Related papers: Separable Dual Space Gaussian Pseudo-potentials
One of the few methods for generating efficient function spaces for multi-D Schrodinger eigenproblems is given by Garashchuk and Light in J.Chem.Phys. 114 (2001) 3929. Their Gaussian basis functions are wider and sparser in high potential…
Sharing the spectrum with in-band full-duplex (FD) primary users (PU) is a challenging and interesting problem in the underlay cognitive radio (CR) systems. The self-interference introduced at the primary network may dramatically impede the…
Noncollinear (NC) magnetism and spin-orbit coupling (SOC) are indispensable for predictive ab initio materials simulations with pronounced relativistic effects and magnetic frustration, yet they significantly increase the cost of…
We consider the time-continuous doubly-dispersive channel with additive Gaussian noise and establish a capacity formula for the case where the channel correlation operator is represented by a symbol which is periodic in time and fulfills…
We show that quasiparticle (QP) energies as calculated in the $GW$ approximation converge to the wrong value using the projector augmented wave (PAW) method, since the overlap integrals between occupied orbitals and high energy, plane wave…
Supersymmetric quantum mechanics (SUSY QM) is a powerful tool for generating new potentials with known spectra departing from an initial solvable one. In these lecture notes we will present some general formulas concerning SUSY QM of first…
Excited-state calculations, notably for quasiparticle band structures, are nowadays routinely performed within the GW approximation for the electronic self-energy. Nevertheless, certain numerical approximations and simplifications are still…
The pseudospectral method is a powerful tool for finding highly precise solutions of Schr\"{o}dinger's equation for few-electron problems. We extend the method's scope to wave functions with non-zero angular momentum and test it on several…
We introduce a new technique for reducing the dimension of the ambient space of low-degree polynomials in the Gaussian space while preserving their relative correlation structure, analogous to the Johnson-Lindenstrauss lemma. As…
By putting two harmonic oscillator potential $x^2$ side by side with a separation $2d$, two exactly solvable piecewise analytic quantum systems with a free parameter $d>0$ are obtained. Due to the mirror symmetry, their eigenvalues $E$ for…
We present polynomial Poisson algebras for the 8 classical potentials in two-dimensional Euclidian space that separate in cartesian coordinates and allow a third order integral of motion. Some of the classical superintegrale potentials do…
Standard sparse pseudo-input approximations to the Gaussian process (GP) cannot handle complex functions well. Sparse spectrum alternatives attempt to answer this but are known to over-fit. We suggest the use of variational inference for…
Stochastic matrices and positive maps in matrix algebras proved to be very important tools for analysing classical and quantum systems. In particular they represent a natural set of transformations for classical and quantum states,…
The three dimensional superintegrable systems with quadratic integrals of motion have five functionally independent integrals, one among them is the Hamiltonian. Kalnins, Kress and Miller have proved that in the case of non degenerate…
The importance of the theory of pseudo-differential operators in the study of non linear integrable systems is point out. Principally, the algebra $\Xi $ of nonlinear (local and nonlocal) differential operators, acting on the ring of…
Computing capacity of Gaussian Interference Channel (GIC) is complex since knowledge of input distributions is needed to find the mutual information terms in closed forms, which should be optimized over input distributions and associated…
In some cases, computational benefit can be gained by exploring the hyper parameter space using a deterministic set of grid points instead of a Markov chain. We view this as a numerical integration problem and make three unique…
Partition of unity networks (POU-Nets) have been shown capable of realizing algebraic convergence rates for regression and solution of PDEs, but require empirical tuning of training parameters. We enrich POU-Nets with a Gaussian noise model…
We address periodic-image errors arising from the use of periodic boundary conditions to describe systems that do not exhibit full three-dimensional periodicity. The difference between the periodic potential, as straightforwardly obtained…
The quantum capacity of bosonic Gaussian quantum channels can be non-additive in a particularly striking way: a pair of such optical-fiber type channels can individually have zero quantum capacity but super-activate each other such that the…