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Neural network (NN) interatomic potentials provide fast prediction of potential energy surfaces, closely matching the accuracy of the electronic structure methods used to produce the training data. However, NN predictions are only reliable…

Machine Learning · Computer Science 2021-08-31 Daniel Schwalbe-Koda , Aik Rui Tan , Rafael Gómez-Bombarelli

The renormalization group (RG) method is extended for global asymptotic analysis of discrete systems. We show that the RG equation in the discretized form leads to difference equations corresponding to the Stuart-Landau or Ginzburg-Landau…

patt-sol · Physics 2009-10-30 T. Kunihiro , J. Matsukidaira

Automatic differentiation (AD) is a technique for computing the derivative of a function represented by a program. This technique is considered as the de-facto standard for computing the differentiation in many machine learning and…

Programming Languages · Computer Science 2022-12-21 Amir Shaikhha , Mathieu Huot , Shabnam Ghasemirad , Andrew Fitzgibbon , Simon Peyton Jones , Dimitrios Vytiniotis

The density matrix renormalization group (DMRG) algorithm is a cornerstone computational method for studying quantum many-body systems, renowned for its accuracy and adaptability. Despite DMRG's broad applicability across fields such as…

Computational Physics · Physics 2026-03-24 Per Sehlstedt , Jan Brandejs , Paolo Bientinesi , Lars Karlsson

The time-dependent numerical renormalization-group approach (TD-NRG), originally devised for tracking the real-time dynamics of quantum-impurity systems following a single quantum quench, is extended to multiple switching events. This…

Mesoscale and Nanoscale Physics · Physics 2012-06-12 Eitan Eidelstein , Avraham Schiller , Fabian Guettge , Frithjof B. Anders

We train machine learning algorithms to infer the entanglement structure of disordered long-range interacting quantum spin chains by learning from the strong disorder renormalisation group (SDRG) method. The system consists of…

Disordered Systems and Neural Networks · Physics 2026-03-06 A. Ustyuzhanin , J. Vahedi , S. Kettemann

We present a renormalization group (RG) procedure which works naturally on a wide class of interacting one-dimension models based on perturbed (possibly strongly) continuum conformal and integrable models. This procedure integrates Kenneth…

Strongly Correlated Electrons · Physics 2016-07-05 Robert M. Konik , Yury Adamov

The Density Matrix Renormalization Group (DMRG) has become a powerful numerical method that can be applied to low-dimensional strongly correlated fermionic and bosonic systems. It allows for a very precise calculation of static, dynamical…

Condensed Matter · Physics 2007-05-23 Karen Hallberg

Using backpropagation to compute gradients of objective functions for optimization has remained a mainstay of machine learning. Backpropagation, or reverse-mode differentiation, is a special case within the general family of automatic…

Machine Learning · Computer Science 2022-02-18 Atılım Güneş Baydin , Barak A. Pearlmutter , Don Syme , Frank Wood , Philip Torr

Algorithmic differentiation (AD) is a set of techniques that provide partial derivatives of computer-implemented functions. Such a function can be supplied to state-of-the-art AD tools via its source code, or via an intermediate…

Mathematical Software · Computer Science 2023-07-10 Max Aehle , Johannes Blühdorn , Max Sagebaum , Nicolas R. Gauger

A hybrid approach to nonequilibrium dynamics of quantum impurity systems is presented. The numerical renormalization group serves as a means to generate a suitable low-energy Hamiltonian, allowing for an accurate evaluation of the real-time…

Strongly Correlated Electrons · Physics 2013-03-20 Fabian Guettge , Frithjof B. Anders , Ulrich Schollwoeck , Eitan Eidelstein , Avraham Schiller

A major advance in density-matrix renormalization group (DMRG) calculations has been achieved by the invention of highly efficient DMRG techniques for the simulation of real-time dynamics of strongly correlated quantum systems in one…

Strongly Correlated Electrons · Physics 2007-05-23 U. Schollwoeck , S. R. White

Differentiable programming, enabled by automatic differentiation (AD), provides a robust framework for gradient-based optimization in computational plasma physics. While optimization is often only used towards design, we demonstrate that it…

Plasma Physics · Physics 2026-03-13 A. S. Joglekar , A. G. R. Thomas , A. L. Milder , K. G. Miller , J. P. Palastro , D. H. Froula

Physicists have had a keen interest in the areas of Artificial Intelligence (AI) and Machine Learning (ML) for some time now, with a special inclination towards unravelling the mechanism at the core of the process of learning. In…

Disordered Systems and Neural Networks · Physics 2022-11-30 Mohak Shukla , Ajay D. Thakur

The Density Matrix Renormalization Group (DMRG) has become a powerful numerical method that can be applied to low-dimensional strongly correlated fermionic and bosonic systems. It allows for a very precise calculation of static, dynamic and…

Condensed Matter · Physics 2007-05-23 Karen Hallberg

The problem of the logarithmic discretization of an arbitrary positive function (such as the density of states) is studied in general terms. Logarithmic discretization has arbitrary high resolution around some chosen point (such as Fermi…

Strongly Correlated Electrons · Physics 2009-08-06 Rok Zitko

Applications of the similarity renormalization group (SRG) approach [F. Wegner, Ann. Phys. 506, 77 (1994), S. D. G{\l}azek and K. G. Wilson, Phys. Rev. D 49, 4214 (1994)] to the formulation of useful many-body theories of electron…

Chemical Physics · Physics 2015-06-19 Francesco A. Evangelista

We summarize our recent results on the large N renormalization group (RG) approach to matrix models for discretized two-dimensional quantum gravity. We derive exact RG equations by solving the reparametrization identities, which reduce…

High Energy Physics - Theory · Physics 2007-05-23 S. Higuchi , C. Itoi , S. Nishigaki , N. Sakai

The practical success of polynomial-time tensor network methods for computing ground states of certain quantum local Hamiltonians has recently been given a sound theoretical basis by Arad, Landau, Vazirani, and Vidick. The convergence…

Statistical Mechanics · Physics 2018-02-14 Brenden Roberts , Thomas Vidick , Olexei I. Motrunich

The renormalization group plays an essential role in many areas of physics, both conceptually and as a practical tool to determine the long-distance low-energy properties of many systems on the one hand and on the other hand search for…

Statistical Mechanics · Physics 2021-05-10 N. Dupuis , L. Canet , A. Eichhorn , W. Metzner , J. M. Pawlowski , M. Tissier , N. Wschebor