DMRG control using an automated Richardson-type error protocol

No abstract is available for this paper.

• Publication year

  2010

• Venue

  Molecular Physics

• Publication date

  2010-02-10

• Fields of study

  Physics

• Identifiers
  DOI 10.1080/00268971003657078
• External record

  Open on Semantic Scholar

• Source metadata

  Semantic Scholar

• No claims are published for this paper.

• No concepts are published for this paper.

• High-performance ab initio density matrix renormalization group method: applicability to large-scale multireference problems for metal compounds.

  2009cited by this paper
• Matrix product states, projected entangled pair states, and variational renormalization group methods for quantum spin systems

  2008cited by this paper
• Frontiers in Quantum Systems in Chemistry and Physics

  2008cited by this paper
• Density matrix renormalization group calculations on relative energies of transition metal complexes and clusters.

  2008cited by this paper
• Ground state fidelity from tensor network representations.

  2007cited by this paper
• Decomposition of density matrix renormalization group states into a Slater determinant basis.

  2007cited by this paper
• Criticality, the area law, and the computational power of projected entangled pair states.

  2006cited by this paper
• Construction of environment states in quantum-chemical density-matrix renormalization group calculations.

  2006cited by this paper
• Multireference correlation in long molecules with the quadratic scaling density matrix renormalization group.

  2006cited by this paper
• Density-matrix renormalization-group algorithms with nonorthogonal orbitals and non-Hermitian operators, and applications to polyenes.

  2005cited by this paper
• Classical simulation of quantum many-body systems with a tree tensor network

  2005cited by this paper
• Convergence behavior of the density-matrix renormalization group algorithm for optimized orbital orderings.

  2005cited by this paper
• Relativistic DMRG calculations on the curve crossing of cesium hydride.

  2005cited by this paper
• Entanglement renormalization.

  2005cited by this paper
• Density matrix renormalization group algorithms with a single center site

  2005cited by this paper
• State-of-the-art density matrix renormalization group and coupled cluster theory studies of the nitrogen binding curve.

  2004cited by this paper
• An algorithm for large scale density matrix renormalization group calculations.

  2004cited by this paper
• The density-matrix renormalization group

  2004cited by this paper
• Quantum chemistry using the density matrix renormalization group II

  2003cited by this paper
• Exact solution (within a triple-zeta, double polarization basis set) of the electronic Schrödinger equation for water

  2003cited by this paper
• Controlling the accuracy of the density-matrix renormalization-group method: The dynamical block state selection approach

  2002cited by this paper
• Highly correlated calculations with a polynomial cost algorithm: A study of the density matrix renormalization group

  2002cited by this paper
• Introduction to Numerical Analysis

  2001cited by this paper
• A Density Matrix Renormalization Group study of Excitons in Dendrimers

  2000cited by this paper
• Full‐CI quantum chemistry using the density matrix renormalization group

  1999cited by this paper
• COMPARISON OF DENSITY MATRIX RENORMALIZATION GROUP CALCULATIONS WITH ELECTRON-HOLE MODELS OF EXCITON BINDING IN CONJUGATED POLYMERS

  1998cited by this paper
• Ab initio quantum chemistry using the density matrix renormalization group

  1998cited by this paper
• The density matrix renormalization group method. Application to the PPP model of a cyclic polyene chain.

  1998cited by this paper
• Strongly correlated electron systems and the density matrix renormalization group

  1998cited by this paper
• Accuracy of the density-matrix renormalization-group method.

  1996cited by this paper
• Full configuration-interaction and state of the art correlation calculations on water in a valence double-zeta basis with polarization functions

  1996cited by this paper
• CLASS OF ANSATZ WAVE FUNCTIONS FOR ONE-DIMENSIONAL SPIN SYSTEMS AND THEIR RELATION TO THE DENSITY MATRIX RENORMALIZATION GROUP

  1996cited by this paper
• Thermodynamic limit of density matrix renormalization.

  1995cited by this paper
• Numerical Recipes in C The Art of Scientific Computing

  1995cited by this paper
• Time dependent wavepackets and periodic orbit assignment

  1994cited by this paper
• Density-matrix algorithms for quantum renormalization groups.

  1993cited by this paper
• Density matrix formulation for quantum renormalization groups.

  1992cited by this paper
• Electron affinities of the first‐row atoms revisited. Systematic basis sets and wave functions

  1992cited by this paper
• Gaussian basis sets for use in correlated molecular calculations. I. The atoms boron through neon and hydrogen

  1989cited by this paper
• Numerical Recipes in C: The Art of Scientific Computing

  1989influential reference
• Exact solution (within a double-zeta basis set) of the schrodinger electronic equation for water

  1981cited by this paper
• Gaussian Basis Functions for Use in Molecular Calculations. III. Contraction of (10s6p) Atomic Basis Sets for the First‐Row Atoms

  1970cited by this paper
• The Approximate Arithmetical Solution by Finite Differences of Physical Problems Involving Differential Equations, with an Application to the Stresses in a Masonry Dam

  year unknowncited by this paper

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  2025cites this paper
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  2024cites this paper
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  2020cites this paper
• Electron correlation effects in cobalt fluorides CoF n

  2020cites this paper
• Iterative Qubit Coupled Cluster approach with efficient screening of generators.

  2019cites this paper
• Multireference Approaches for Excited States of Molecules.

  2018cites this paper
• Quantification of electron correlation effects: Quantum Information Theory vs Method of Increments

  2018cites this paper
• Analysis of electron-correlation effects in strongly correlated systems (N2 and N2+) by applying the density-matrix renormalization-group method and quantum information theory

  2017cites this paper
• Automated Selection of Active Orbital Spaces.

  2016cites this paper
• Density matrix renormalization group for ab initio calculations and associated dynamic correlation methods: A review of theory and applications

  2015cites this paper
• Density-matrix renormalization group algorithm with multi-level active space.

  2015cites this paper
• Multireference electron correlation methods with density matrix renormalisation group reference functions

  2014cites this paper
• Accurate variational electronic structure calculations with the density matrix renormalization group

  2014cites this paper
• The density matrix renormalization group for ab initio quantum chemistry

  2014cites this paper
• Tensor product methods and entanglement optimization for ab initio quantum chemistry

  2014cites this paper
• Excited states structure and processes: Understanding organic light-emitting diodes at the molecular level

  2014cites this paper
• CheMPS2: A free open-source spin-adapted implementation of the density matrix renormalization group for ab initio quantum chemistry

  2013cites this paper
• Multiconfiguration self-consistent field and multireference configuration interaction methods and applications.

  2012cites this paper
• Extended implementation of canonical transformation theory: parallelization and a new level-shifted condition.

  2012cites this paper
• New electron correlation theories for transition metal chemistry.

  2011cites this paper
• Construction of CASCI-type wave functions for very large active spaces.

  2011cites this paper
• Quantification of Computational Uncertainty for Molecular and Continuum Methods in Thermo-Fluid Sciences

  2011cites this paper
• New electron correlation theories and haptic exploration of molecular systems

  2010cites this paper