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We present an embedding scheme for periodic systems that facilitates the treatment of the physically important part (here the unit cell) with advanced electronic-structure methods, that are computationally too expensive for periodic…

Materials Science · Physics 2016-04-08 Wael Chibani , Xinguo Ren , Matthias Scheffler , Patrick Rinke

In the last decade, the quantum chemical version of the density matrix renormalization group (DMRG) method has established itself as the method of choice for calculations of strongly correlated molecular systems. Despite its favourable…

Chemical Physics · Physics 2016-11-15 Libor Veis , Andrej Antalík , Jiří Brabec , Frank Neese , Örs Legeza , Jiří Pittner

We reformulate the O(N) sigma model as a loop model whose configurations are the all-order strong coupling graphs of the original model. The loop configurations are represented by a pointer list in the computer and a Monte Carlo update…

High Energy Physics - Lattice · Physics 2015-03-13 Ulli Wolff

We develop a direct diagrammatic Monte Carlo framework for the Renyi entanglement entropy of interacting lattice fermions. The method starts from the fermionic graded-swap representation of Z_n[A]=Tr_A\rho_A^n, which converts the entropy…

Strongly Correlated Electrons · Physics 2026-05-22 Boyuan Shi

We extend the dipole formalism of Catani and Seymour to QCD processes involving heavy fermions. We give the appropriate subtraction terms together with their integrated counterpart. All calculations are done within dimensional…

High Energy Physics - Phenomenology · Physics 2010-02-03 Lukas Phaf , Stefan Weinzierl

We use a single site lattice in four dimensions to study the scaling of large N Yang-Mills field coupled to a single massless Dirac fermion in the adjoint representation. We use the location of the strong to weak coupling transition defined…

High Energy Physics - Lattice · Physics 2015-06-04 A. Hietanen , R. Narayanan

Mixing single and triple fermions an exact killing operator of the Coupled Cluster Doubles (CCD) wave function with good symmetry was found in \cite{Tohy13}. Using these operators with the equation of motion (EOM) method the so-called…

Nuclear Theory · Physics 2020-10-26 Mohsen Jemaï , Peter Schuck

Long-range correlations, which are partially responsible for the observed fragmentation and depletion of low-lying single-particle strength, are studied in the Green's function formalism. The self-energy is expanded up to second order in…

Nuclear Theory · Physics 2009-10-30 Y. Dewulf , D. Van Neck , L. Van Daele , M. Waroquier

Cluster perturbation theory is a technique for calculating the spectral weight of Hubbard models of strongly correlated electrons, which combines exact diagonalizations on small clusters with strong-coupling perturbation theory at leading…

Strongly Correlated Electrons · Physics 2009-11-07 D. Sénéchal , D. Pérez , D. Plouffe

The dynamical cluster-decay model (DCM) is developed further for the decay of hot and rotating compound nuclei (CN) formed in light heavy-ion reactions. The model is worked out in terms of only one parameter, namely the neck-length…

Nuclear Experiment · Physics 2008-11-26 Raj K. Gupta , M. Balasubramaniam , Rajesh Kumar , Dalip Singh , C. Beck , W. Greiner

This paper introduces a novel ansatz-based technique for solution of the Hubbard model over two length scales. Short range correlations are treated exactly using a dynamical cluster approximation QMC simulation, while longer-length-scale…

Strongly Correlated Electrons · Physics 2009-11-10 J. P. Hague , Mark Jarrell , T. C. Schulthess

Approximate full configuration interaction (FCI) calculations have recently become tractable for systems of unforeseen size thanks to stochastic and adaptive approximations to the exponentially scaling FCI problem. The result of an FCI…

Strongly Correlated Electrons · Physics 2017-10-25 Susi Lehtola , Norm M. Tubman , K. Birgitta Whaley , Martin Head-Gordon

We consider interacting Fermi systems close to the unitary regime and compute the corrections to the energy density that are due to a large scattering length and a small effective range. Our approach exploits the universality of the density…

Nuclear Theory · Physics 2009-02-05 Anirban Bhattacharyya , T. Papenbrock

Numerical simulations of strongly correlated electron systems suffer from the notorious fermion sign problem which has prevented progress in understanding if systems like the Hubbard model display high-temperature superconductivity. Here we…

Strongly Correlated Electrons · Physics 2015-06-24 S. Chandrasekharan , J. Cox , J. C. Osborn , U. -J. Wiese

We relate the reduced density matrices of quadratic bosonic and fermionic models to their Green's function matrices in a unified way and calculate the scaling of bipartite entanglement of finite systems in an infinite universe exactly. For…

Statistical Mechanics · Physics 2007-05-23 Thomas Barthel , Ming-Chiang Chung , Ulrich Schollwoeck

The London ground-state energy formula as a function of number density for a system of identical boson hard spheres, corrected for the reduced mass of a pair of particles in a sphere-of-influence picture, and generalized to fermion…

Statistical Mechanics · Physics 2009-11-13 M. A. Solís , M. de Llano , J. W. Clark , George A. Baker

We use a modified directed path algorithm to study the finite temperature chiral singularities of two color lattice QCD with staggered fermions at strong coupling. Our lattice calculations are done at a fixed finite temperature in the…

High Energy Physics - Lattice · Physics 2008-11-26 Fu-Jiun Jiang

A number of proposed extensions of the Standard Model include new strongly interacting dynamics, in the form of SU(N) gauge fields coupled to various numbers of fermions. Often, these extensions allow N = 3 as a plausible choice, or even…

High Energy Physics - Phenomenology · Physics 2025-10-09 Thomas DeGrand , Ethan T. Neil

Quantum embedding methods have recently developed significantly to model large molecular structures. This work proposes a novel wave function theory in density functional theory (WTF-in-DFT) embedding scheme based on pair-coupled cluster…

Chemical Physics · Physics 2024-01-10 Rahul Chakraborty , Katharina Boguslawski , Paweł Tecmer

We construct a lattice theory describing a system of interacting nonrelativistic spin s=1/2 fermions at nonzero chemical potential. The theory is applicable whenever the interparticle separation is large compared to the range of the…

High Energy Physics - Lattice · Physics 2009-11-10 Jiunn-Wei Chen , David B. Kaplan