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We review the variational principle in the density matrix renormalization group (DMRG) method, which maximizes an approximate partition function within a restricted degrees of freedom; at zero temperature, DMRG mini- mizes the ground state…

Statistical Mechanics · Physics 2009-10-28 T. Nishino , K. Okunishi

In the Density Matrix Renormalization Group (DMRG) algorithm, Hamiltonian symmetries play an important role. Using symmetries, the matrix representation of the Hamiltonian can be blocked. Diagonalizing each matrix block is more efficient…

Strongly Correlated Electrons · Physics 2012-06-29 G. Alvarez

The widely used density matrix renormalization group (DRMG) method often fails to converge in systems with multiple length scales, such as lattice discretizations of continuum models and dilute or weakly doped lattice models. The local…

Quantum Gases · Physics 2012-07-17 M. Dolfi , B. Bauer , M. Troyer , Z. Ristivojevic

Classical probability distributions on sets of sequences can be modeled using quantum states. Here, we do so with a quantum state that is pure and entangled. Because it is entangled, the reduced densities that describe subsystems also carry…

Quantum Physics · Physics 2020-12-10 Tai-Danae Bradley , E. Miles Stoudenmire , John Terilla

The density matrix renormalization group (DMRG) algorithm is a popular alternating minimization scheme for solving high-dimensional optimization problems in the tensor train format. Classical DMRG, however, is based on sequential…

Numerical Analysis · Mathematics 2025-12-09 Laura Grigori , Muhammad Hassan

We use the adaptive time-dependent density matrix renormalization group method (t-DMRG) to study the nonequilibrium dynamics of a benchmark quantum impurity system which has a time-dependent Hamiltonian. This model is a resonant-level…

Strongly Correlated Electrons · Physics 2009-04-01 Cheng Guo , Andreas Weichselbaum , Stefan Kehrein , Tao Xiang , Jan von Delft

We have applied the momentum space version of the Density Matrix Renormalization Group method ($k$-DMRG) in quantum chemistry in order to study the accuracy of the algorithm in the new context. We have shown numerically that it is possible…

Strongly Correlated Electrons · Physics 2009-02-06 O. Legeza , J. Roder , B. A. Hess

Wilson's Numerical Renormalization Group (NRG) is so far the only nonperturbative technique that can reliably access low-energy properties of quantum impurity systems. We present a recent extension of the method, the DM-NRG, which yields…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Walter Hofstetter

The generalization of Density Matrix Renormalization Group (DMRG) approach as implemented in quantum chemistry, to the case of non-orthogonal orbitals is carefully analyzed. This generalization is attractive from the physical point of view…

Strongly Correlated Electrons · Physics 2007-05-23 A. O. Mitrushenkov , Guido Fano , Roberto Linguerri , Paolo Palmieri

We discuss a few simple modifications to time-dependent density matrix renormalization group (DMRG) algorithms which allow to access larger time scales. We specifically aim at beginners and present practical aspects of how to implement…

Strongly Correlated Electrons · Physics 2016-12-14 D. M. Kennes , C. Karrasch

We propose a new concept upon the renormalization group (RG) procedure for an interacting many-electron correlated system in the framework of natural orbitals, and formulate an algorithm for this RG approach. To demonstrate its…

Strongly Correlated Electrons · Physics 2014-02-17 Rong-Qiang He , Zhong-Yi Lu

A momentum-space approach of the density-matrix renormalization-group (DMRG) method is developed. Ground state energies of the Hubbard model are evaluated using this method and compared with exact diagonalization as well as quantum…

Condensed Matter · Physics 2009-10-28 T. Xiang

Although substantial progress has been achieved in solving quantum impurity problems, the numerical renormalization group (NRG) method generally performs poorly when applied to quantum lattice systems in a real-space blocking form. The…

Strongly Correlated Electrons · Physics 2018-09-03 Li-Xiang Cen

We investigate fully self-consistent multiscale quantum-classical algorithms on current generation superconducting quantum computers, in a unified approach to tackle the correlated electronic structure of large systems in both quantum…

We present an efficient protocol leveraging classical computation to support Initial State Preparation for strongly correlated fermionic systems, a critical bottleneck for fault-tolerant quantum simulation. Focusing on nuclear shell model…

Quantum Physics · Physics 2026-03-27 Joe Gibbs , Lukasz Cincio , Chandan Sarma , Zoë Holmes , Paul Stevenson

We study the dynamical density matrix renormalization group (DDMRG) and time-dependent density matrix renormalization group (td-DMRG) algorithms in the ab initio context, to compute dynamical correlation functions of correlated systems. We…

Chemical Physics · Physics 2017-11-21 Enrico Ronca , Zhendong Li , Carlos A. Jimenez-Hoyos , Garnet Kin-Lic Chan

Exploiting symmetries in the numerical renormalization group (NRG) method significantly enhances performance by improving accuracy, increasing computational speed, and optimizing memory efficiency. Published codes focus on continuous…

Strongly Correlated Electrons · Physics 2024-09-19 Aitor Calvo-Fernández , María Blanco-Rey , Asier Eiguren

We describe how to efficiently construct the quantum chemical Hamiltonian operator in matrix product form. We present its implementation as a density matrix renormalization group (DMRG) algorithm for quantum chemical applications in a…

Computational Physics · Physics 2016-01-05 Sebastian Keller , Michele Dolfi , Matthias Troyer , Markus Reiher

We have studied transition metal clusters from a quantum information theory perspective using the density-matrix renormalization group (DMRG) method. We demonstrate the competition between entanglement and interaction localization. We also…

Quantum Physics · Physics 2015-05-19 G. Barcza , Ö. Legeza , K. H. Marti , M. Reiher

We introduce and systematically investigate a novel approach combining the Uhlmann gauge bundle with Density Matrix Renormalization Group (DMRG) and Matrix Product State (MPS) techniques to enhance the representation and preservation of…

Quantum Physics · Physics 2025-07-16 Andrei Tudor Patrascu