We present Maxent, a tool for performing analytic continuation of spectral functions using the maximum entropy method. The code operates on discrete imaginary axis datasets (values with uncertainties) and transforms this input to the real axis. The code works for imaginary time and Matsubara frequency data and implements the 'Legendre' representation of finite temperature Green's functions. It implements a variety of kernels, default models, and grids for continuing bosonic, fermionic, anomalous, and other data. Our implementation is licensed under GPLv2 and extensively documented. This paper shows the use of the programs in detail. Nature of problem: The analytic continuation of imaginary axis correlation functions to real frequency/time variables is an ill-posed problem which has an infinite number of solutions.Solution method: The maximum entropy method obtains a possible solution that maximizes entropy, enforces sum rules, and otherwise produces 'smooth' curves. Our implementation allows for input in Matsubara frequencies, imaginary time, or a Legendre expansion. It implements a range of bosonic, fermionic and generalized kernels for normal and anomalous Green's functions, self-energies, and two-particle response functions. Running time: 10s -2h per solution [1] B. Bauer, et al., The ALPS project release 2.0: open source software for strongly correlated systems, J. Stat. Mech. Theor. Exp. 2011 (05)
The open source ALPS (Algorithms and Libraries for Physics Simulations) project provides a collection of physics libraries and applications, with a focus on simulations of lattice models and strongly correlated systems. The libraries provide a convenient set of well-documented and reusable components for developing condensed matter physics simulation code, and the applications strive to make commonly used and proven computational algorithms available to a non-expert community. In this paper we present an updated and refactored version of the core ALPS libraries geared at the computational physics software development community, rewritten with focus on documentation, ease of installation, and software maintainability.
PROGRAM SUMMARY
We compute dynamic spin susceptibilities in the two-dimensional Hubbard model using the method of Dual Fermions and provide comparison to lattice Monte Carlo and cluster dynamical mean field theory. We examine the energy dispersion identified by peaks in Imχ(ω, q) which define spin modes and compare the exchange scale and magnon dispersion to neutron experiments on the parent La2CuO4 cuprate. We present the evolution of the spin excitations as a function of Hubbard interaction strengths and doping and explore the particle-hole asymmetry of the spin excitations. We also study the correlation lengths and the spin excitation dispersion peak structure and find a 'Y'-shaped dispersion similar to neutron results on doped HgBa2CuO 4+δ .
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