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Eric Macke

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Journal of Chemical Theory and Computation|May 31, 2024
Orbital-Resolved DFT<i>+U</i> for Molecules and SolidsEric Macke, Iurii Timrov, Nicola Marzari, et al.
Journal of Chemical Theory and Computation|January 7, 2026
Getting the Manifold Right: The Crucial Role of Orbital Resolution in DFT+<i>U</i> for Mixed d-f Electron CompoundsKinga Warda, Eric Macke, Iurii Timrov, et al.
Npj Computational Materials|June 19, 2025
First-principles Hubbard parameters with automated and reproducible workflowsLorenzo Bastonero, Cristiano Malica, Eric Macke, et al.
Pageof 1

Showing results (1-10 of 3) with videos related to

Sort By:
Pageof 1
Journal of Chemical Theory and Computation|May 31, 2024
Orbital-Resolved DFT<i>+U</i> for Molecules and SolidsEric Macke, Iurii Timrov, Nicola Marzari, et al.
Journal of Chemical Theory and Computation|January 7, 2026
Getting the Manifold Right: The Crucial Role of Orbital Resolution in DFT+<i>U</i> for Mixed d-f Electron CompoundsKinga Warda, Eric Macke, Iurii Timrov, et al.
Npj Computational Materials|June 19, 2025
First-principles Hubbard parameters with automated and reproducible workflowsLorenzo Bastonero, Cristiano Malica, Eric Macke, et al.
Pageof 1