PARSEC

swMATH22333MaRDI QIDQ34125FDOQ34125

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Cited In (20)

• A symmetry-based decomposition approach to eigenvalue problems
• An efficient Gauss-Newton algorithm for symmetric low-rank product matrix approximations
• Gaussian basis implementation of the charge patching method
• Finite difference approach for the two-dimensional Schrödinger equation with application to scission-neutron emission
• A thick-restart Lanczos algorithm with polynomial filtering for Hermitian eigenvalue problems
• Computing partial spectra with least-squares rational filters
• Real-space density functional theory and time dependent density functional theory using finite/infinite element methods
• Rational approximation to the Fermi-Dirac function with applications in density functional theory
• Block iterative eigensolvers for sequences of correlated eigenvalue problems
• SPARC: accurate and efficient finite-difference formulation and parallel implementation of density functional theory: extended systems
• A robust and efficient implementation of LOBPCG
• A Kohn-Sham equation solver based on hexahedral finite elements
• A spectral scheme for Kohn-Sham density functional theory of clusters
• Chebyshev-filtered subspace iteration method free of sparse diagonalization for solving the Kohn-Sham equation
• A finite element recovery approach to eigenvalue approximations with applications to electronic structure calculations
• Block Krylov-Schur method for large symmetric eigenvalue problems
• Cyclic density functional theory: a route to the first principles simulation of bending in nanostructures
• Trace-penalty minimization for large-scale eigenspace computation
• Computational materials science and engineering
• The eigenvalues slicing library (EVSL): algorithms, implementation, and software

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