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arXiv:2607.08830

Stochastic Similarity Renormalization Group

Rongzhe Hu, Xin Zhen, Furong Xu, Junchen Pei

Published Jul 9, 2026• 0 citations
arXivHTMLPDF

Abstract

By integrating the quantum Monte Carlo technique into the similarity renormalization group (SRG), we have developed a stochastic SRG framework (SRGQMC) capable of both free-space two-body and in-medium many-body evolutions. This approach circumvents the combinatorial tensor-space explosion of many-body flow equations by mapping continuous unitary transformations onto an ensemble of signed random walkers. We benchmark the SRGQMC against deterministic free-space SRG evolutions of realistic nucleon-nucleon (NN) interactions, as well as against in-medium SRG (IMSRG) many-body calculations with the Richardson pairing model at two- and three-body levels [IMSRG(2)/(3)]. While a deterministic extension to the four-body level [IMSRG(4)] remains unfeasible due to prohibitive computational costs, we have achieved the first IMSRG(4) calculation by using the stochastic technique, demonstrating a substantial improvement toward the full configuration-interaction limit. This stochastic framework provides a practical pathway to higher-order IMSRG calculations.

DOI
10.48550/arxiv.2607.08830

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By integrating the quantum Monte Carlo technique into the similarity renormalization group (SRG), we have developed a stochastic SRG framework (SRGQMC) capable of both free-space two-body and in-medium many-body evolutions. This approach circumvents the combinatorial tensor-space explosion of many-body flow equations by mapping continuous unitary transformations onto an ensemble of signed random walkers. We benchmark the SRGQMC against deterministic free-space SRG evolutions of realistic nucleon-nucleon (NN) interactions, as well as against in-medium SRG (IMSRG) many-body calculations with the Richardson pairing model at two- and three-body levels [IMSRG(2)/(3)]. While a deterministic extension to the four-body level [IMSRG(4)] remains unfeasible due to prohibitive computational costs, we have achieved the first IMSRG(4) calculation by using the stochastic technique, demonstrating a substantial improvement toward the full configuration-interaction limit. This stochastic framework provides a practical pathway to higher-order IMSRG calculations.
We present a new ab initio method that uses similarity renormalization group (SRG) techniques to continuously diagonalize nuclear many-body Hamiltonians. In contrast with applications of the SRG to two- and three-nucleon interactions in free space, we perform the SRG evolution "in medium" directly in the A-body system of interest. The in-medium approach has the advantage that one can approximately evolve 3,…,A-body operators using only two-body machinery based on normal-ordering techniques. The method is nonperturbative and can be tailored to problems ranging from the diagonalization of closed-shell nuclei to the construction of effective valence-shell Hamiltonians and operators. We present first results for the energies of 4He, 16O, and 40Ca, which have accuracies comparable to coupled-cluster calculations.
Over the past decade the in-medium similarity renormalization group (IMSRG) approach has proven to be a powerful and versatile ab initio many-body method for studying medium-mass nuclei. So far, the IMSRG was limited to the approximation in which only up to two-body operators are incorporated in the renormalization group flow, referred to as the IMSRG(2). In this work, we extend the IMSRG(2) approach to fully include three-body operators yielding the IMSRG(3) approximation. We use a perturbative scaling analysis to estimate the importance of individual terms in this approximation and introduce truncations that aim to approximate the IMSRG(3) at a lower computational cost. The IMSRG(3) is systematically benchmarked for different nuclear Hamiltonians for 4He^{4}\mathrm{He}4He and 16O^{16}\mathrm{O}16O in small model spaces. The IMSRG(3) systematically improves over the IMSRG(2) relative to exact results. Approximate IMSRG(3) truncations constructed based on computational cost are able to reproduce much of the systematic improvement offered by the full IMSRG(3). We also find that the approximate IMSRG(3) truncations behave consistently with expectations from our perturbative analysis, indicating that this strategy may also be used to systematically approximate the IMSRG(3).
