9 citations · 9 across the 3 of their papers we have counts for
4 papers
All-electron machine-learned orbital-free density functional for periodic CHNO systems
Marc K. Ickler, Andreas Hermann, Fred A. Hamprecht
We introduce STRUCTURES-P, a machine-learned all-electron orbital-free density functional for periodic CHNO systems. Electrostatics are evaluated analytically in an atom-centered G…
Orbital-Free Surrogate Functionals Yield Transferable Interatomic Potentials and Electron Densities
Simon Wagner, Marc K. Ickler, Manuel V. Klockow +2
Orbital-free density functional theory seeks to compute the energy of an electronic system directly from its electron density, avoiding one-electron wave functions and thereby offe…
Stable and Accurate Orbital-Free DFT Powered by Machine Learning
Roman Remme, Tobias Kaczun, Tim Ebert +10
Hohenberg and Kohn have proven that the electronic energy and the one-particle electron density can, in principle, be obtained by minimizing an energy functional with respect to th…
Taming Detection Transformers for Medical Object Detection
Marc K. Ickler, Michael Baumgartner, Saikat Roy +2
The accurate detection of suspicious regions in medical images is an error-prone and time-consuming process required by many routinely performed diagnostic procedures. To support c…