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Papers matching “electron density” 10

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Phonons from Density-Functional Perturbation Theory using the All-Electron Full-Potential Linearized Augmented Plane-Wave Method FLEUR
2023 Zenodo (CERN European Organization for Nuclear Research) dataset Engineering Semiconductor materials and devices Open access

Alexander Neukirchen

0

citations
Phonons from Density-Functional Perturbation Theory using the All-Electron Full-Potential Linearized Augmented Plane-Wave Method FLEUR
2023 Zenodo (CERN European Organization for Nuclear Research) dataset Engineering Semiconductor materials and devices Open access

Alexander Neukirchen

0

citations
Getting the manifold right: The crucial role of orbital resolution in DFT+U for mixed d-f electron compounds
2025 NCCR MARVEL dataset Open access

Kinga Warda, Eric Macke, Iurii Timrov, Lucio Colombi Ciacchi, Piotr M. Kowalski

2

citations
Getting the manifold right: The crucial role of orbital resolution in DFT+U for mixed d-f electron compounds
2025 NCCR MARVEL dataset Open access

Kinga Warda, Eric Macke, Iurii Timrov, Lucio Colombi Ciacchi, Piotr M. Kowalski

0

citations
Recalculated scattering factors for the refinement in olex2 with NoSpherA2
2026 Zenodo (CERN European Organization for Nuclear Research) dataset Open access

Florian Kleemiss, Daniel Brüx

0

citations
Recalculated scattering factors for the refinement in olex2 with NoSpherA2
2026 Zenodo (CERN European Organization for Nuclear Research) dataset Open access

Florian Kleemiss, Daniel Brüx

0

citations
Replication Data for: "On the Role of the Binding Agent in Silver-Based Low-Temperature Electroreduction of CO2 to CO with Flowing Aqueous Electrolyte"
2026 Jülich DATA dataset Open access

Simon Emken, Kristina Froehlich, Alexander Bauer, Eva Jodat, André Karl, Rüdiger‐A. Eichel

0

citations
Replication Data for: Mapping Proton and Carbon Dioxide Electrocatalytic Reductions at a Rh Complex by In Situ Spectroelectrochemical NMR
2025 JuSER (Forschungszentrum Jülich) dataset Energy CO2 Reduction Techniques and Catalysts Open access

0

citations
Multiband anisotropic superconductivity in 2H-NbSe2 revealed by ab-initio Kohn--Sham Bogoliubov--de Gennes calculations
2026 NCCR MARVEL dataset Open access

Mohammad Hemmati, Stefan Blügel, Philipp Rüßmann

0

citations
Multiband anisotropic superconductivity in 2H-NbSe2 revealed by ab-initio Kohn--Sham Bogoliubov--de Gennes calculations
2026 NCCR MARVEL dataset Open access

Mohammad Hemmati, Stefan Blügel, Philipp Rüßmann

0

citations

10 results