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Rongzhe Hu

Publications and source records attributed to Rongzhe Hu.

11 recordsLinked to original sources

$\textit{Ab Initio}$ Exact Calculation of Strongly Correlated Nucleonic Matter

Dense nucleonic matter is of vital importance for understanding compact stars and inferring the transition into deconfined quark phase. We present $\textit{ab initio}$ exact calculations of infinite nucleonic matter with the state-of-the-art full configuration-interaction quantum Monte Carlo method, enabling us to rigorously benchmark many-body methods and assess the degree to which the nucleonic matter is correlated. Our method has been numerically validated against exact diagonalization within a small model space. Calculations of nucleonic matter using chiral nuclear forces reveal that symmetric nuclear matter is strikingly strongly correlated, raising questions on previous $\textit{ab initio}$ calculations of nuclear matter with many-body expansion truncations and offering insights into simultaneous descriptions of finite nuclei and infinite nucleonic matter from first principles.

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Stochastic Similarity Renormalization Group

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.

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Full configuration interaction quantum Monte Carlo for accurate $\textit{ab initio}$ nuclear structure calculations: algorithms and calculation details

Full configuration interaction quantum Monte Carlo (FCIQMC) is a stochastic many-body solver that has been widely applied to electronic, molecular, and condensed-matter systems. In this work we apply FCIQMC to $\textit{ab initio}$ nuclear structure calculations using interactions derived from chiral effective field theory. We describe the algorithm in detail, including imaginary-time propagation, excitation generation, estimator choices, the initiator approximation with adaptive shift correction, and reduced-density-matrix (RDM) sampling. Benchmark calculations in small model spaces, where deterministic full configuration interaction (FCI) results are available, validate the stochastic calculation of energies, radii, and RDM-based pure estimators. For large model spaces, we analyze the residual finite-walker bias through systematic walker-number convergence and infinite-walker extrapolations. We also demonstrate that FCIQMC can be extended beyond ground-state calculations by computing the low-lying spectrum of $^6$Li.

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Full Configuration Interaction Quantum Monte Carlo for Accurate $\textit{Ab Initio}$ Nuclear Structure Calculations

We introduce novel full configuration interaction quantum Monte Carlo (FCIQMC) as an accurate many-body solver for $\textit{ab initio}$ nuclear structure calculations. This stochastic approach directly samples the exact wave function in the full configuration space, enabling high-fidelity treatment of high-order many-body correlations in strongly interacting nuclear systems. Using interactions from chiral effective field theory, we have computed ground-state energies and charge radii of $^4$He, $^8$Be, $^{12}$C and $^{16}$O with sub-percent-level many-body uncertainties. These results establish FCIQMC as a stochastic full-configuration-space solver capable of treating systems beyond the reach of the conventional no-core shell model, and as an accurate benchmark for truncated many-body expansion methods.

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Chiral three-nucleon forces for the new local position-space two-nucleon potential in $\textit{ab initio}$ many-body calculations

Three-nucleon force (3NF) plays an important role in understanding the structure of finite nuclei and the saturation properties of infinite nuclear matter. More specifically, 3NF should be necessary for each two-nucleon force (2NF) to obtain more accurate description of nuclear systems. 3NF derived from the chiral effective field theory has been successful in $\textit{ab initio}$ calculations of atomic nuclei. Most of established chiral nuclear forces have a nonlocal form in the momentum space. In this work, we construct a companion chiral 3NF specifically tailored to the new Idaho local position-space 2NF, and calculate binding energies and radii of nuclei up to $^{132}$Sn. We find that a chiral 3NF with hybrid local and nonlocal regulators has advantages in improving the nuclear structure calculations of both binding energies and radii with the new Idaho 2NF. The two low-energy constants of 3NF are constrained by the ground-state energies of $^3$H and $^{16}$O as suggested in a recent work.

