Related papers: Clarifying the Ti-V Phase Diagram Using First-Prin…
The thermodynamic and kinetic properties of mono and di-vacancy defects in cubic (para-electric) barium titanate are studied by means of density-functional theory calculations. It is determined which vacancy types prevail for given…
Recent interest in the study of color superconductivity has focused on the regime of high baryon density where perturbative QCD may be employed. Based on the dominant one-gluon-exchange interaction, both the transition temperature and zero…
This study utilises linear-scaling density functional theory (DFT) and develops a new machine-learning potential for carbon and nitrogen (GAP-CN), based on the carbon potential (GAP20), to investigate the interaction between carbon…
The remarkable properties of toroidal metasurfaces, featuring ultrahigh-Q bound states in the continuum (BIC) resonances and nonradiating anapole modes, have garnered significant attention. The active manipulation of quasi-BIC resonance…
Using unbiased Monte Carlo simulations and variational analysis, we present the ground state and finite temperature phase diagrams of an exactly solvable spin-orbital model with Kitaev-type interactions on a square lattice. We show that an…
We measured the rate of velocity-changing collisions (VCCs) between alkali atoms and background gas in buffer-gas-free anti-relaxation-coated cells. The average VCC rate in paraffin-coated rubidium vapor cells prepared in this work was $1…
We characterize a high-density sample of negatively charged silicon-vacancy (SiV$^-$) centers in diamond using collinear optical multidimensional coherent spectroscopy. By comparing the results of complementary signal detection schemes, we…
Turbulent mixing layers (TMLs) are ubiquitous in multiphase gas. They can potentially explain observations of high ions such as O VI, which have significant observed column densities despite short cooling times. Previously, we showed that…
The negatively charged nickel vacancy center (NiV$^-$) in diamond is a promising spin qubit candidate with predicted inversion symmetry, large ground state spin orbit splitting to limit phonon-induced decoherence, and emission in the…
New refractory alloys are being continuously designed and characterised for applications requiring good high-temperature mechanical properties and stability. Computational design from atomistic simulations is limited by interatomic…
Following an established protocol of science, that results must be reproducible, we examine the Gaussian fits to Galactic 21-cm emission profiles obtained by two seemingly complementary methods: the semi-automated approach based on the…
The Li-Sn binary system has been the focus of extensive research because it features Li-rich alloys with potential applications as battery anodes. Our present re-examination of the binary system with a combination of machine learning and ab…
We present a phase diagram study of the O(4) model as an effective theory for 2-flavor QCD. In the chiral limit, both theories perform spontaneous symmetry breaking with isomorphic groups, which suggests that they belong to the same…
The experimental determination of eutectic points is a long-established and widely used technique, but it is generally only practical for systems with relatively low melting points. Many modern, promising materials, however, are…
Continuum-buried defect states in semiconductors are generally expected to be optically inactive due to their strong coupling to continuum bands. Here, we show that such defects can instead host radiative electronic bound states in the…
Ti/Al multilayer thin films with precise thickness have been deposited using a combination of dc and rf magnetron sputtering techniques. Cross-sectional transmission electron microscopy (TEM) revealed unmixed fifteen parallel and alternate…
The phase diagram of a material is of central importance to describe the properties and behaviour of a condensed matter system. We prove that the general task of determining the quantum phase diagram of a many-body Hamiltonian is…
Two-dimensional (2D) group V elemental materials have attracted widespread attention due to their nonzero band gap while displaying high electron mobility. Using first-principles calculations, we propose a series of new elemental bilayers…
We investigate the steady-state phases of the one-dimensional quantum contact process model. We present the Liouvillian gap in the thermodynamic limit and uncover the metastability of the system. Exploiting the mean-field approximations…
A metastable phase has important physical implications, since it may form vacuum bubbles detectable experimentally, whereas an unstable vacuum instantly explodes. It is well known, due to chiral symmetry breaking, there are at least two…