DGDFT
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Cited in
(15)- ONETEP
- Adaptive local basis set for Kohn-Sham density functional theory in a discontinuous Galerkin framework. II: force, vibration, and molecular dynamics calculations
- NWChem
- Discontinuous Galerkin method with Voronoi partitioning for quantum simulation of chemistry
- Deep Density: circumventing the Kohn-Sham equations via symmetry preserving neural networks
- Moduli spaces and macromolecules
- RESCU
- ELPA
- Pselinv
- ELSI
- ChASE
- Globally constructed adaptive local basis set for spectral projectors of second order differential operators
- Quantum dynamics with the parallel transport gauge
- Numerical methods for Kohn–Sham density functional theory
- Gaussian basis implementation of the charge patching method
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