Related papers: Fast capacity computation for maze-like configurat…
The superposition of atomic potentials (SAP) approach has recently been shown to be a simple and efficient way to initialize electronic structure calculations [S. Lehtola, J. Chem. Theory Comput. 15, 1593 (2019)]. Here, we study the…
Like the letters in the alphabet forming words, reusing components of a heterogeneous mixture is an efficient strategy for assembling a large number of target structures. Examples range from synthetic DNA origami to proteins self-assembling…
The optimization of expensive-to-evaluate black-box functions over combinatorial structures is an ubiquitous task in machine learning, engineering and the natural sciences. The combinatorial explosion of the search space and costly…
Uniformly quasiconformally homogeneous domains in $\mathbb{R}^n$ carry a transitive collection of $K$-quasiconformal maps for a fixed $K\geq 1.$ In this paper, we study two questions in this setting. The first is to show that…
The effective mass of the quasiparticle excitations in quasi two-dimensional systems is calculated analytically. It is shown that the effective mass increases sharply when the density approaches the critical one of metal-insulator…
Let $K\subset\mathbb{C}$ be a compact set in the plane whose logarithmic capacity $c(K)$ is strictly positive. Let $\mathscr{P}_n(K)$ be the space of monic polynomials of degree $n,$ \emph{all} of whose zeros lie in $K.$ For $p\in…
This paper introduces a framework for uncertainty quantification in regression models defined in metric spaces. Leveraging a newly defined notion of homoscedasticity, we develop a conformal prediction algorithm that offers finite-sample…
It is well-known that several problems related to analysis on $s$-John domains can be unified by certain capacity lower estimates. In this paper, we obtain general lower bounds of $p$-capacity of a compact set $E$ and the central Whitney…
We quantify the internal structure of near-threshold bound, virtual, and resonance states in systems where Coulomb and short-range interactions coexist by evaluating the compositeness. Using the Coulomb-modified effective range expansion,…
We introduce a method to numerically compute equilibrium measures for problems with attractive-repulsive power law kernels of the form $K(x-y) = \frac{|x-y|^\alpha}{\alpha}-\frac{|x-y|^\beta}{\beta}$ using recursively generated banded and…
Compact locally maximal hyperbolic sets are studied via geometrically defined functional spaces that take advantage of the smoothness of the map in a neighborhood of the hyperbolic set. This provides a self-contained theory that not only…
In this work, we study the classic submodular maximization problem under knapsack constraints and beyond. We first present an $(7/16-\varepsilon)$-approximate algorithm for single knapsack constraint, which requires…
We initiate a study of the following problem: Given a continuous domain $\Omega$ along with its convex hull $\mathcal{K}$, a point $A \in \mathcal{K}$ and a prior measure $\mu$ on $\Omega$, find the probability density over $\Omega$ whose…
The capacity of a channel with an energy-harvesting (EH) encoder and a finite battery remains an open problem, even in the noiseless case. A key instance of this scenario is the binary EH channel (BEHC), where the encoder has a unit-sized…
A highly efficient Monte Carlo method for the calculation of the density of states of classical spin systems is presented. As an application, we investigate the density of states Omega_N(E,M) of two- and three-dimensional Ising models with…
We present a method to perform fully selfconsistent density-functional calculations, which scales linearly with the system size and which is well suited for very large systems. It uses strictly localized pseudoatomic orbitals as basis…
Considering a linearly ordered set, we introduce its symmetric version, and endow it with two operations extending supremum and infimum, so as to obtain an algebraic structure close to a commutative ring. We show that imposing symmetry…
We define several notions of a limit point on sequences with domain a barrier in $[\omega]^{<\omega}$ focusing on the two dimensional case $[\omega]^2$. By exploring some natural candidates, we show that countable compactness has a number…
By using the technique of supersymmetric quantum mechanics, we study a quasi exactly solvable extension of the N-particle rational Calogero model with harmonic confining interaction. Such quasi exactly solvable many particle system, whose…
We describe some sufficient conditions, under which smooth and compactly supported functions are or are not dense in the fractional Sobolev space $W^{s,p}(\Omega)$ for an open, bounded set $\Omega\subset\mathbb{R}^{d}$. The density property…