Sandra Luber

55PUBLICATIONS
39CO-AUTHORS
Statistical mechanics, physical combinatorics and mathematical aspects of condensed matterOrganic chemical synthesisColloid and surface chemistryRadiation and matterMetal organic frameworks
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Publications (55)

|Jun 17, 2026
Stable, Fast, and Accurate Kohn-Sham Matrix Reconstruction in Gaussian Basis for Open-Shell Molecular and Condensed-Phase Systems via Density Matrix Penalization.

|May 31, 2026
Enzyme-Like Synthetic Cleft for Light-Driven Water-Oxidation Catalysis Via an Oxide Relay Pathway.

|Mar 17, 2026
Atomic-Scale Characterization of Interfacial Water on LaTiO2N(100) Surface.

Deqi Tang, Fabrizio Creazzo, Jakob Praxmair

|Mar 02, 2026
Origin of the Singlet Excited Electronic Energy Shifts in ΔSCF with Fractional Occupation Numbers and Hybrid Density Functionals.

Momir Mališ, Sandra Luber

|Feb 18, 2026
Secondary Coordination Sphere Effects in Macrocycle-Embedded Mononuclear Ru(bda) Water Oxidation Catalysts.

Gourab Das, Daniel A P Friedewald, Deqi Tang

|Nov 10, 2025
Anisotropic Interface Continuum Solvation Model and the Finite-Element Anisotropic Poisson Solver.

Ziwei Chai, Sandra Luber

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Frequent Collaborators

5 joint publications

Eva Vandaele

4 joint publications

Lukas Schreder

3 joint publications

Momir Mališ

3 joint publications

Ziwei Chai