scholarly journals Many-body localization in spin chains with long-range transverse interactions: Scaling of critical disorder with system size

2020 ◽  
Vol 101 (2) ◽  
Author(s):  
Andrii O. Maksymov ◽  
Alexander L. Burin
Keyword(s):  
Long Range ◽  
System Size ◽  
Spin Chains ◽  
Many Body

scholarly journals Metastability and discrete spectrum of long-range systems

2021 ◽  
Vol 118 (30) ◽  
pp. e2101785118
Author(s):  
Nicolò Defenu
Keyword(s):  
Discrete Spectrum ◽  
Long Range ◽  
Power Law ◽  
System Size ◽  
Many Body ◽  
Internal Parameters ◽  
Quantum Ising Model ◽  
Long Range Interactions ◽  
Interacting Systems ◽  
Chaotic Nature

Long-lived quasi-stationary states (QSSs) are a signature characteristic of long-range interacting systems both in the classical and in the quantum realms. Often, they emerge after a sudden quench of the Hamiltonian internal parameters and present a macroscopic lifetime, which increases with the system size. Despite their ubiquity, the fundamental mechanism at their root remains unknown. Here, we show that the spectrum of systems with power-law decaying couplings remains discrete up to the thermodynamic limit. As a consequence, several traditional results on the chaotic nature of the spectrum in many-body quantum systems are not satisfied in the presence of long-range interactions. In particular, the existence of QSSs may be traced back to the finiteness of Poincaré recurrence times. This picture justifies and extends known results on the anomalous magnetization dynamics in the quantum Ising model with power-law decaying couplings. The comparison between the discrete spectrum of long-range systems and more conventional examples of pure point spectra in the disordered case is also discussed.

Divergence of Many-Body Perturbation Theory for Noncovalent Interactions of Large Molecules

2019 ◽  
Author(s):  
Brian Nguyen ◽  
Guo P Chen ◽  
Matthew M. Agee ◽  
Asbjörn M. Burow ◽  
Matthew Tang ◽  
...  
Keyword(s):  
Perturbation Theory ◽  
System Size ◽  
State Density ◽  
Second Order ◽  
Binding Energies ◽  
Basis Set ◽  
Many Body ◽  
Many Body Perturbation Theory ◽  
Relative Errors ◽  
Ground State Density

Prompted by recent reports of large errors in noncovalent interaction (NI) energies obtained from many-body perturbation theory (MBPT), we compare the performance of second-order Møller–Plesset MBPT (MP2), spin-scaled MP2, dispersion-corrected semilocal density functional approximations (DFA), and the post-Kohn–Sham random phase approximation (RPA) for predicting binding energies of supramolecular complexes contained in the S66, L7, and S30L benchmarks. All binding energies are extrapolated to the basis set limit, corrected for basis set superposition errors, and compared to reference results of the domain-based local pair-natural orbital coupled-cluster (DLPNO-CCSD(T)) or better quality. Our results confirm that MP2 severely overestimates binding energies of large complexes, producing relative errors of over 100% for several benchmark compounds. RPA relative errors consistently range between 5-10%, significantly less than reported previously using smaller basis sets, whereas spin-scaled MP2 methods show limitations similar to MP2, albeit less pronounced, and empirically dispersion-corrected DFAs perform almost as well as RPA. Regression analysis reveals a systematic increase of relative MP2 binding energy errors with the system size at a rate of approximately 1‰ per valence electron, whereas the RPA and dispersion-corrected DFA relative errors are virtually independent of the system size. These observations are corroborated by a comparison of computed rotational constants of organic molecules to gas-phase spectroscopy data contained in the ROT34 benchmark. To analyze these results, an asymptotic adiabatic connection symmetry-adapted perturbation theory (AC-SAPT) is developed which uses monomers at full coupling whose ground-state density is constrained to the ground-state density of the complex. Using the fluctuation–dissipation theorem, we obtain a nonperturbative “screened second-order” expression for the dispersion energy in terms of monomer quantities which is exact for non-overlapping subsystems and free of induction terms; a first-order RPA-like approximation to the Hartree, exchange, and correlation kernel recovers the macroscopic Lifshitz limit. The AC-SAPT expansion of the interaction energy is obtained from Taylor expansion of the coupling strength integrand. Explicit expressions for the convergence radius of the AC-SAPT series are derived within RPA and MBPT and numerically evaluated. Whereas the AC-SAPT expansion is always convergent for nondegenerate monomers when RPA is used, it is found to spuriously diverge for second-order MBPT, except for the smallest and least polarizable monomers. The divergence of the AC-SAPT series within MBPT is numerically confirmed within RPA; prior numerical results on the convergence of the SAPT expansion for MBPT methods are revisited and support this conclusion once sufficiently high orders are included. The cause of the failure of MBPT methods for NIs of large systems is missing or incomplete “electrodynamic” screening of the Coulomb interaction due to induced particle–hole pairs between electrons in different monomers, leaving the effective interaction too strong for AC-SAPT to converge. Hence, MBPT cannot be considered reliable for quantitative predictions of NIs, even in moderately polarizable molecules with a few tens of atoms. The failure to accurately account for electrodynamic polarization makes MBPT qualitatively unsuitable for applications such as NIs of nanostructures, macromolecules, and soft materials; more robust non-perturbative approaches such as RPA or coupled cluster methods should be used instead whenever possible.<br>

scholarly journals A novel class of translationally invariant spin chains with long-range interactions