The in-medium similarity renormalization group (IMSRG) is a popular many-body method used for computations of nuclei. It solves the many-body Schrödinger equation through a continuous unitary transformation of the many-body Hamiltonian. The IMSRG transformation is typically truncated at the normal-ordered two-body level, the IMSRG(2), but recently several approaches have been developed to capture the effects of normal-ordered three-body operators, the IMSRG(3). In particular, a factorized approximation to the IMSRG(3) proposes to capture the leading effects of three-body operators at the same computational cost as the IMSRG(2) approximation. This approach often employs an approximate scheme for solving the IMSRG equations, the so-called hunter-gatherer scheme. In this work, I study the uncertainty associated with this scheme. I find that the hunter-gatherer scheme differs by up to 7 MeV7\,\mathrm{MeV}7MeV for ground-state energies and 0.5 MeV0.5\,\mathrm{MeV}0.5MeV for excitation energies from standard IMSRG(2) approaches. These differences are in some cases comparable to the expected size of IMSRG(3) corrections.
Abstract We present a pedagogical introduction to the in-medium similarity renormalization group (IMSRG) framework for ab initio calculations of nuclei. The IMSRG performs continuous unitary transformations of the nuclear many-body Hamiltonian in second-quantized form, which can be implemented with polynomial computational effort. Through suitably chosen generators, it is possible to extract eigenvalues of the Hamiltonian in a given nucleus, or drive the Hamiltonian matrix in configuration space to specific structures, e.g., band- or block-diagonal form. Exploiting this flexibility, we describe two complementary approaches for the description of closed- and open-shell nuclei: the first is the multireference IMSRG (MR-IMSRG), which is designed for the efficient calculation of nuclear ground-state properties. The second is the derivation of non-empirical valence-space interactions that can be used as input for nuclear shell model (i.e., configuration interaction (CI)) calculations. This IMSRG+shell model approach provides immediate access to excitation spectra, transitions, etc, but is limited in applicability by the factorial cost of the CI calculations. We review applications of the MR-IMSRG and IMSRG+shell model approaches to the calculation of ground-state properties for the oxygen, calcium, and nickel isotopic chains or the spectroscopy of nuclei in the lower sd shell, respectively, and present selected new results, e.g., for the ground- and excited state properties of neon isotopes.
The Similarity Renormalization Group (SRG) is investigated as a powerful yet practical method to modify nuclear potentials so as to reduce computational requirements for calculations of observables. The key feature of SRG transformations that leads to computational benefits is the decoupling of low-energy nuclear physics from high-energy details of the inter-nucleon interaction. We examine decoupling quantitatively for two-body observables and few-body binding energies. The universal nature of this decoupling is illustrated and errors from suppressing high-momentum modes above the decoupling scale are shown to be perturbatively small. To explore the SRG evolution of many-body forces, we use as a laboratory a one-dimensional system of bosons with short-range repulsion and mid-range attraction, which emulates realistic nuclear forces. The free-space SRG is implemented for few-body systems in a symmetrized harmonic oscillator basis using a recursive construction analogous to no-core shell model implementations. Building on one-dimensional results we performed the first practical evolution of three-dimensional many-body forces within the No-Core Shell Model basis. Results for the 3H binding energy are consistent with previous calculations involving momentum-space evolution of only two-body forces, and validate expectations from calculations in the one-dimensional oscillator basis. When applied to 4He calculations, the two- and three-body oscillator matrix elements yield rapid convergence of the ground-state energy with a small net contribution of the induced four-body force. The radius of light nuclei is also explored in the three-dimensional basis.
The similarity renormalization group (SRG) concept (or flow equations methodology) is studied with a view toward the renormalization of nucleon–nucleon interactions for ab initio shell-model calculations. For a general flow, we give quantitative measures, in the framework of spectral distribution theory, for the strength of the SRG-induced higher order (many-body) terms of an evolved interaction. Specifically, we show that there is a hierarchy among the terms, with those of the lowest particle rank being the most important. This feature is crucial for maintaining the unitarity of SRG transformations and key to the method's applicability.