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Using time dependent Lyapunov functions, we prove pointwise upper bounds for the heat kernels of some nonautonomous Kolmogorov operators with possibly unbounded drift and diffusion coefficients.

Analysis of PDEs · Mathematics 2013-08-09 M. Kunze , L. Lorenzi , A. Rhandi

Linear-scaling electronic structure methods based on the calculation of moments of the underlying electronic Hamiltonian offer a computationally efficient and numerically robust scheme to drive large-scale atomistic simulations, in which…

Materials Science · Physics 2017-01-09 Eunan J. McEniry , Ralf Drautz

We define some of the programming and system-level challenges facing the application of quantum processing to high-performance computing. Alongside barriers to physical integration, prominent differences in the execution of quantum and…

Quantum Physics · Physics 2017-12-06 Keith A. Britt , Fahd A. Mohiyaddin , Travis S. Humble

We show that not feeling the boundary estimates for heat kernels hold for any non-negative self-adjoint extension of the Laplace operator acting on vector-valued compactly supported functions on a domain in $\mathbb{R}^d$. They are…

Analysis of PDEs · Mathematics 2016-04-05 Liangpan Li , Alexander Strohmaier

Quantum computing raises the possibility of solving a variety of problems in physics that are presently intractable. A number of such problems involves the physics of systems in or near thermal equilibrium. There are two main ways to…

Quantum Physics · Physics 2023-08-16 Carter Ball , Thomas D. Cohen

In the pursuit of numerically identifying the ground state of quantum many-body systems, approximate quantum wavefunction ansatzes are commonly employed. This study focuses on the spectral decomposition of these approximate quantum…

Quantum Physics · Physics 2025-08-29 Yu-Qin Chen , Shi-Xin Zhang

Let $L$ be an elliptic differential operator on a complete connected Riemannian manifold $M$ such that the associated heat kernel has two-sided Gaussian bounds as well as a Gaussian type gradient estimate. Let $L^{(\aa)}$ be the…

Mathematical Physics · Physics 2012-04-24 Feng-Yu Wang , Xicheng Zhang

In recent years, much attention has been paid to the development of techniques which transfer trapped particles to very low temperatures. Here we focus our attention on a heating mechanism which contributes to the finite temperature limit…

Quantum Physics · Physics 2015-05-30 Almut Beige , Andreas Kurcz , Adam Stokes

Accurate radiative transfer coefficients (emissivities, absorptivities, and rotativities) are needed for modeling radiation from relativistically hot, magnetized plasmas such as those found in Event Horizon Telescope sources. Here we…

High Energy Astrophysical Phenomena · Physics 2021-11-03 Andrew Marszewski , Ben S. Prather , Abhishek V. Joshi , Alex Pandya , Charles F. Gammie

This paper introduces a novel, non-deterministic method for embedding data in low-dimensional Euclidean space based on computing realizations of a Gaussian process depending on the geometry of the data. This type of embedding first appeared…

Machine Learning · Computer Science 2024-03-14 Anna C. Gilbert , Kevin O'Neill

We give a detailed presentation of the theory and numerical implementation of an expression for the adiabatic energy flux in extended systems, derived from density-functional theory. This expression can be used to estimate the heat…

Computational Physics · Physics 2021-12-20 Aris Marcolongo , Riccardo Bertossa , Davide Tisi , Stefano Baroni

We derive all heat kernel coefficients for Laplacians acting on scalars, vectors, and tensors on fully symmetric spaces, in any dimension. Final expressions are easy to evaluate and implement, and confirmed independently using spectral sums…

High Energy Physics - Theory · Physics 2020-07-02 Yannick Kluth , Daniel F. Litim

The conformal powers of the Laplacian of a Riemannian metric which are known as the GJMS-operators admit a combinatorial description in terms of the Taylor coefficients of a natural second-order one-parameter family $\H(r;g)$ of…

Differential Geometry · Mathematics 2022-03-28 Andreas Juhl

We establish a new formula for the heat kernel on regular trees in terms of classical I-Bessel functions. Although the formula is explicit, and a proof is given through direct computation, we also provide a conceptual viewpoint using the…

Combinatorics · Mathematics 2013-02-20 Gautam Chinta , Jay Jorgenson , Anders Karlsson

We study new invariants of elliptic partial differential operators acting on sections of a vector bundle over a closed Riemannian manifold that we call the relativistic heat trace and the quantum heat traces. We obtain some reduction…

Mathematical Physics · Physics 2017-02-28 Ivan G Avramidi

Radiative processes, where a photon/neutrino is emitted as a result of a collision or decay of a particle, play a central role in atomic, nuclear and particle physics. Their rate is determined by certain off-diagonal matrix elements with…

Nuclear Theory · Physics 2022-09-22 Paulo F. Bedaque , Ratna Khadka , Gautam Rupak , Muhammad Yusf

We study heat semigroups generated by self-adjoint Laplace operators on metric graphs characterized by the property that the local scattering matrices associated with each vertex of the graph are independent from the spectral parameter. For…

Mathematical Physics · Physics 2008-02-05 Vadim Kostrykin , Jurgen Potthoff , Robert Schrader

Being motivated by physical applications (as the phi^4 model) we calculate the heat kernel coefficients for generalised Laplacians on the Moyal plane containing both left and right multiplications. We found both star-local and star-nonlocal…

High Energy Physics - Theory · Physics 2009-11-11 Dmitri V. Vassilevich

A new web-server called The Molecule Calculator (MolCalc) is presented. The entry page is a molecular editor (JSmol) for interactive molecule building. The resulting structure can then be used to estimate molecular properties such as heats…

Chemical Physics · Physics 2013-07-15 Jan H. Jensen , Jimmy C. Kromann

We consider the asymptotic expansion of the heat kernel of a generalized Laplacian for $t\to 0^+$ and characterize the coefficients $a_k$ of this expansion by a natural intertwining property. In particular we will give a closed formula for…

Differential Geometry · Mathematics 2007-05-23 Gregor Weingart