Machine-learning adaptive Slater-Koster tables in DFTB reach 95% band-structure accuracy across Ni-O compositions by assigning oxidation-state-specific parameters.
Title resolution pending
2 Pith papers cite this work. Polarity classification is still indexing.
2
Pith papers citing it
fields
cond-mat.mtrl-sci 2years
2026 2verdicts
UNVERDICTED 2representative citing papers
Theoretical prediction that light pulses from optical to X-ray regimes cause sub-100 fs demagnetization via electronic excitation and electron redistribution in the magneto-sensitive band, without significant phonon or Heisenberg exchange contributions.
citing papers explorer
-
Adaptive Slater Koster Parameters: Crossing Oxidation States with Density Functional Tight Binding
Machine-learning adaptive Slater-Koster tables in DFTB reach 95% band-structure accuracy across Ni-O compositions by assigning oxidation-state-specific parameters.
-
Electronic mechanism of sub-100-fs demagnetization induced by a femtosecond light pulse
Theoretical prediction that light pulses from optical to X-ray regimes cause sub-100 fs demagnetization via electronic excitation and electron redistribution in the magneto-sensitive band, without significant phonon or Heisenberg exchange contributions.