KSSOLV

swMATH6806MaRDI QIDQ18881FDOQ18881

Author name not available (Why is that?)

Described by source

• KSSOLV—a MATLAB toolbox for solving the Kohn-Sham equations

Cited In (38)

• A New First-Order Algorithmic Framework for Optimization Problems with Orthogonality Constraints
• Projection-Based Embedding Theory for Solving Kohn--Sham Density Functional Theory
• Projected nonmonotone search methods for optimization with orthogonality constraints
• Compression of the electron repulsion integral tensor in tensor hypercontraction format with cubic scaling cost
• An asymptotic Green's function method for time-dependent Schrödinger equations with application to Kohn-Sham equations
• A vertex-centered and positivity-preserving scheme for anisotropic diffusion problems on arbitrary polygonal grids
• A Proximal Gradient Method for Ensemble Density Functional Theory
• A perturbation-method-based post-processing for the planewave discretization of Kohn-Sham models
• Reduced rank extrapolation applied to electronic structure computations
• A framework of constraint preserving update schemes for optimization on Stiefel manifold
• Maximization of the sum of the trace ratio on the Stiefel manifold. II: computation
• Structured Quasi-Newton Methods for Optimization with Orthogonality Constraints
• A feasible method for optimization with orthogonality constraints
• Preconditioned steepest descent-like methods for symmetric indefinite systems
• Split representation of adaptively compressed polarizability operator
• Low rank approximation in \(G_0W_0\) calculations
• Energy-adaptive Riemannian optimization on the Stiefel manifold
• Preconditioned Locally Harmonic Residual Method for Computing Interior Eigenpairs of Certain Classes of Hermitian Matrices
• Mesh independence of the generalized Davidson algorithm
• Locally optimal and heavy ball GMRES methods
• An \(h\)-adaptive finite element solver for the calculations of the electronic structures
• Chebyshev-filtered subspace iteration method free of sparse diagonalization for solving the Kohn-Sham equation
• A Cascadic Adaptive Finite Element Method for Nonlinear Eigenvalue Problems in Quantum Physics
• Numerical integration for ab initio many-electron self energy calculations within the GW approximation
• Adaptive Quadratically Regularized Newton Method for Riemannian Optimization
• Numerical solution of the Kohn-Sham equation by finite element methods with an adaptive mesh redistribution technique
• Two adaptive scaled gradient projection methods for Stiefel manifold constrained optimization
• A class of smooth exact penalty function methods for optimization problems with orthogonality constraints
• Transportless conjugate gradient for optimization on Stiefel manifold
• Mathematical methods in quantum chemistry. Abstracts from the workshop held March 18--24, 2018
• An asymptotics-based adaptive finite element method for Kohn-Sham equation
• A multilevel correction adaptive finite element method for Kohn-Sham equation
• Adaptive regularized self-consistent field iteration with exact Hessian for electronic structure calculation
• Trace-penalty minimization for large-scale eigenspace computation
• KSSOLV 2.0: an efficient Matlab toolbox for solving the Kohn-Sham equations with plane-wave basis set
• On the Analysis of the Discretized Kohn--Sham Density Functional Theory
• Global convergence of Riemannian line search methods with a Zhang-Hager-type condition
• Parallelizable Algorithms for Optimization Problems with Orthogonality Constraints

This page was built for software: KSSOLV