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Stochastic many-body perturbation theory for high-order calculations

High-order perturbative $\textit{ab initio}$ calculations are challenging due to the rapidly growing configuration space and the difficulty of assessing convergence. In this letter, we introduce perturbation theory quantum Monte Carlo (PTQMC), a stochastic approach designed to compute high-order many-body perturbative corrections. By representing the perturbative wave function with random walkers in configuration space, PTQMC avoids the exponential scaling inherent to conventional constructions of high-rank excitation operators. Benchmark calculations for the Richardson pairing model demonstrate that PTQMC accurately reproduces exact many-body perturbation theory (MBPT) coefficients up to 16th order, even in strongly divergent regimes. We further show that combining PTQMC with series resummation techniques yields stable and precise energy estimates in cases where the straightforward perturbative series fails. Finally, we propose the effective number of configurations, $e^{S}$, as a global measure of perturbative wave-function complexity that can be directly extracted within PTQMC. We demonstrate that the saturation behavior of $e^{S}$ provides a more reliable indicator of the validity of perturbative expansions than energy convergence alone.

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Toward $\textit{Ab Initio}$ Quantum Simulations of Atomic Nuclei Using Noisy Qubits

Quantum computers are expected to provide a ultimate solver for quantum many-body systems, although it is a tremendous challenge to achieve that goal on current noisy quantum devices. This work illustrated quantum simulations of ab initio no-core shell model calculations of $^3$H with chiral two-nucleon and three-nucleon forces. The measurement costs are remarkably reduced by using the general commutativity measurement together with the asymptotic optimization. In addition, the noise causes serious contaminations of configurations with undesired particle numbers, and the accuracies are much improved by applying the particle number projected measurement. By tackling the efficiency and noise issues, this work demonstrated a substantial step toward ab initio quantum computing of atomic nuclei.

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Complex-energy eigenvector continuation for nuclear many-body broad resonances

Broad resonances are a unique phenomenon in nuclear many-body systems. Theoretical studies usually involve the continuum degree of freedom, which drastically increases the model space of calculations, and may lead to non-convergence or instability of computations. In this paper, we present the extension of the eigenvector continuation (EC) method to the complex-energy space to treat the broad resonances of open quantum systems of nuclei. EC provides an efficient method to predict the solution of a large-space many-body problem within a small subspace. Using only a few bound and narrow resonance solutions as input in EC, we can obtain the solution of a broad resonance. We have applied the complex-energy EC to the broad resonances of $^4$H, four-neutron $^4n$, $^6$He and $^7$He systems.

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Many-Body Effects on Nuclear Short Range Correlations

We reveal nuclear many-body effects on short range correlations by ab initio no-core shell model calculations of the scaling factor a2. The factor a2 characterizes the abundance of SRC pairs and is linearly related to the EMC effect. Our study employs the fifth-order N4LO chiral nuclear force without softening, enabling to distinguish the influences of nuclear states with different quantum numbers on SRC. It is striking to find that a2 is reduced and close in triplet isobaric analog states of neighboring nuclei, indicating that it is insufficient to estimate SRC abundances by considering only mean-field shell structures. This is explained as specific nuclear states suppress the formation of deuteron-like component, impacting our understandings of the link between high-energy partonic properties and low-energy nuclear physics.

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Non-perturbative calculations of nuclear matter using in-medium similarity renormalization group

The non-perturbative {\it ab initio} calculations of infinite nuclear matter using In-Medium Similarity Renormalization Group (IMSRG) method is developed in this work, which enables calculations with chiral two and three-nucleon forces at N$^2$LO and N$^3$LO. Results from the many-body perturbation theory at different orders and coupled-cluster theory are also presented for comparison. It is shown that different many-body approaches lead to obvious discrepancies with a harder nuclear interaction for both pure neutron matter and symmetric nuclear matter. This work provides a novel alternative infrastructure for future studies of dense nuclear matter and strongly-correlated many-body systems.

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Properties of chiral nucleon-nucleon interaction at N$^3$LO with high cutoffs studied by local projection

The chiral nucleon-nucleon ($NN$) interaction at high cutoffs has been plagued by the presence of spurious bound states. In this work, the chiral $NN$ interaction at N$^3$LO is studied by the local projection method as the cutoff increases. The evolution of short-range behaviors of pion-exchange interactions and contact interactions is intuitively demonstrated. The $P$-channel potentials toward high cutoffs appear to be erratic at short ranges to compromise with phase shifts, while such erratic behaviors can be avoided in $S$ and $D$ channels. Furthermore, a chiral $NN$ interaction at N$^3$LO is studied at a cutoff of 700 MeV. The properties of deuteron and triton are testified with this interaction. Such a hard interaction is expected to provide an alternative choice for studies of short-range correlations and high density nuclear matter.

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