arXiv subjects

R. Villarreal

Publications and source records attributed to R. Villarreal.

5 recordsLinked to original sources

arXiv2026

Exploring $\alpha$- and $\beta$-decay-induced quenching of the $^{229}$Th nuclear-clock isomer in solid-state hosts

The radiative decay dynamics of an ensemble of $^{229\mathrm{m}}$Th nuclei embedded in CaF$_2$ and MgF$_2$ is investigated. The isomer is populated through $\beta$ decay of $^{229}$Ac following ion implantation, and its radiative decay is detected using vacuum-ultraviolet spectroscopy and measured as a function of time. This allows to identify and quantify the quenching of the radiative-decay signal induced by $\alpha$ or $\beta$ radiation. The quenching probability density is determined in different CaF$_2$ crystals and in a MgF$_2$ crystal, revealing differences up to two orders of magnitude between the investigated samples and a strong dependence on the host material and defect densities. The results support a microscopic mechanism mediated by charge carriers in which electronic excitations created by the decay radiation are captured near Th defects, thereby favoring non-radiative decay channels.

nucl-ex↗

arXiv2020

Metric-driven search for structurally stable inorganic compounds

We report a facile `metric' for the identification of structurally and dynamically (positive definite phonon structure) stable inorganic compounds. The metric considers charge-imbalance within the local substructures in crystalline compounds calculated using first-principles density-functional theory. To exemplify, we chose carbon-based nitrides as it provides a large pool of structurally stable and unstable phases. We showcase how local structural information related to Wyckoff symmetry uniquely identifies four new carbon-nitride phases. The metric predicts three new structurally stable phases of 4 (C)$:$3 (N) stoichiometry, i.e., C$_{4}$N$_{3}$, which is further confirmed by direct phonon calculations. The structurally stable phases also satisfy the thermodynamic stability and mechanical stability criteria. New phases possess extraordinary mechanical properties, similar to diamond, and show insulating bandgap ranging from optimal, 1.45 eV (optimal) to 5.5 eV (large gap). The structural, electronic, and optical properties of Pm(1)-C$_{4}$N$_{3}$, discussed in detail, indicate possible application in optoelectronic and photovoltaic technologies. The way metric is design, it can be used to predict stability of any material with three-dimensional bonding network. The metric was also able to predict structural stability of other nitride polymorphs with 100$\%$ accuracy. We believe that the proposed `Metric' will accelerate the search of unknown and unexplored inorganic compounds by quick filtering of dynamically stable phases without expensive density-functional theory calculations.

cond-mat.mtrl-sci↗

arXiv2017

Electronic coupling between Bi nanolines and the Si(001) substrate: An experimental and theoretical study

Atomic nanolines are one dimensional systems realized by assembling many atoms on a substrate into long arrays. The electronic properties of the nanolines depend on those of the substrate. Here, we demonstrate that to fully understand the electronic properties of Bi nanolines on clean Si(001) several different contributions must be accounted for. Scanning tunneling microscopy reveals a variety of different patterns along the nanolines as the imaging bias is varied. We observe an electronic phase shift of the Bi dimers, associated with imaging atomic p-orbitals, and an electronic coupling between the Bi nanoline and neighbouring Si dimers, which influences the appearance of both. Understanding the interplay between the Bi nanolines and Si substrate could open a novel route to modifying the electronic properties of the nanolines.

cond-mat.mtrl-sci↗

arXiv2015

Structure of self-assembled Mn atom chains on Si(001)

Mn has been found to self-assemble into atomic chains running perpendicular to the surface dimer reconstruction on Si(001). They differ from other atomic chains by a striking asymmetric appearance in filled state scanning tunneling microscopy (STM) images. This has prompted complicated structural models involving up to three Mn atoms per chain unit. Combining STM, atomic force microscopy and density functional theory we find that a simple necklace-like chain of single Mn atoms reproduces all their prominent features, including their asymmetry not captured by current models. The upshot is a remarkably simpler structure for modelling the electronic and magnetic properties of Mn atom chains on Si(001).

cond-mat.mes-hall↗

arXiv2012

Magnetic Phase Diagram of CuO

High resolution ultrasonic velocity measurements have been used to determine the temperature -- magnetic-field phase diagram of the monoclinic multiferroic CuO. A new transition at TN3 = 230 K, corresponding to an intermediate state between the antiferromagnetic non-collinear spiral phase observed below TN2 = 229.3 K and the paramagnetic phase, is revealed. Anomalies associated with a first order transition to the commensurate collinear phase are also observed at TN1 = 213 K. For fields with B along the b axis, a spin-flop transition is detected between 11 T - 13 T at lower temperatures. Moreover, our analysis using a Landau-type free energy clearly reveals the necessity for an incommensurate collinear phase between the spiral and the paramagnetic phase. This model is also relevant to the phase diagrams of other monoclinic multiferroic systems.

cond-mat.mtrl-sci↗