Pages that link to "Item:Q989004"

The following pages link to Non-periodic finite-element formulation of Kohn-Sham density functional theory (Q989004):

Displaying 19 items.

• A variational framework for spectral approximations of Kohn-Sham density functional theory (Q291818) (← links)
• A singularity-based eigenfunction decomposition for Kohn-Sham equations (Q341330) (← links)
• Higher-order adaptive finite-element methods for Kohn-Sham density functional theory (Q348135) (← links)
• Augmented Lagrangian formulation of orbital-free density functional theory (Q349483) (← links)
• A finite element recovery approach to eigenvalue approximations with applications to electronic structure calculations (Q356769) (← links)
• Numerical solution of the Kohn-Sham equation by finite element methods with an adaptive mesh redistribution technique (Q356776) (← links)
• A Kohn-Sham equation solver based on hexahedral finite elements (Q417846) (← links)
• Approximation of the electron density of aluminium clusters in tensor-product format (Q419613) (← links)
• An \(h\)-adaptive finite element solver for the calculations of the electronic structures (Q440645) (← links)
• Gradient flows and variational principles for cardiac electrophysiology: toward efficient and robust numerical simulations of the electrical activity of the heart (Q459139) (← links)
• B-splines and NURBS based finite element methods for Kohn-Sham equations (Q503298) (← links)
• A mesh-free convex approximation scheme for Kohn-sham density functional theory (Q550951) (← links)
• Real-time adaptive finite element solution of time-dependent Kohn-Sham equation (Q728808) (← links)
• A spectral scheme for Kohn-Sham density functional theory of clusters (Q729158) (← links)
• Anderson acceleration of the Jacobi iterative method: an efficient alternative to Krylov methods for large, sparse linear systems (Q729311) (← links)
• NURBS-based non-periodic finite element framework for Kohn-Sham density functional theory calculations (Q777532) (← links)
• Chemical compound design using nuclear charge distributions (Q1617573) (← links)
• SPARC: accurate and efficient finite-difference formulation and parallel implementation of density functional theory: isolated clusters (Q1685671) (← links)
• Geometric discretization of the multidimensional Dirac delta distribution -- application to the Poisson equation with singular source terms (Q1691865) (← links)