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Kyle Wendt

Publications and source records attributed to Kyle Wendt.

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Quantum Complexity in Nuclear Scattering and Fission Dynamics

Quantum computers promise advantages for simulating strongly correlated quantum many-body systems, like atomic nuclei, that are beyond the reach of classical computers. Realizing this potential requires understanding the quantum complexity structure of the target problem. We investigate the time-evolution of two key indicators of quantum complexity, bipartite entanglement entropy and non-local magic (non-stabilizerness), in nuclear reaction dynamics. We analyze two representative dynamical processes: scattering in a one-dimensional model of strongly interacting fermions governed by the Negele potential, and a realistic simulation of $^{240}$Pu fission within time-dependent Hartree-Fock-Bogoliubov (TDHFB) theory. In the former case, we find that interactions dynamically generate both entanglement and non-local magic, leaving persistent signatures of quantum complexity in the outgoing states. In the latter, we observe that substantial quantum complexity survives in the spatial bipartition of daughter fragments well beyond scission. The presence of significant non-local magic and entanglement in both cases strongly indicate that quantum computers would provide substantial advantages for accurately simulating nuclear reaction dynamics.

quant-ph

Nuclear Reaction Data for Fission Products Off Stability

Neutron cross sections on fission products are relevant to a wide range of applications, including nuclear nonproliferation and forensics, spent-fuel assay, reactor burnup and design, as well as astrophysics. Evaluated nuclear data libraries generally fulfill application needs for isotopes on or near stability, however, for unstable fission products, theoretical descriptions of neutron-induced reactions often constitute the only available source of information. These models often make use of simplified assumptions, leading to unquantified impacts on predicted cross sections. In this work, we discuss possible approaches to addressing these issues, particularly by leveraging machine-learning methods, improved predictive reaction modeling, and experimental data to better constrain model parameters. Our goal is to eventually produce evaluated files for the most-produced nuclei off stability in the fission process of $^{235}$U and submit them to the ENDF/B for consideration in the future ENDF/B-IX.0 release. Here we present the methodology and discuss preliminary results comparing usual simplified approaches with a more realistic one accounting for nuclear deformation.

nucl-th

Bayesian model mixing with multi-reference energy density functional

Reliably predicting nuclear properties across the entire chart of isotopes is important for applications ranging from nuclear astrophysics to superheavy science to nuclear technology. To this day, however, all the theoretical models that can scale at the level of the chart of isotopes remain semi phenomenological. Because they are fitted locally, their predictive power can vary significantly; different versions of the same theory provide different predictions. Bayesian model mixing takes advantage of such imperfect models to build a local mixture of a set of models to make improved predictions. Earlier attempts to use Bayesian model mixing for mass table calculations relied on models treated at single-reference energy density functional level, which fail to capture some of the correlations caused by configuration mixing or the restoration of broken symmetries. In this study we have applied Bayesian model mixing techniques within a multi-reference energy density functional (MR-EDF) framework. We considered predictions of two-particle separation energies from particle number projection or angular momentum projection with four different energy density functionals - a total of eight different MR-EDF models. We used a hierarchical Bayesian stacking framework with a Dirichlet prior distribution over weights together with an inverse log-ratio transform to enable positive correlations between different models. We found that Bayesian model mixing provide significantly improved predictions over results from single MR-EDF calculations.

nucl-th

Learning nuclear cross sections across the chart of nuclides with graph neural networks

In this work, we explore the use of deep learning techniques to learn how nuclear cross sections change as we add or remove protons and neutrons. As a proof of principle, we focus on the neutron-induced reactions in the fast energy regime. Our approach follows a two-stage learning framework. First, we apply representation learning to encode cross section data into a latent space using either variational autoencoders (VAEs) or implicit neural representations (INRs). Then, we train graph neural networks (GNNs) on the resulting embeddings to predict missing values across the nuclear chart by leveraging the topological structure of neighboring isotopes. We demonstrate accurate cross section predictions within a 9x9 block of missing nuclei. We also find that the optimal GNN training strategy depends on the type of latent representation used, with VAE embeddings performing best under end-to-end optimization in the original space, while INR embeddings achieve better results when the GNN is trained only in the latent space. Furthermore, using clustering algorithms, we map groups of latent vectors into regions of the nuclear chart and show that VAEs and INRs can discover some of the neutron magic numbers. These findings suggest that deep-learning models based on the representation encoding of cross sections combined with graph neural networks holds significant potential in augmenting nuclear theory models, e.g., by providing reliable estimates of covariances of cross sections, including cross-material covariances.

nucl-th

Quantum Information Science and Technology for Nuclear Physics. Input into U.S. Long-Range Planning, 2023

In preparation for the 2023 NSAC Long Range Plan (LRP), members of the Nuclear Science community gathered to discuss the current state of, and plans for further leveraging opportunities in, QIST in NP research at the Quantum Information Science for U.S. Nuclear Physics Long Range Planning workshop, held in Santa Fe, New Mexico on January 31 - February 1, 2023. The workshop included 45 in-person participants and 53 remote attendees. The outcome of the workshop identified strategic plans and requirements for the next 5-10 years to advance quantum sensing and quantum simulations within NP, and to develop a diverse quantum-ready workforce. The plans include resolutions endorsed by the participants to address the compelling scientific opportunities at the intersections of NP and QIST. These endorsements are aligned with similar affirmations by the LRP Computational Nuclear Physics and AI/ML Workshop, the Nuclear Structure, Reactions, and Astrophysics LRP Town Hall, and the Fundamental Symmetries, Neutrons, and Neutrinos LRP Town Hall communities.

nucl-ex

Control optimization for parametric hamiltonians by pulse reconstruction

Optimal control techniques provide a means to tailor the control pulses required to generate customized quantum gates, which helps to improve the resilience of quantum simulations to gate errors and device noise. However, the significant amount of (classical) computation required to generate customized gates can quickly undermine the effectiveness of this approach, especially when pulse optimization needs to be iterated. We propose a method to reduce the computational time required to generate the control pulse for a Hamiltonian that is parametrically dependent on a time-varying quantity. We use simple interpolation schemes to accurately reconstruct the control pulses from a set of pulses obtained in advance for a discrete set of predetermined parameter values. We obtain a reconstruction with very high fidelity and a significant reduction in computational effort. We report the results of the application of the proposed method to device-level quantum simulations of the unitary (real) time evolution of two interacting neutrons based on superconducting qubits.

quant-ph