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We present a spectrum-splitting approach to conduct all-electron Kohn-Sham density functional theory (DFT) calculations by employing Fermi-operator expansion of the Kohn-Sham Hamiltonian. The proposed approach splits the subspace containing…

Computational Physics · Physics 2017-02-01 Phani Motamarri , Vikram Gavini , Kaushik Bhattacharya , Michael Ortiz

In a recent paper we have suggested that the finite temperature density matrix can be computed efficiently by a combination of polynomial expansion and iterative inversion techniques. We present here significant improvements over this…

Materials Science · Physics 2010-10-19 Michele Ceriotti , Thomas D. Kühne , Michele Parrinello

We present a systematic study of asymptotic behavior of (generalised) $\zeta-$functions and heat kernels used in noncommutative geometry and clarify their connections with Dixmier traces. We strengthen and complete a number of results from…

Operator Algebras · Mathematics 2010-10-29 F. A. Sukochev , D. V. Zanin

For an elliptic differential operator $D$ of order $h$ in $n$ dimensions, the spectral $\zeta$-function $\zeta_D(s)$ for $\Re s > \frac{n}{h}$ can be evaluated as an integral over the heat kernel $e^{-t D}$. Here, alternative expressions…

Mathematical Physics · Physics 2019-03-18 Tobias Zingg

We consider integral kernels for functions $f(\hat F)$ of a minimal second-order differential operator $\hat F(\nabla)$ on a curved spacetime. We show that they can be expanded in a functional series, analogous to the DeWitt expansion for…

High Energy Physics - Theory · Physics 2026-02-10 Andrei O. Barvinsky , Alexey E. Kalugin , Władysław Wachowski

Let us consider a time-dependent differential operator quadratic with respect to the phase variables. Let us consider a multiplication operator defined with the help of a "small" matrix-valued function. Under suitable conditions, we give an…

Mathematical Physics · Physics 2013-02-08 Thierry Harge

Fractional differential equations provide a tractable mathematical framework to describe anomalous behavior in complex physical systems, yet they introduce new sensitive model parameters, i.e. derivative orders, in addition to model…

Numerical Analysis · Mathematics 2018-06-05 Ehsan Kharazmi , Mohsen Zayernouri

In this paper we consider the numerical solution of fractional differential equations. In particular, we study a step-by-step graded mesh procedure based on an expansion of the vector field using orthonormal Jacobi polynomials. Under mild…

Numerical Analysis · Mathematics 2024-04-09 L. Brugnano , K. Burrage , P. Burrage , F. Iavernaro

We study the heat kernel for an operator of Laplace type with a $\delta$-function potential concentrated on a closed surface. We derive the general form of the small $t$ asymptotics and calculate explicitly several first heat kernel…

High Energy Physics - Theory · Physics 2008-11-26 M. Bordag , D. V. Vassilevich

Mathematical structure of the reflection coefficients for the one-dimensional Fokker-Planck equation is studied. A new formalism using differential operators is introduced and applied to the analysis in high- and low-energy regions.…

Mathematical Physics · Physics 2011-12-30 Toru Miyazawa

Let $L = -{\rm div}( A(x) \cdot \nabla ) + V(x)$ be a second-order uniformly elliptic operator on $\mathbb{ R }^{n}$ $(n\geq 3)$, where $A(x)$ is a real symmetric matrix satisfying standard ellipticity conditions, and $V$ is a nonnegative…

Functional Analysis · Mathematics 2025-05-09 Honglei Shi , Pengtao Li , Kai Zhao

We calculate the 1/N corrections to the probability distributions of quadratic discrepancies for sets of N random points. This is achieved by the introduction of fermionic variables. We give the diagrammatic expansion up to and including…

High Energy Physics - Phenomenology · Physics 2016-09-06 A. van Hameren , R. Kleiss , C. G. Papadopoulos

Solitons of a nonlinear field interacting with fermions often acquire a fermionic number or an electric charge if fermions carry a charge. We show how the same mechanism (chiral anomaly) gives solitons statistical and rotational properties…

High Energy Physics - Theory · Physics 2009-11-07 A. G. Abanov , P. B. Wiegmann

We propose an experimental scheme to simulate the fractionalization of particle number by using a one-dimensional spin-orbit coupled ultracold fermionic gas. The wanted spin-orbit coupling, a kink-like potential, and a…

Quantum Gases · Physics 2012-12-19 Dan-Wei Zhang , L. -B. Shao , Zheng-Yuan Xue , Hui Yan , Z. D. Wang , Shi-Liang Zhu

A computer aided high temperature expansion of the magnetic susceptibility and the magnetic specific heat is presented and demonstrated for frustrated and unfrustrated spin chains. The results are analytic in nature since the calculations…

Strongly Correlated Electrons · Physics 2009-10-31 Alexander Buehler , Norbert Elstner , Goetz S. Uhrig

We introduce a certain differential (heat) operator on the space of Hermitian Jacobi forms of degree 1, show it's commutation with certain Hecke operators and use it to construct a lift of elliptic cusp forms to Hermitian Jacobi cusp forms.…

Number Theory · Mathematics 2009-10-23 Soumya Das

We give an introduction to the heat kernel technique and zeta function. Two applications are considered. First we derive the high temperature asymptotics of the free energy for boson fields in terms of the heat kernel expansion and zeta…

High Energy Physics - Theory · Physics 2009-11-10 Valery N. Marachevsky

We study the relationship of soliton solutions for electron system with those of the sigma model on the noncommutative space, working directly in the operator formalism. We find that some soliton solutions of the sigma model are also the…

High Energy Physics - Theory · Physics 2009-11-11 H. Otsu , T. Sato , H. Ikemori , S. Kitakado

We address the modification of open heavy-flavor mesons in a hot medium of light mesons within an effective theory approach consistent with chiral and heavy-quark spin-flavor symmetries and the use of the imaginary time formalism to…

High Energy Physics - Phenomenology · Physics 2022-02-16 Gloria Montana , Angels Ramos , Laura Tolos , Juan M. Torres-Rincon

The present paper is a continuation of our work [11], where we introduced a fractional operator calculus related to a fractional ${\psi}-$Fueter operator in the one-dimensional Riemann-Liouville derivative sense in each direction of the…

Complex Variables · Mathematics 2022-09-27 José Oscar González-Cervantes , Juan Bory-Reyes