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In this paper we describe how the density matrix renormalization group (DMRG) can be used for quantum chemical calculations for molecules, as an alternative to traditional methods, such as configuration interaction or coupled cluster…

凝聚态物理 · 物理学 2009-10-31 Steven R. White , Richard L. Martin

In the past two decades, the density matrix renormalization group (DMRG) has emerged as an innovative new method in quantum chemistry relying on a theoretical framework very different from that of traditional electronic structure…

计算物理 · 物理学 2020-02-18 Alberto Baiardi , Markus Reiher

Path integral techniques for the density matrix of a one-dimensional statistical system near a boundary previously employed in black-hole physics are applied to providing a new interpretation of the density matrix renormalization group: its…

统计力学 · 物理学 2008-11-26 Jose Gaite

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…

化学物理 · 物理学 2024-12-11 Pavlo Golub , Chao Yang , Vojtěch Vlček , Libor Veis

In some cases the state of a quantum system with a large number of subsystems can be approximated efficiently by the density matrix renormalization group, which makes use of redundancies in the description of the state. Here we show that…

强关联电子 · 物理学 2009-02-03 Michael J. Hartmann , Javier Prior , Stephen R. Clark , Martin B. Plenio

The Density Matrix Renormalisation Group (DMRG) is an electronic structure method that has recently been applied to ab-initio quantum chemistry. Even at this early stage, it has enabled the solution of many problems that would previously…

Reliable quantum chemical methods for the description of molecules with dense-lying frontier orbitals are needed in the context of many chemical compounds and reactions. Here, we review developments that led to our newcomputational toolbo x…

We present an overview of the Density Matrix Renormalization Group and its connections to Quantum Groups, Matrix Products and Conformal Field Theory. We emphasize some common formal structures in all these theories. We also propose…

强关联电子 · 物理学 2007-05-23 G. Sierra , M. A. Martin-Delgado

The purpose of this paper is (i) to present a generic and fully functional implementation of the density-matrix renormalization group (DMRG) algorithm, and (ii) to describe how to write additional strongly-correlated electron models and…

强关联电子 · 物理学 2015-05-13 G. Alvarez

The density-matrix renormalization group method (DMRG) has established itself over the last decade as the leading method for the simulation of the statics and dynamics of one-dimensional strongly correlated quantum lattice systems. In the…

强关联电子 · 物理学 2011-01-04 Ulrich Schollwoeck

We introduce a versatile and practical framework for applying matrix product state techniques to continuous quantum systems. We divide space into multiple segments and generate continuous basis functions for the many-body state in each…

量子气体 · 物理学 2022-06-09 Shovan Dutta , Anton Buyskikh , Andrew J. Daley , Erich J. Mueller

We report on the current status of recent efforts to develop the Density Matrix Renormalization Group method for use in large-scale nuclear shell-model calculations.

核理论 · 物理学 2011-05-12 S. Pittel , J. Dukelsky , S. Dimitrova , M. Stoitsov

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…

凝聚态物理 · 物理学 2007-05-23 Karen Hallberg

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…

凝聚态物理 · 物理学 2007-05-23 Karen Hallberg

The density matrix renormalization group (DMRG) method and its applications to finite temperatures and two-dimensional systems are reviewed. The basic idea of the original DMRG method, which allows precise study of the ground state…

强关联电子 · 物理学 2009-11-10 Naokazu Shibata

We developed a density matrix renormalization-group technique to study quantum Hall fractions of fast rotating bosons. In this paper we present a discussion of the method together with the results which we obtain in three distinct cases of…

强关联电子 · 物理学 2010-03-31 D. L. Kovrizhin

We investigate the role of entanglement in quantum phase transitions, and show that the success of the density matrix renormalization group (DMRG) in understanding such phase transitions is due to the way it preserves entanglement under…

量子物理 · 物理学 2007-05-23 Tobias J. Osborne , Michael A. Nielsen

Several density-matrix renormalization group methods have been proposed to compute the momentum- and frequency-resolved dynamical correlation functions of low-dimensional strongly correlated systems. The most relevant approaches are…

强关联电子 · 物理学 2009-01-28 Eric Jeckelmann

The density-matrix renormalization group (DMRG) is a numerical algorithm for the efficient truncation of the Hilbert space of low-dimensional strongly correlated quantum systems based on a rather general decimation prescription. This…

强关联电子 · 物理学 2009-11-10 Ulrich Schollwoeck

The renormalization group is a tool that allows one to obtain a reduced description of systems with many degrees of freedom while preserving the relevant features. In the case of quantum systems, in particular, one-dimensional systems…

量子物理 · 物理学 2009-11-13 Jose Gaite
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