Pages that link to "Item:Q2870691"

The following pages link to Elliptic Preconditioner for Accelerating the Self-Consistent Field Iteration in Kohn--Sham Density Functional Theory (Q2870691):

Displaying 37 items.

• Anderson acceleration of the Jacobi iterative method: an efficient alternative to Krylov methods for large, sparse linear systems (Q729311) (← links)
• RESCU: a real space electronic structure method (Q729415) (← links)
• Higher-order finite-difference formulation of periodic orbital-free density functional theory (Q729423) (← links)
• SPARC: accurate and efficient finite-difference formulation and parallel implementation of density functional theory: isolated clusters (Q1685671) (← links)
• On accelerating a multilevel correction adaptive finite element method for Kohn-Sham equation (Q2099726) (← links)
• Deep Density: circumventing the Kohn-Sham equations via symmetry preserving neural networks (Q2132596) (← links)
• Numerical continuation method for nonlinear system of scalar and functional equations (Q2207517) (← links)
• Spectral quadrature method for accurate \(\mathcal{O}(N)\) electronic structure calculations of metals and insulators (Q2374018) (← links)
• SPARC: accurate and efficient finite-difference formulation and parallel implementation of density functional theory: extended systems (Q2414434) (← links)
• Anderson acceleration based on the \(\mathcal{H}^{- s}\) Sobolev norm for contractive and noncontractive fixed-point operators (Q2667121) (← links)
• DFT-FE - a massively parallel adaptive finite-element code for large-scale density functional theory calculations (Q2698744) (← links)
• KSSOLV 2.0: an efficient Matlab toolbox for solving the Kohn-Sham equations with plane-wave basis set (Q2700744) (← links)
• Convergence of the EDIIS Algorithm for Nonlinear Equations (Q4613510) (← links)
• Globally Constructed Adaptive Local Basis Set for Spectral Projectors of Second Order Differential Operators (Q4627445) (← links)
• Anderson Acceleration for Nonsmooth Fixed Point Problems (Q5043623) (← links)
• Quantum Dynamics with the Parallel Transport Gauge (Q5112039) (← links)
• Semidefinite Relaxation of Multimarginal Optimal Transport for Strictly Correlated Electrons in Second Quantization (Q5147962) (← links)
• Anderson Acceleration for a Class of Nonsmooth Fixed-Point Problems (Q5161733) (← links)
• Numerical methods for nonlinear equations (Q5230517) (← links)
• Numerical methods for Kohn–Sham density functional theory (Q5230523) (← links)
• Convergence Analysis for Anderson Acceleration (Q5253575) (← links)
• Local Improvement Results for Anderson Acceleration with Inaccurate Function Evaluations (Q5372619) (← links)
• On the Analysis of the Discretized Kohn--Sham Density Functional Theory (Q5499974) (← links)
• A Proximal Gradient Method for Ensemble Density Functional Theory (Q5502093) (← links)
• Adaptively Compressed Polarizability Operator for Accelerating Large Scale <i>Ab Initio</i> Phonon Calculations (Q5737743) (← links)
• Convergent and Orthogonality Preserving Schemes for Approximating the Kohn-Sham Orbitals (Q5885720) (← links)
• Stochastic algorithms for self-consistent calculations of electronic structures (Q5886872) (← links)
• On an improved PDE-based elliptic parameterization method for isogeometric analysis using preconditioned Anderson acceleration (Q6046144) (← links)
• Composite Anderson acceleration method with two window sizes and optimized damping (Q6092230) (← links)
• Multigrid method for nonlinear eigenvalue problems based on Newton iteration (Q6101883) (← links)
• nlTGCR: A Class of Nonlinear Acceleration Procedures Based on Conjugate Residuals (Q6130649) (← links)
• Variational Characterization of Monotone Nonlinear Eigenvector Problems and Geometry of Self-Consistent Field Iteration (Q6139650) (← links)
• Improved Self-consistent Field Iteration for Kohn–Sham Density Functional Theory (Q6150467) (← links)
• A Convergence Analysis of a Structure-Preserving Gradient Flow Method for the All-Electron KohnSham Model (Q6151257) (← links)
• SQDFT: spectral quadrature method for large-scale parallel \(\mathcal{O}(N)\) Kohn-Sham calculations at high temperature (Q6155140) (← links)
• Mathematical Analysis and Numerical Approximations of Density Functional Theory Models for Metallic Systems (Q6178103) (← links)
• Asymptotic convergence analysis and influence of initial guesses on composite Anderson acceleration (Q6185810) (← links)