The Density Matrix Renormalization Group Algorithm in Quantum Chemistry (Q57905394)

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The renormalization group and critical phenomena

21 January 2018

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Density-matrix algorithms for quantum renormalization groups.

21 January 2018

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The density-matrix renormalization group

21 January 2018

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Decomposition of density matrix renormalization group states into a Slater determinant basis

21 January 2018

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Multireference correlation in long molecules with the quadratic scaling density matrix renormalization group.

21 January 2018

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Ground state fidelity from tensor network representations

21 January 2018

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An algorithm for large scale density matrix renormalization group calculations.

21 January 2018

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Relativistic DMRG calculations on the curve crossing of cesium hydride

21 January 2018

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The generalized Douglas–Kroll transformation

21 January 2018

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Exact decoupling of the Dirac Hamiltonian. I. General theory

21 January 2018

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Exact decoupling of the Dirac Hamiltonian. II. The generalized Douglas-Kroll-Hess transformation up to arbitrary order

21 January 2018

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Douglas–Kroll–Hess Theory: a relativistic electrons-only theory for chemistry

21 January 2018

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Density-matrix renormalization-group algorithms with nonorthogonal orbitals and non-Hermitian operators, and applications to polyenes

21 January 2018

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Convergence behavior of the density-matrix renormalization group algorithm for optimized orbital orderings

21 January 2018

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Construction of environment states in quantum-chemical density-matrix renormalization group calculations

21 January 2018

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Orbital optimization in the density matrix renormalization group, with applications to polyenes and beta-carotene.

21 January 2018

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Obtaining the two-body density matrix in the density matrix renormalization group method

21 January 2018

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Targeted excited state algorithms

21 January 2018

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The radical character of the acenes: a density matrix renormalization group study

21 January 2018

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Density matrix renormalisation group Lagrangians

21 January 2018

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On the spin and symmetry adaptation of the density matrix renormalization group method

21 January 2018

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Density matrix renormalization group calculations on relative energies of transition metal complexes and clusters

21 January 2018

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Reparameterization of hybrid functionals based on energy differences of states of different multiplicity

21 January 2018

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Theoretical Study of the Fe(phen)2(NCS)2Spin-Crossover Complex with Reparametrized Density Functionals

21 January 2018

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On the definition of local spin in relativistic and nonrelativistic quantum chemistry

21 January 2018

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Theoretical Models on the Cu2O2Torture Track: Mechanistic Implications for Oxytyrosinase and Small-Molecule Analogues

21 January 2018

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

21 January 2018

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The restricted active space followed by second-order perturbation theory method: Theory and application to the study of CuO2 and Cu2O2 systems

21 January 2018

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Matrix product states, projected entangled pair states, and variational renormalization group methods for quantum spin systems

21 January 2018

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Equivalence and solution of anisotropic spin-1 models and generalized t-J fermion models in one dimension

21 January 2018

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Groundstate properties of a generalized VBS-model

21 January 2018

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