Dalton

MaRDI QIDQ45620swMATHFDO

Official website https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4171759/

Cited in

(5)

• NURBS-based non-periodic finite element framework for Kohn-Sham density functional theory calculations
• EinSum
• Libint
• Variationally consistent Hellmann-Feynman forces in the finite element formulation of Kohn-Sham density functional theory
• Convergence of the electronic density for a target region in cluster models of a \(\mathrm{NH}_3\) molecular crystal

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