2020 ◽  
Vol 2020 (8) ◽  
Author(s):  
B. Basu-Mallick ◽  
F. Finkel ◽  
A. González-López
Keyword(s):  
Long Range ◽  
Degrees Of Freedom ◽  
Spin Chains ◽  
Open Chain ◽  
New Class ◽  
Spin Interactions ◽  
Long Range Interactions ◽  
Spin Reversal ◽  
Twisted Yangian ◽  
Internal Degrees Of Freedom

Abstract We introduce a new class of open, translationally invariant spin chains with long-range interactions depending on both spin permutation and (polarized) spin reversal operators, which includes the Haldane-Shastry chain as a particular degenerate case. The new class is characterized by the fact that the Hamiltonian is invariant under “twisted” translations, combining an ordinary translation with a spin flip at one end of the chain. It includes a remarkable model with elliptic spin-spin interactions, smoothly interpolating between the XXX Heisenberg model with anti-periodic boundary conditions and a new open chain with sites uniformly spaced on a half-circle and interactions inversely proportional to the square of the distance between the spins. We are able to compute in closed form the partition function of the latter chain, thereby obtaining a complete description of its spectrum in terms of a pair of independent su(1|1) and su(m/2) motifs when the number m of internal degrees of freedom is even. This implies that the even m model is invariant under the direct sum of the Yangians Y (gl(1|1)) and Y (gl(0|m/2)). We also analyze several statistical properties of the new chain’s spectrum. In particular, we show that it is highly degenerate, which strongly suggests the existence of an underlying (twisted) Yangian symmetry also for odd m.

scholarly journals Long-range interactions in antiferromagnetic quantum spin chains

2017 ◽  
Vol 96 (5) ◽  
Author(s):  
B. Bravo ◽  
D. C. Cabra ◽  
F. A. Gómez Albarracín ◽  
G. L. Rossini
Keyword(s):  
Long Range ◽  
Quantum Spin ◽  
Spin Chains ◽  
Quantum Spin Chains ◽  
Long Range Interactions

scholarly journals Sign-Problem-Free Fermionic Quantum Monte Carlo: Developments and Applications

2019 ◽  
Vol 10 (1) ◽  
pp. 337-356 ◽  
Author(s):  
Zi-Xiang Li ◽  
Hong Yao
Keyword(s):  
Monte Carlo ◽  
Quantum Monte Carlo ◽  
Hot Spot ◽  
High Temperature Superconductors ◽  
System Size ◽  
Many Body ◽  
Broken Symmetries ◽  
Sign Problem ◽  
Universal Quantum ◽  
Many Body Systems

Reliable simulations of correlated quantum systems, including high-temperature superconductors and frustrated magnets, are increasingly desired nowadays to further our understanding of essential features in such systems. Quantum Monte Carlo (QMC) is a unique numerically exact and intrinsically unbiased method to simulate interacting quantum many-body systems. More importantly, when QMC simulations are free from the notorious fermion sign problem, they can reliably simulate interacting quantum models with large system size and low temperature to reveal low-energy physics such as spontaneously broken symmetries and universal quantum critical behaviors. Here, we concisely review recent progress made in developing new sign-problem-free QMC algorithms, including those employing Majorana representation and those utilizing hot-spot physics. We also discuss applications of these novel sign-problem-free QMC algorithms in simulations of various interesting quantum many-body models. Finally, we discuss possible future directions of designing sign-problem-free QMC methods.

scholarly journals Off-Diagonal Long-Range Order in Generalized Hubbard Models

1997 ◽  
Vol 11 (11) ◽  
pp. 1311-1335 ◽  
Author(s):  
Kristel Michielsen ◽  
Hans De Raedt
Keyword(s):  
Density Matrix ◽  
Hubbard Model ◽  
Long Range ◽  
Ground State ◽  
Size Dependence ◽  
State Energy ◽  
System Size ◽  
Range Order ◽  
Long Range Order ◽  
Hubbard Models

We present stochastic diagonalization results for the ground-state energy and the largest eigenvalue of the two-fermion density matrix of the BCS reduced Hamiltonian, the Hubbard model, and the Hubbard model with correlated hopping. The system-size dependence of this eigenvalue is used to study the existence of Off-Diagonal Long-Range Order in these models. We show that the model with correlated hopping and repulsive on-site interaction can exhibit Off-Diagonal Long-Range Order. Analytical results for some special limiting cases indicate that Off-Diagonal Long-Range Order not always implies superconductivity.

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