相关论文: Uniqueness of Ground State Solutions for a Defocus…
We study a class of mixed local-nonlocal equations with Hartree-type nonlinearities of the form \begin{equation}\label{meqnab} -\Delta u + (-\Delta)^s u + u = (I_\alpha * F(u))\,F'(u) \quad \text{in } \mathbb{R}^N, \end{equation} where $N…
In this paper, we address the existence of ground state solutions for Schrodinger equations in the presence of local and nonlocal operators and two critical nonlinearities associated with each operator. The situation is completely solved in…
In this paper we consider an Hartree-Fock type system made by two Schr\"odinger equations in presence of a Coulomb interacting term and a cooperative pure power and subcritical nonlinearity, driven by a suitable parameter $\beta \geq 0$. We…
Implicit inverse problems, in which noisy observations of a physical quantity are used to infer a nonlinear functional applied to an associated function, are inherently ill posed and often exhibit non uniqueness of solutions. Such problems…
The inverse scattering theory for many-body systems in quantum mechanics is an important and difficult issue not only in physics---atomic physics, molecular physics and nuclear physics---but also mathematics. The major purpose in this paper…
The Hartree-Fock exchange potential is fundamental for capturing quantum mechanical exchange effects but faces critical challenges in large-scale applications due to its nonlocal and computationally intensive nature. This study introduces a…
The Hartree-Fock exchange operator is an integral operator arising in the Hartree-Fock method and replaced by a multiplicative operator (a local potential) in Kohn-Sham density functional theory. This article presents a detailed analysis of…
Alternating-Current Optimal Power Flow (AC-OPF) is framed as a NP-hard non-convex optimization problem that solves for the most economical dispatch of grid generation given the AC-network and device constraints. Although there are no…
Arguments showing that exchange-only optimized effective potential (xOEP) methods, with finite basis sets, cannot in general yield the Hartree-Fock (HF) ground state energy, but a higher one, are given. While the orbital products of a…
The operator method is used to construct the solutions of the problem of the polaron in the strong coupling limit and of the helium atom on the basis of the Hartree-Fock equation. $E_0=-0.1085128052\alpha^2$ is obtained for the polaron…
Accurate modeling of conical intersections is crucial in nonadiabatic molecular dynamics, as these features govern processes such as radiationless transitions and photochemical reactions. Conventional electronic structure methods, including…
We establish uniqueness and radial symmetry of ground states for higher-order nonlinear Schr\"odinger and Hartree equations whose higher-order differentials have small coefficients. As an application, we obtain error estimates for…
We prove the phase segregation phenomenon to occur in the ground state solutions of an interacting system of two self-coupled repulsive Hartree equations for large nonlinear and nonlocal interactions. A self-consistent numerical…
We study the existence of ground state solutions for a class of non-linear pseudo-relativistic Schr\"odinger equations with critical two-body interactions. Such equations are characterized by a nonlocal pseudo-differential operator closely…
Given a linear ordinary differential equation (ODE) on $\RE$ and a set of interface conditions at a finite set of points $I \subset \RE$, we consider the problem of determining another differential equation whose {\it global} solutions…
In this paper, we first provide an alternative proof of the uniqueness of the ground state solution for NLS with inverse square potential and power nonlinearity $|u|^pu$ for all $0<p<\frac 4{d-2}$ in dimensions $d\ge 3$. While the…
This work presents exchange potentials for specific orbitals calculated by inverting Hartree-Fock wavefunctions. This was achieved by using a Depurated Inversion Method. The basic idea of the method relies upon the substitution of…
An implementation of the Hartree-Fock (HF) method capable of robust convergence for well-behaved arbitrary central potentials is presented. The Hartree-Fock equations are converted to a generalized eigenvalue problem by employing a B-spline…
With appropriate hypotheses on the nonlinearity $f$, we prove the existence of a ground state solution $u$ for the problem \[\sqrt{-\Delta+m^2}\, u+Vu=\left(W*F(u)\right)f(u)\ \ \text{in }\ \mathbb{R}^{N},\] where $V$ is a bounded…
This paper shows how a class of non-convex optimization problems constrained by discretized nonlinear partial differential equations may be solved to global optimality using an interior point continuation method. The solution procedure…