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An approximate relativistic two-component Hamiltonian for use in molecular electronic structure calculations is derived in the form of a sum of fixed atom-centered kinetic and spin-orbit operators added to the non-relativistic Hamiltonian.…

Chemical Physics · Physics 2019-02-13 Dimitri N. Laikov

We propose a quantum algorithm for inferring the molecular nuclear spin Hamiltonian from time-resolved measurements of spin-spin correlators, which can be obtained via nuclear magnetic resonance (NMR). We focus on learning the anisotropic…

The variational method and the Hamiltonian formalism of QCD are used to derive relativistic, momentum space integral equations for a quark-antiquark system with an arbitrary number of gluons present. As a first step, the resulting infinite…

High Energy Physics - Phenomenology · Physics 2009-10-31 L. Di Leo , J. W. Darewych

We consider the 1D Dirac operator on the half-line with compactly supported potentials. We study resonances as the poles of scattering matrix or equivalently as the zeros of modified Fredholm determinant. We obtain the following properties…

Spectral Theory · Mathematics 2013-07-10 Alexei Iantchenko , Evgeny Korotyaev

The Extended Hubbard Hamiltonian used by the Condensed Matter community is nothing but a simplified version of the Pariser, Parr and Pople Hamiltonian, well established in the Quantum Chemistry community as a powerful tool to describe the…

Materials Science · Physics 2013-07-16 E. San-Fabián , J. A. Vergés , G. Chiappe , E. Louis

The authors in their previous papers obtained compact, arbitrarily accurate expressions for two-center one- and two-electron relativistic molecular integrals expressed over Slater-type orbitals. In this present study, the accuracy limits of…

Mathematical Physics · Physics 2015-10-28 A. Bagci , P. E. Hoggan

It is generally acknowledged that neither the Klein-Gordon equation nor the Dirac Hamiltonian can produce sound solitary-particle relativistic quantum mechanics due to the ill effects of their negative-energy solutions; instead their…

General Physics · Physics 2009-09-23 Steven Kenneth Kauffmann

We show that the spectrum of the Dirac operator in complex Langevin simulations of QCD at non-zero chemical potential must behave in a way which is radically different from the one in simulations with ordinary non-complexified gauge fields:…

High Energy Physics - Lattice · Physics 2015-03-05 K. Splittorff

A new aspect of understanding a Fano absorption spectrum is presented in terms of the complex spectral analysis. The absorption spectrum of an impurity embedded in semi-infinite superlattice is investigated. The boundary condition on the…

Quantum Physics · Physics 2017-12-06 Taku Fukuta , Savannah Garmon , Kazuki Kanki , Ken-ichi Noba , Satoshi Tanaka

A tight binding representation of the kicked Harper model is used to obtain an integrable semiclassical Hamiltonian consisting of degenerate "quantized" orbits. New orbits appear when renormalized Harper parameters cross integer multiples…

chao-dyn · Physics 2009-10-31 Indubala I. Satija , Bala Sundaram

Several compact $sssc\bar c$ pentaquark resonances are predicted in a potential quark model. The Hamiltonian is the best available one, which reproduces the masses of the low-lying charmed and strange hadrons well. Full five-body…

Nuclear Theory · Physics 2019-10-16 Qi Meng , Emiko Hiyama , Kadir Utku Can , Philipp Gubler , Makoto Oka , Atsushi Hosaka , Hongshi Zong

The relative power of quantum algorithms, using an adaptive access to quantum devices, versus classical post-processing methods that rely only on an initial quantum data set, remains the subject of active debate. Here, we present evidence…

Quantum Physics · Physics 2025-10-02 Oleksandr Kyriienko , Chukwudubem Umeano , Zoë Holmes

Potential resonances are usually investigated either directly in the complex energy plane or indirectly in the complex angular momentum plane. Another formulation complementing these two is presented in this work. It is an indirect method…

Mathematical Physics · Physics 2009-11-10 A. D. Alhaidari

Two different "wave chaotic" systems, involving complex eigenvalues or resonances, can be analyzed using common semiclassical methods. In particular, one obtains fractal Weyl upper bounds for the density of resonances/eigenvalues near the…

Analysis of PDEs · Mathematics 2017-08-23 Stéphane Nonnenmacher

We develop a resonance chiral theory without any a priori limitation on the number of derivatives in the hadronic operators. Through an exhaustive analysis of the resonance lagrangian and by means of field redefinitions, we find that the…

High Energy Physics - Phenomenology · Physics 2008-11-26 L. Y. Xiao , J. J. Sanz-Cillero

We investigate the eigenvalue spectrum of the staggered Dirac matrix in two color QCD at finite chemical potential. The profiles of complex eigenvalues close to the origin are compared to a complex generalization of the chiral Gaussian…

High Energy Physics - Lattice · Physics 2008-11-26 Gernot Akemann , Elmar Bittner , Maria-Paola Lombardo , Harald Markum , Rainer Pullirsch

We show how to introduce a quark chemical potential in the overlap Dirac operator. The resulting operator satisfies a Ginsparg-Wilson relation and has exact zero modes. It is no longer gamma_5-hermitian, but its nonreal eigenvalues still…

High Energy Physics - Lattice · Physics 2009-01-14 Jacques Bloch , Tilo Wettig

The Dirac equation with mass and axial chemical potential is solved analytically obtaining the mode spinors and corresponding projection operators giving the spectral representations of the principal conserved operators. In this framework,…

High Energy Physics - Theory · Physics 2025-06-24 Ion I. Cotaescu

Machine learning driven interatomic potentials, including Gaussian approximation potential (GAP) models, are emerging tools for atomistic simulations. Here, we address the methodological question of how one can fit GAP models that…

Materials Science · Physics 2020-08-20 Janine George , Geoffroy Hautier , Albert P. Bartók , Gábor Csányi , Volker L. Deringer

Quantum resonances described by non-Hermitian tridiagonal-matrix Hamiltonians $H$ with complex energy eigenvalues are considered. The method of evaluation of quantities $\sigma_n$ known as the singular values of $H$ is proposed. Its basic…

Mathematical Physics · Physics 2025-05-12 Miloslav Znojil
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