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This lecture note reviews recently proposed sparse-modeling approaches for efficient ab initio many-body calculations based on the data compression of Green's functions. The sparse-modeling techniques are based on a compact orthogonal…

We propose the sparse modeling approach for quasiclassical theory of superconductivity, which reduces the computational cost of solving the gap equations. The recently proposed sparse modeling approach is based on the fact that the Green's…

Superconductivity · Physics 2023-03-01 Yuki Nagai , Hiroshi Shinaoka

Many-body calculations at the two-particle level require a compact representation of two-particle Green's functions. In this paper, we introduce a sparse sampling scheme in the Matsubara frequency domain as well as a tensor network…

Strongly Correlated Electrons · Physics 2020-01-29 Hiroshi Shinaoka , Dominique Geffroy , Markus Wallerberger , Junya Otsuki , Kazuyoshi Yoshimi , Emanuel Gull , Jan Kuneš

The popular, stable, robust and computationally inexpensive cubic spline interpolation algorithm is adopted and used for finite temperature Green's function calculations of realistic systems. We demonstrate that with appropriate…

Chemical Physics · Physics 2016-11-15 Alexei A. Kananenka , Alicia Rae Welden , Tran Nguyen Lan , Emanuel Gull , Dominika Zgid

We introduce a new interpretation of sparse variational approximations for Gaussian processes using inducing points, which can lead to more scalable algorithms than previous methods. It is based on decomposing a Gaussian process as a sum of…

Machine Learning · Statistics 2024-02-27 Jiaxin Shi , Michalis K. Titsias , Andriy Mnih

The temperature-dependent Matsubara Green's function that is used to describe temperature-dependent behavior is expressed on a numerical grid. While such a grid usually has a couple of hundred points for low-energy model systems, for…

Chemical Physics · Physics 2016-11-15 Alexei A. Kananenka , Jordan J. Phillips , Dominika Zgid

A numerical method is developed for calculating the real time Green's functions of very large sparse Hamiltonian matrices, which exploits the numerical solution of the inhomogeneous time-dependent Schroedinger equation. The method has a…

Computational Physics · Physics 2007-05-23 Toshiaki Iitaka

We introduce sparse-ir, a collection of libraries to efficiently handle imaginary-time propagators, a central object in finite-temperature quantum many-body calculations. We leverage two concepts: firstly, the intermediate representation…

This paper considers the problem of estimating the channel response (or Green's function) between multiple source-receiver pairs. Typically, the channel responses are estimated one-at-a-time: a single source sends out a known probe signal,…

Numerical Analysis · Mathematics 2015-05-18 Justin Romberg , Ramesh Neelamani

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…

Machine Learning · Statistics 2015-03-23 Yarin Gal , Richard Turner

This paper introduces the class of ambiguity sparse processes, containing subsets of popular nonstationary time series such as locally stationary, cyclostationary and uniformly modulated processes. The class also contains aggregations of…

Methodology · Statistics 2015-03-19 Sofia Olhede

The Marchenko method retrieves the responses to virtual sources in the Earth's subsurface from reflection data at the surface, accounting for all orders of multiple reflections. The method is based on two integral representations for…

Geophysics · Physics 2020-11-25 Johno van IJsseldijk , Kees Wapenaar

Gaussian processes (GPs) are widely used in non-parametric Bayesian modeling, and play an important role in various statistical and machine learning applications. In a variety tasks of uncertainty quantification, generating random sample…

Computation · Statistics 2024-08-02 Haoyuan Chen , Rui Tuo

Problems of finite-temperature quantum statistical mechanics can be formulated in terms of imaginary (Euclidean) -time Green's functions and self-energies. In the context of realistic Hamiltonians, the large energy scale of the Hamiltonian…

Statistical Mechanics · Physics 2018-08-17 Emanuel Gull , Sergei Iskakov , Igor Krivenko , Alexander A. Rusakov , Dominika Zgid

This article presents a new method to compute matrices from numerical simulations based on the ideas of sparse sampling and compressed sensing. The method is useful for problems where the determination of the entries of a matrix constitutes…

Chemical Physics · Physics 2014-10-21 Jacob N. Sanders , Xavier Andrade , Alán Aspuru-Guzik

We present an efficient basis for imaginary time Green's functions based on a low rank decomposition of the spectral Lehmann representation. The basis functions are simply a set of well-chosen exponentials, so the corresponding expansion…

Numerical Analysis · Mathematics 2023-07-31 Jason Kaye , Kun Chen , Olivier Parcollet

We formulate an efficient scheme to perform Migdal-Eliashberg calculation considering the retardation effect from first principles. While the conventional approach requires a huge number of Matsubara frequencies, we show that the…

Gaussian Processes (GPs) are highly expressive, probabilistic models. A major limitation is their computational complexity. Naively, exact GP inference requires $\mathcal{O}(N^3)$ computations with $N$ denoting the number of modeled points.…

Machine Learning · Computer Science 2022-06-23 Gordian Edenhofer , Reimar H. Leike , Philipp Frank , Torsten A. Enßlin

Representing spectral densities, real-frequency, and real-time Green's functions of continuous systems by a small discrete set of complex poles is an ubiquitous problem in condensed matter physics, with applications ranging from quantum…

Strongly Correlated Electrons · Physics 2025-06-04 Lei Zhang , André Erpenbeck , Yang Yu , Emanuel Gull

There has been considerable interest in properties of condensed matter at finite temperature, including non-equilibrium behavior and extreme conditions up to the warm dense matter regime. Such behavior is encountered, e.g., in experimental…

Materials Science · Physics 2021-07-28 Tun S. Tan , J. J. Kas , J. J. Rehr
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