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In this p', 'paper,wedetail numerical algorithms for', 'performing the required steps of the MED,principally solving a minimization problem with a', 'preconditioned', 'astea1ocrtratnrtpccc', "Newton's", 'algorithm,as well as how to extract global susceptibilities and thermal responses.', 'Wedemonstrate', 'the power of the method with the spin-l/2 XXZ model on the 2D squarelattice, including the extraction of', 'critical points and details of each phase. Although the method shares some qualitative similarities with exact-', 'diagonalization,we show the MED is both more accurate and significantly more flexible.', 'PACSnumbers:05.10.-a, 02.50.Ng,03.67.-a,74.40.Kb', 'I.INTRODUCTION', 'This approximation becomes exact in the case of a 1D', 'quan-', 'tum(orclassical)', 'Markov chain', '[10],and leads to an', 'expo-', 'Although', 'the', 'equations', 'governing', 'quantum many-body', 'nentialreduction', '1 of cost for exact entropy calculations when', 'systems are', 'simplet', 'writedown,findin', 'solutions', 'sforthe', 'the global density matrix is a higher-dimensional Markov net-', 'majority', 'of', 'systems', 'remains incredibly', 'difficult.', 'Modern', 'workstate', '[12,13].', 'physics finds itself in need of new', 'tools to compute the emer-', 'The second approximation used in the MED approach is', 'gentbehavior of large, many-body', 'ysystems.', 'related to the V-representibility problem. Given a set of lo-', 'Therehasbeen', 'greatvariety', 'r oftools developed to tackle', 'calbutoverlapping', 'reduced density', 'matrices{pi},it is avery', 'many-bodyproblems', 's,butin', 'general,large', '2D', 'and3D', 'quan-', 'challenging', 'problemto determinei', 'ifthereexists', 'globalden-', 'tum', 'systems', 'remain', 'hard', 'deal', 'with.', 'Most', 'systems', 'are', 'sity operator which is positive semi-definite and whose partial', 'thought to be non-integrable, so exact analytic solutions are', 'trace agrees', 'with', 'each', 'p.This', 'problemisQMA-hard', '(the', 'notusually expected.Direct numerical diagonalization canbe', 'quantum analogue of NP)', '[14,', '151.', 'and is hopelessly', 'diffi-', 'performedforrelatively', 'small', 'wstems', '-howevertheemer-', 'cultto', 'enforce.', 'Thus', 'the', 'second', 'pproximationemployed', 'gentbehaviorofas', 'ystem in thethermodynamiclimitmaybe', 'involves ignoringglobal consistency', 'with a', 'positive', 'opera-', 'difficult to extract, especially in s', 'ystemswithlarge', 'correlation', 'tor,while', 'requiring', 'localconsistenc', 'on any overlapping re-', 'lengths.MonteCarlo', 'approaches are technically', '/exact(upto', 'gionsbetween thep.Atthezero-temperaturelimit,theMED', 'sampling', 'error),but', 'suffer', 'fromthe', 'so-called', 'ign', 'problem', 'approach becomes analogous to the', 'ariationalnth-orderre-', '111', 'for fermionic, frustrated, or dynamical problems. Thus', 'weare', 'duceddensity', 'matrix', 'approach,', 'where', 'positivity is enforced', 'limitedto', 'search for clever', ' approximations to solve the ma-', 'on all reduced density', 'matrices of size', '[16-18].', ' jority of many-body problems.', 'The MED approach is an extremely flexible cluster method,', 'Overthe', 'pastcentury', 'hundredsof such', 'approximations', 'applicable to both translationally', 'y invariant systems of any di-', 'havebeen', 'proposed,', ' and we will mention just a few notable', 'mension in the thermodynamic limit.', 'as well asfinite', 'ystems', 'examples', 'applicable', 'quantum lattice', 'odels.Mean-field', 'or systems', 'without translational invariance (e.g.', 'disordered', 'theory', 'is simple and frequently', 'arrives', 'at the correct', 'quali-', 'lattices,', 'or harmonically', 'trappedatomsin', 'optical lattices).', 'tative description,but', 'often fails', 'swhen', 'correlations', 'are im-', 'Thefreeenergygivenby', 'MEDis', 'guaranteed to lower', 'bound', 'portant. Density-matrix renormalisation', 'group (DMRG)[1]', 'the true free', 'energy', 'which in turn lower-bounds the', 'ground', 'is efficient and extremely', 'accurate at solving', '1D', 'problems,', 'stateenergy', '—thus', 'providing a natural complement to varia-', 'butthe computational cost', 'grows exponentially', 'ywithsystem', 'tionalapproacheswhich upper-boundthe', 'ground state energy.', 'size in two- or higher-dimensions', '[2,3].', 'Related tensor-', 'The ability to provide a rigorous', 's ground-stateenergywindow', 'networktechniquesdesigned for2D', 'ystemsarestill intheir', 'is apowerful validation tool, creating', 'averycompellingrea-', 'infancy [4-6]. Series-expansion methods', '7', 'canbe success-', 'son to use this approach.', 'ful, but may diverge', 'orotherwise converge', 'eslowly,obscuring', 'In this paper we paper we present a pedagogical introduc-', 'thestatein', '1certain', 'regimes. There exist', 'variety', 'of cluster-', 'tion toMED, includingnumericalimplementation issues and', 'based techniques', 'such as', 'dynamical-mean-field theory[8]', 'applications', 'to 2D quantum lattice', 'models in the thermody-', 'anddensity', '7-matrix', 'embedding[9].', 'namiclimit.', 'In Sec.II,we', 'give a brief derivation', 'ofthe', 'Herewe', 'discuss the so-called Markov entropy decompo-', 'Markov entropy decomposition.', 'SectionIlloutlinesarobust', 'sition (MED),recently', 'proposedby', 'Poulin&Hastings', '[10]', 'numerical strategy for', 'optimizing', 'the clusters that make up', '(andanalogous to a slightly', 'earlier', ' classical algorithm', '[11])', 'thedecomposition.', 'InSec.IVw', 'show how we can extend', 'This is', 'a self-consistent', 'cluster method for finite temperature', 'thesealgorithmsto', 'extract non-trivial', 'information,suchas', 'systems that takes advantage of an ', 'approximationofthe(von', 'specific heat and susceptibilities.We present an application of', 'Neumann)entropy.', 'In[10],itwas', 'shown that the entropy', 'the method to the spin-1/2 XXZmodel on a 2D squarelattice', 'per site can be rigorously upper bounded using only local in-', 'in Sec.V,describing how to characterize the phase diagram', 'formation—alocal.reduceddensity', 'matrix onN sites,say.', 'and determine critical points, before concluding in Sec.VI.'], 'rec_scores': array([0.98928159, ..., 0.98077077]), 'rec_polys': array([[[ 355, 109], |