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Related papers: A spin-adapted Density Matrix Renormalization Grou…

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The Density Matrix Renormalization Group (DMRG) algorithm has been a rising star for the accurate ab initio exploration of Born-Oppenheimer potential energy surfaces in theoretical chemistry. However, owing to its iterative numerical…

Chemical Physics · Physics 2014-05-13 Sebastian F. Keller , Markus Reiher

We present a multiloop pseudofermion functional renormalization group (pffRG) approach to quantum spin systems. As a test case, we study the spin-$\tfrac{1}{2}$ Heisenberg model on the kagome lattice, a prime example of a geometrically…

Strongly Correlated Electrons · Physics 2020-11-04 Julian Thoenniss , Marc K. Ritter , Fabian B. Kugler , Jan von Delft , Matthias Punk

We report cutting-edge performance results via mixed-precision spin adapted ab initio Density Matrix Renormalization Group (DMRG) electronic structure calculations utilizing the Ozaki scheme for emulating FP64 arithmetic through the use of…

Linear response theory for the density matrix renormalization group (DMRG-LRT) was first presented in terms of the DMRG renormalization projectors [Dorando et al., J. Chem. Phys. 130, 184111 (2009)]. Later, with an understanding of the…

Strongly Correlated Electrons · Physics 2014-02-25 Naoki Nakatani , Sebastian Wouters , Dimitri Van Neck , Garnet Kin-Lic Chan

We introduce a strictly single-site DMRG algorithm based on the subspace expansion of the Alternating Minimal Energy (AMEn) method. The proposed new MPS basis enrichment method is sufficient to avoid local minima during the optimisation,…

Strongly Correlated Electrons · Physics 2015-04-14 Claudius Hubig , Ian P. McCulloch , Ulrich Schollwöck , F. Alexander Wolf

We describe in detail the application of the recent non-Abelian Density Matrix Renormalization Group (DMRG) algorithm to the two dimensional t-J model. This extension of the DMRG algorithm allows us to keep the equivalent of twice as many…

Strongly Correlated Electrons · Physics 2015-06-24 I. P. McCulloch , A. R. Bishop , M. Gulacsi

We present the Copupled Cluster (CC) method and the Density matrix Renormalization Grooup (DMRG) method in a unified way, from the perspective of recent developments in tensor product approximation. We present an introduction into recently…

Chemical Physics · Physics 2017-11-22 Örs Legeza , Thorsten Rohwedder , Reinhold Schneider , Szilárd Szalay

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

An algorithm for the simulation of the evolution of slightly entangled quantum states has been recently proposed as a tool to study time-dependent phenomena in one-dimensional quantum systems. Its key feature is a time-evolving…

Strongly Correlated Electrons · Physics 2022-08-22 A. J. Daley , C. Kollath , U. Schollwoeck , G. Vidal

We apply the density matrix renormalization group (DMRG) method to a non-equilibrium problem: the asymmetric exclusion process in one dimension. We study the stationary state of the process to calculate the particle density profile…

Statistical Mechanics · Physics 2009-10-30 Yasuhiro Hieida

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

An interaction-round-a-face density-matrix renormalization-group (IRF-DMRG) method is developed for higher integer spin chain models which are rotational invariant. The expressions of the IRF weights associated with the nearest-neighbor…

Statistical Mechanics · Physics 2007-05-23 Tatsuaki Wada

We use CheMPS2, our free open-source spin-adapted implementation of the density matrix renormalization group (DMRG) [Wouters et al., Comput. Phys. Commun. 185, 1501 (2014)], to study the lowest singlet, triplet, and quintet states of the…

We use the density matrix renormalization group (DMRG) method to study the ground and low-lying excited states of three kinds of uniform and dimerized alternating spin chains. The DMRG procedure is also employed to obtain low-temperature…

Strongly Correlated Electrons · Physics 2009-10-30 Swapan K. Pati , S. Ramasesha , Diptiman Sen

The tensor train approximation of electronic wave functions lies at the core of the QC-DMRG (Quantum Chemistry Density Matrix Renormalization Group) method, a recent state-of-the-art method for numerically solving the $N$-electron…

Numerical Analysis · Mathematics 2020-02-19 Mi-Song Dupuy , Gero Friesecke

The performance of the density matrix renormalization group (DMRG) is strongly influenced by the choice of the local basis of the underlying physical lattice. We demonstrate that, for the two-dimensional Hubbard model, the hybrid…

Strongly Correlated Electrons · Physics 2017-03-22 G. Ehlers , S. R. White , R. M. Noack

We present a systematic approach for the semiclassical treatment of many-body dynamics of interacting, open spin systems. Our approach overcomes some of the shortcomings of the recently developed discrete truncated Wigner approximation…

Quantum Physics · Physics 2022-12-01 Christopher D. Mink , David Petrosyan , Michael Fleischhauer

We implement and apply time-dependent density matrix renormalization group (TD-DMRG) algorithms at zero and finite temperature to compute the linear absorption and fluorescence spectra of molecular aggregates. Our implementation is within a…

Chemical Physics · Physics 2019-07-30 Jiajun Ren , Zhigang Shuai , Garnet Kin-Lic Chan

The density matrix renormalization group (DMRG) approach is extended to complex-symmetric density matrices characteristic of many-body open quantum systems. Within the continuum shell model, we investigate the interplay between many-body…

Nuclear Theory · Physics 2009-11-11 J. Rotureau , N. Michel , W. Nazarewicz , M. Ploszajczak , J. Dukelsky

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