Neural-Network Inverse Design of SRF Cavities and Transmons for Bosonic Quantum Computation

In this work, a novel algorithm structured on Lie algebras for the approximate quantum state preparation problem is proposed, addressing a challenge of fundamental importance in many areas of quantum computing. The algorithm uses a variational quantum circuit designed on the Standard Recursive Block Basis (SRBB), a hierarchical construction for the matrix algebra of the $SU(2^n)$ group, which is capable of linking the variational parameters with the topology of the Lie group. Compared to the full algebra, using only diagonal components reduces the number of CNOTs by an exponential factor, as well as the circuit depth, in full agreement with the relaxation principle inherent to the approximation methodology of minimizing resources while achieving high accuracy. The desired quantum state is then approximated by a novel quantum neural network, which is designed based on the diagonal SRBB sub-algebra. This approach provides a new scheme for approximate quantum state preparation in a variational framework and a specific use case for the SRBB hierarchy. The performance of the algorithm is assessed with different loss functions, such as fidelity, trace distance, and Frobenius norm, in relation to two optimizers: Adam and Nelder-Mead. The results highlight the potential of SRBB in close connection with the geometry of unitary groups, achieving high accuracy of up to 4 qubits in simulation, but also its current limitations with an increasing number of qubits. Additionally, the approximate SRBB-based QSP algorithm has been tested on real quantum devices to assess its performance with a small number of qubits.

The validation of advanced nuclear reactor designs and fuel concepts requires critical experiments with high neutronic similarity to the target technology. Neutronic similarity is quantified by the correlation coefficient $c_k$, which captures the shared bias in $k_\text{eff}$ induced by uncertainties in nuclear data. Generally, a $c_k\geq0.9$ is needed for an experiment to be sufficiently similar to a target technology. This work presents a methodology for the inverse design of critical experiments. Deep neural network surrogate modeling and nonparametric gradient optimization are used to generate experiment geometries that maximize $c_k$. A deep neural network is trained on OpenMC-calculated sensitivity vectors for grid-based critical experiment geometries. The model architecture combines a U-Net convolutional encoder-decoder with a novel multigroup attention pooling layer, introduced to capture the differing spatial dependencies of sensitivities. Multigroup attention pooling is shown to achieve better performance than traditional pooling, as well as interpretable internal behavior. The differentiability of the surrogate enables gradient-based optimization of the full combinatorial design space, allowing $c_k$ to be maximized by directly changing the material assignment of each position in the geometry grid. The method is applied to the validation of the TN-Americas TN-LC transportation cask with HALEU fuel, for which existing critical experiment coverage is limited. The optimization procedure is shown to produce experiment geometries achieving $c_k$ scores of 0.97757, 0.81324, and 0.93276 for three configurations of interest. This approach demonstrates the potential of deep learning and gradient optimization to accelerate the development of advanced nuclear technology.

Inverse design of RF passive components from S-parameters is a high-dimensional, ill-posed problem, and prior generative approaches are limited to single-layer binary-metallization structures. This paper presents an inverse design approach that generates passive components from partial S-parameter inputs on an $8\times8$ mm board discretized at $64\times64$ pixels with sub-pixel grayscale metallization across 1-20 GHz. The framework generates two-layer copper layouts with vias, with hard physical constraints on feed locations enforced through annealed Langevin projection, flexible multi-modal conditioning on partial S-parameter specifications, port locations, dielectric properties, reference topology, and variable port placement. Candidate designs are generated in seconds, with surrogate-predicted S-parameters matching targets to within $0.77 \pm 1.28$ dB weighted mean absolute error. We validate the approach with two fabricated designs on RO4003C: a manufacturable alternative to a hairpin filter whose coupling gaps violate fabrication rules, and a combline bandpass filter designed from scratch given only target S-parameters.