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We have studied the Metal-Insulator like Transition (MIT) in lithium and beryllium ring-shaped clusters through ab initio Density Matrix Renormalization Group (DMRG) method. Performing accurate calculations for different interatomic…

Strongly Correlated Electrons · Physics 2015-06-22 E. Fertitta , B. Paulus , G. Barcza , Ö. Legeza

Accurate electronic structure calculations are essential in modern materials science, but strongly correlated systems pose a significant challenge due to their computational cost. Traditional methods, such as complete active space…

Chemical Physics · Physics 2024-12-11 Pavlo Golub , Chao Yang , Vojtěch Vlček , Libor Veis

The ground-state and low-energy excitations of quantum Hall systems are studied by the density matrix renormalization group (DMRG) method. From the ground-state pair correlation functions and low-energy excitions, the ground-state phase…

Strongly Correlated Electrons · Physics 2009-06-08 Naokazu Shibata

Motivated by the presence of Ising transitions that take place entirely in the singlet sector of frustrated spin-1/2 ladders and spin-1 chains, we study two types of effective dimer models on ladders, a quantum dimer model and a quantum…

Strongly Correlated Electrons · Physics 2019-03-20 Natalia Chepiga , Frédéric Mila

The presence of many degenerate $d/f$ orbitals makes polynuclear transition metal compounds such as iron-sulfur clusters in nitrogenase challenging for state-of-the-art quantum chemistry methods. To address this challenge, we present the…

Chemical Physics · Physics 2023-12-22 Chunyang Xiang , Weile Jia , Wei-Hai Fang , Zhendong Li

Tensor renormalization group, originally devised as a numerical technique, is emerging as a rigorous analytical framework for studying lattice models in statistical physics. Here we introduce a new renormalization map - the 2x1 map - which…

Statistical Mechanics · Physics 2025-06-05 Nikolay Ebel , Tom Kennedy , Slava Rychkov

A new approach to large-scale nuclear structure calculations, based on the Density Matrix Renormalization Group (DMRG), is described. The method is tested in the context of a problem involving many identical nucleons constrained to move in…

Nuclear Theory · Physics 2011-05-12 J. Dukelsky , S. Pittel

We present an infinite lattice DMRG sweeping procedure which can be used as a replacement for the standard infinite lattice blocking schemes. Although the scheme is generally applicable to any system, its main advantages are the correct…

Strongly Correlated Electrons · Physics 2018-04-25 Peter Schmitteckert

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

Given a Hamiltonian with a continuous symmetry one can generally factorize that symmetry and consider the dynamics on invariant Hilbert Spaces. In Statistical Mechanics this procedure is known as the vertex-IRF map, and in certain cases,…

Statistical Mechanics · Physics 2009-10-28 G. Sierra , T. Nishino

Mixed-precision quantization can potentially achieve the optimal tradeoff between performance and compression rate of deep neural networks, and thus, have been widely investigated. However, it lacks a systematic method to determine the…

Machine Learning · Computer Science 2021-02-23 Huanrui Yang , Lin Duan , Yiran Chen , Hai Li

We present an implementation of the relativistic quantum-chemical density matrix renormalization group (DMRG) approach based on a matrix-product formalism. Our approach allows us to optimize matrix product state (MPS) wave functions…

Chemical Physics · Physics 2017-10-24 Stefano Battaglia , Sebastian Keller , Stefan Knecht

We quantify the emergent complexity of quantum states near quantum critical points on regular 1D lattices, via complex network measures based on quantum mutual information as the adjacency matrix, in direct analogy to quantifying the…

Statistical Mechanics · Physics 2017-12-06 Marc Andrew Valdez , Daniel Jaschke , David L. Vargas , Lincoln D. Carr

The numerical study of anyonic systems is known to be highly challenging due to their non-bosonic, non-fermionic particle exchange statistics, and with the exception of certain models for which analytical solutions exist, very little is…

Strongly Correlated Electrons · Physics 2015-12-25 Robert N. C. Pfeifer , Sukhwinder Singh

Synthetic nonconservative systems with parity-time (PT) symmetric gain-loss structures can exhibit unusual spontaneous symmetry breaking that accompanies spectral singularity. Recent studies on PT symmetry in optics and weakly interacting…

Statistical Mechanics · Physics 2017-06-12 Yuto Ashida , Shunsuke Furukawa , Masahito Ueda

We propose a new implementation of real-space renormalization group (RG) transformations for quantum states on a lattice. Key to this approach is the removal of short-ranged entanglement, similar to Vidal's entanglement renormalization…

Quantum Physics · Physics 2017-07-19 Glen Evenbly

In the beginning of the 1970's, Wilson developed the concept of a fully non-perturbative renormalization group transformation. Applied to the Kondo problem, this numerical renormalization group method (NRG) gave for the first time the full…

Strongly Correlated Electrons · Physics 2008-04-22 Ralf Bulla , Theo Costi , Thomas Pruschke

Numerical renormalization group (NRG) calculations of quantum impurity models, based on a logarithmic discretization in energy of electronic or bosonic Hamiltonians, provide a powerful tool to describe physics involving widely separated…

Strongly Correlated Electrons · Physics 2009-11-13 Axel Freyn , Serge Florens

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

Ions of the same charge inside confining potentials can form crystalline structures which can be controlled by means of the ions density and of the external trap parameters. In particular, a linear chain of trapped ions exhibits a…

Quantum Physics · Physics 2014-03-11 Pietro Silvi , Tommaso Calarco , Giovanna Morigi , Simone Montangero