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Saajid Chowdhury

Publications and source records attributed to Saajid Chowdhury.

6 recordsLinked to original sources

Self-limiting electrostriction of a single ion in an ultracold polar gas: From mesoscopic ions to crystalline molecular rings

We investigate the self-assembly of polar molecules around a single ion immersed in an ultracold, dilute two-dimensional molecular gas. The ion aligns and attracts the molecules through charge-dipole interactions, producing a strong electrostrictive accumulation around the impurity, while intermolecular repulsion limits further densification and favors spatially extended configurations. By combining global optimization with diffusion Monte Carlo, we calculate the evaporation energy as a function of the number of molecules bound to the ion. In contrast to conventional charged and van der Waals clusters, the evaporation energy exhibits a plateau-like dependence on cluster size, reflecting the sequential formation of concentric molecular rings. These structures are governed by the topology of the ion's electric field and by the competition between attractive ion-molecule interactions, repulsive intra-ring interactions, and attractive correlations between neighboring rings, rather than by conventional coordination or icosahedral packing. In the weak-interaction regime, the resulting structures form extended mesoscopic molecular ions, whereas stronger interactions produce increasingly rigid, crystal-like molecular rings. We further analyze their stability against thermal perturbations and the time-dependent ion trap and find that a broad range of clusters remain stable under experimentally relevant conditions. The intermolecular repulsion and dipolar geometry also suppress close-range ion-molecule encounters, suggesting an intrinsic shielding mechanism. Our results establish ion-bound polar-molecule clusters as a distinct class of mesoscopic molecular ions and open a route to studying charged impurities in quantum baths with anisotropic interactions.

cond-mat.quant-gas↗

Coordination-driven magic numbers in protonated argon clusters

The structural properties of rare-gas clusters can be primarily described by a simple sphere packing model or by pairwise interactions. Remarkably, adding a single proton yields a large set of magic numbers that has remained unexplained. In this Letter, we unravel their origin by combining quantum Monte Carlo techniques with many-body ab initio potentials that correctly capture the proton's coordination environment. Thanks to this approach, we find that argon atoms are mainly localized around the classical minimum, resulting in a particularly rigid behavior in stark contrast to lighter rare-gas clusters. Moreover, as cluster size increases, we identify a clear structural transition from many-body coordination-driven stability to a regime dominated by two-body interactions, reflecting a reshaping of the underlying potential energy landscape.

physics.atm-clus↗

On CAT($κ$) surfaces

We study the properties of $\text{CAT}(κ)$ surfaces: length metric spaces homeomorphic to a surface having curvature bounded above in the sense of satisfying the $\text{CAT}(κ)$ condition locally. The main facts about $\text{CAT}(κ)$ surfaces seem to be largely a part of mathematical folklore, and this paper is intended to rectify the situation. We provide a complete proof that $\text{CAT}(κ)$ surfaces have bounded (integral) curvature. This fact allows one to apply the established theory of surfaces of bounded curvature to derive further properties of $\text{CAT}(κ)$ surfaces. We also show that $\text{CAT}(κ)$ surfaces can be approximated by smooth Riemannian surfaces of Gaussian curvature at most $κ$. We do this by giving explicit formulas for smoothing the vertices of model polyhedral surfaces.

math.MG↗

Chaotic scattering and heating in cold ion-atom collisions: two sides of the same coin

We study the classical dynamics of a Paul-trapped ion in a low-density bath of atoms above 1 $μ\textrm{K}$. We find that lower energy collisions with more massive atoms, especially at energies less than the initial micromotion heating, are more likely to form atom-ion complexes. These complexes evolve in a fractal structure for every scattering observable, showing non-hyperbolic chaotic dynamics. To explore the chaotic dynamics, we use a GPU-accelerated methodology allowing us to run over $3\times 10^{8}$ trajectories of a $^{174}$Yb$^+$ and different atoms. As a result, after analyzing the dynamics as a function of the atom species, collision energy, trap parameters, and ion-atom potential depth, we find a link between heating and the onset of chaos in the first atom-ion interaction that occurs when a low-density atomic bath is merged with a trapped ion.

physics.atom-ph↗

GPU-Accelerated MATLAB Software for Atom-Ion Dynamics

We present a MATLAB script which can use GPU acceleration to simulate a trapped ion interacting with a low-density cloud of atoms. This script, called atomiongpu.m, can massively parallelize MD simulations of trajectories of a trapped ion and an atom starting far away. The script uses ode45gpu, which is our optimized and specialized implementation of the Runge-Kutta algorithm used in MATLAB's ODE solver ode45. We first discuss the physical system and show how ode45gpu can solve it up to 22x faster than MATLAB's ode45. Then, we show how to easily modify the inputs to atomiongpu.m to account for different kinds of atoms, ions, atom-ion interactions, trap potentials, simulation parameters, initial conditions, and computational hardware, so that atomiongpu.m automatically finds the probability of complex formation, the distribution of observables such as the scattering angle and complex lifetime, and plots of specific trajectories.

physics.atom-ph↗

Ion solvation in atomic baths: from snowballs to polarons

Solvation, the result of the complicated interplay between solvent-solute and solvent-internal interactions, is one of the most important chemical processes. Consequently, a complete theoretical understanding of solvation seems a heroic task. However, it is possible to elucidate fundamental solvation mechanisms by looking into simpler systems, such as ion solvation in atomic baths. In this work, we study ion solvation by calculating the ground state properties of a single ion in a neutral bath from the high-density regime to the low-density regime, finding common ground for these two, in principle, disparate regimes. Our results indicate that a single $^{174}$Yb$^+$ ion in a bath of $^{7}$Li atoms forms a coordination complex at high densities with a coordination number of 8, with strong electrostriction, characteristic of the snowball effect. On the contrary, treating the atomic bath as a dilute quantum gas at low densities, we find that the ion-atom interaction's short-range plays a significant role in the physics of many-body bound states and polarons. Furthermore, in this regime, we explore the role of a putative ion trap, which drastically affects the binding mechanism of the ion and atoms from a quantum gas. Therefore, our results give a novel insight into the universality of ion-neutral systems in the ultracold regime and the possibilities of observing exotic many-body effects.

cond-mat.quant-gas↗