Improved Self-consistent Field Iteration for Kohn–Sham Density Functional Theory
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Recommendations
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Cites work
- A Class of Methods for Solving Nonlinear Simultaneous Equations
- An h-adaptive finite element solver for the calculations of the electronic structures
- Electronic Structure
- Elliptic preconditioner for accelerating the self-consistent field iteration in Kohn-Sham density functional theory
- Iterative Procedures for Nonlinear Integral Equations
- On the Convergence of the Self-Consistent Field Iteration for a Class of Nonlinear Eigenvalue Problems
- On the convergence of the self-consistent field iteration in Kohn-Sham density functional theory
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