Research
Research
Research
Research
6,827+ open-access research outputs.
The evolution of protoplanetary disks, especially in the early stages of planetary formation, as dust grows, is the cornerstone of the birth of planets. The mechanisms involved in the growth of sub-mi…
Accurate large-scale Kohn-Sham density functional theory (DFT) calculations are essential for modeling complex material systems, including interfaces, defects, nanoclusters, and twisted two-dimensiona…
Electron backscatter diffraction is a powerful tool for mapping crystallographic microstructures. However, the primary crux to improving orientation accuracy and applying the technique to challenging …
Platinum (Pt) is widely used for carrier-lifetime control in silicon power devices, yet the microscopic nonradiative recombination mechanism of the substitutional platinum ($\text{Pt}_\text{Si}$) dopa…
Kohn-Sham (KS) eigenvalues are routinely compared with angle-resolved photoemission (ARPES) and used as input for many-body methods, yet density functional theory (DFT) assigns them no physical meanin…
Strongly correlated systems have long been a central and highly non-trivial topic in condensed matter physics. At the non-interacting level, strong correlation can be associated with powerful (near) d…
This study explores the density profile of the stellar disk, radially and azimuthally, based on approximately 8.4 million red clump stars selected from Gaia Bp/Rp spectra. After correcting for selecti…
Among the group-IV vacancy color centers in diamond, the SnV holds promise for photonics based quantum applications. In this work, the Tin-Vacancy (SnV) zero-phonon line (ZPL) and its pressure coeffic…
The magnetic excitation spectrum of itinerant magnets exhibits rich and complex spectral features that often complicate interpretation of the underlying physics. For perturbations in the long waveleng…
A sample of 139 young open star clusters closely associated with the Radcliffe wave is considered. Modeling their spatial distribution and kinematics over a time interval of 30 Myrs ago and 30 Myrs in…
In this article, we prove that the quantum $f$-divergence between two normal states on a semifinite von~Neumann algebra is equal to the classical $f$-divergence between two corresponding classical sta…
Metal-organic frameworks (MOFs) are a major target of machine-learning-based property prediction, yet most models assume that a single framework representation maps to a single property value. This as…
The rapidly oscillating chemically peculiar A-type (roAp) stars offer valuable insights into the internal physical processes of all stars, but their study is challenged by their rarity. The large-scal…
Polar metals and noncentrosymmetric superconductors are exceptionally rare, yet their broken inversion symmetry can give rise to emergent electronic phenomena including mixed singlet-triplet supercond…
The orbital degree of freedom in rare-earth nickelates is typically inactive across the temperature-driven metal-insulator transition, where the system develops two inequivalent Ni sites associated wi…
Collective rotations are common in active matter, enhancing cohesion, transport, and mixing. They are typically attributed to chiral non-reciprocal dynamics due to intrinsic particle chirality, torque…
A novel approach for measuring the electrical resistivity of non-magnetic materials using magnetic force microscopy (MFM) is discussed. In this method, MFM detects magnetic fields generated by eddy cu…
We investigate the localized-electron character of the Mott-insulating phase in A$_3$C$_{60}$ using a single-site multiorbital electron model coupled to anisotropic molecular vibrations (Jahn--Teller …
Galactic radio transients (GRTs) are mysterious short-lived (~days to months) radio transients that are quiet at all other wavelengths. Until now, roughly half a dozen such sources have been reported,…
We report on the GPU porting of the Abinit high-performance simulation code for plane-wave DFT calculations. Large-scale electronic structure calculations require computing the electronic wave functio…
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