Keyphrases
Density Functional Theory
100%
Invariant Subspace
100%
Lanczos Iteration
100%
Large Systems
50%
Lanczos Algorithm
50%
Smallest Eigenvalue
50%
Largest Eigenvalue
25%
System Yield
25%
Discretized
25%
Eigenvalues
25%
Filter Method
25%
Electronic Structure Calculations
25%
Eigenvector
25%
Real Space
25%
Plane Wave
25%
Matrix-vector Product
25%
Low-pass Filter
25%
Large Matrices
25%
Polynomial Space
25%
Space Discretization
25%
Hermitian Matrix
25%
Hamiltonian Operator
25%
Main Active Ingredients
25%
Computational Materials Science
25%
Conjugate Residual
25%
All-electronic
25%
Partial Reorthogonalization
25%
Orthogonal Basis
25%
Residual Types
25%
Valence Electrons
25%
Mathematics
Density Functional
100%
Polynomial
100%
Matrix
66%
Discretization
66%
Eigenvalue
66%
Small Eigenvalue
66%
Lie Theory
33%
Residuals
33%
Total Number
33%
Hermitian Matrix
33%
Vector Product
33%
Real Space
33%
Orthogonal Basis
33%
Low-Pass Filter
33%
Hamiltonian Operator
33%
Eigenvector
33%
Electronic State
33%
Computer Science
Density Functional Theory
100%
Eigenvalue
100%
Invariant Subspace
100%
Discretization
50%
Polynomial Space
25%
Eigenvector
25%
Matrix Vector Product
25%
Hermitian Matrix
25%
Structure Calculation
25%
Orthogonal Basis
25%
Hamiltonian Operator
25%
Valence Electron
25%
Electronic State
25%
Engineering
Invariant Subspace
100%
Eigenvalue
75%
Discretization
50%
Illustrates
25%
Lowpass Filter
25%
Matrix Vector Product
25%
Structure Calculation
25%
Largest Eigenvalue
25%
Real Space
25%
Eigenvector
25%
Hermitian Matrix
25%
Orthogonal Basis
25%
Electronic State
25%