Potential Energy
13%
Partition
13%
Energy
12%
Excited State
10%