Showing 1–20 of 29 results
/ Date/ Name
Apr 1, 2011Hydrogen-bonded supramolecular assembly of dyes at nanostructured solar cell interfacesApr 20, 2012GW quasiparticle bandgaps of anatase TiO2 starting from DFT+UJan 7, 2023Crucial role of Fe in determining the hard magnetic properties of Nd$_2$Fe$_{14}$BJun 14, 2018Rare-earth/transition-metal magnets at finite temperature: Self-interaction-corrected relativistic density functional theory in the disordered local moment pictureMar 27, 2019Structural and magnetic properties of GdCo$_{5-x}$Ni$_x$Jul 27, 2016Quantitative analysis of valence photoemission spectra and quasiparticle excitations at chromophore-semiconductor interfacesJun 18, 2019Accurate ground state- and quasiparticle energies: beyond the RPA and GW methods with adiabatic exchange-correlation kernelsOct 16, 2019Temperature-dependent magnetocrystalline anisotropy of rare earth/transition metal permanent magnets from first principles: The light RCo$_5$ (R=Y, La-Gd) intermetallicsJul 27, 2016Structure of a Water Monolayer on the Anatase TiO$_2$(101) SurfaceAug 1, 2017Rare-earth/transition-metal magnetic interactions in pristine and (Ni,Fe)-doped YCo5 and GdCo5Oct 21, 2015Stochastic approach to phonon-assisted optical absorptionJul 22, 2025Long-lived Photoluminescence of Photostable One-dimensional PicoperovskitesAug 11, 2025Anisotropy at twin interfaces in $RT_{12}$ ($R$=rare earth, $T$=transition metal) magnetsAug 22, 2023Theory of defect-induced crystal field perturbations in rare earth magnetsJan 5, 2015Adiabatic-connection fluctuation-dissipation DFT for the structural properties of solids-the renormalized ALDA and electron gas kernelsNov 8, 2017Simple vertex correction improves GW band energies of bulk and two-dimensional crystalsJul 30, 2020Spin orientation and magnetostriction of Tb$_{1-x}$Dy$_{x}$Fe$_{2}$ from first principlesJan 14, 2019First-principles calculations of the magnetocrystalline anisotropy of the prototype 2:17 cell boundary phase Y(Co$_{1-x-y}$Fe$_x$Cu$_y$)$_5$Nov 13, 2023Origin of Incommensurate Magnetic Order in Rare-Earth Magnetic Weyl SemimetalsJul 27, 2016Unified theory of electron-phonon renormalization and phonon-assisted optical absorption