3.3QUANT-PHAug 2, 2024
Optimizing Variational Quantum Circuits Using Metaheuristic Strategies in Reinforcement LearningMichael Kölle, Daniel Seidl, Maximilian Zorn et al.
Quantum Reinforcement Learning (QRL) offers potential advantages over classical Reinforcement Learning, such as compact state space representation and faster convergence in certain scenarios. However, practical benefits require further validation. QRL faces challenges like flat solution landscapes, where traditional gradient-based methods are inefficient, necessitating the use of gradient-free algorithms. This work explores the integration of metaheuristic algorithms -- Particle Swarm Optimization, Ant Colony Optimization, Tabu Search, Genetic Algorithm, Simulated Annealing, and Harmony Search -- into QRL. These algorithms provide flexibility and efficiency in parameter optimization. Evaluations in $5\times5$ MiniGrid Reinforcement Learning environments show that, all algorithms yield near-optimal results, with Simulated Annealing and Particle Swarm Optimization performing best. In the Cart Pole environment, Simulated Annealing, Genetic Algorithms, and Particle Swarm Optimization achieve optimal results, while the others perform slightly better than random action selection. These findings demonstrate the potential of Particle Swarm Optimization and Simulated Annealing for efficient QRL learning, emphasizing the need for careful algorithm selection and adaptation.
13.0LGMar 1, 2025
Input Specific Neural NetworksAsghar A. Jadoon, D. Thomas Seidl, Reese E. Jones et al.
The black-box nature of neural networks limits the ability to encode or impose specific structural relationships between inputs and outputs. While various studies have introduced architectures that ensure the network's output adheres to a particular form in relation to certain inputs, the majority of these approaches impose constraints on only a single set of inputs. This paper introduces a novel neural network architecture, termed the Input Specific Neural Network (ISNN), which extends this concept by allowing scalar-valued outputs to be subject to multiple constraints. Specifically, the ISNN can enforce convexity in some inputs, non-decreasing monotonicity combined with convexity with respect to others, and simple non-decreasing monotonicity or arbitrary relationships with additional inputs. The paper presents two distinct ISNN architectures, along with equations for the first and second derivatives of the output with respect to the inputs. These networks are broadly applicable. In this work, we restrict their usage to solving problems in computational mechanics. In particular, we show how they can be effectively applied to fitting data-driven constitutive models. We then embed our trained data-driven constitutive laws into a finite element solver where significant time savings can be achieved by using explicit manual differentiation using the derived equations as opposed to automatic differentiation. We also show how ISNNs can be used to learn structural relationships between inputs and outputs via a binary gating mechanism. Particularly, ISNNs are employed to model an anisotropic free energy potential to get the homogenized macroscopic response in a decoupled multiscale setting, where the network learns whether or not the potential should be modeled as polyconvex, and retains only the relevant layers while using the minimum number of inputs.
11.4LGJul 1, 2025
Physics Augmented Machine Learning Discovery of Composition-Dependent Constitutive Laws for 3D Printed Digital MaterialsSteven Yang, Michal Levin, Govinda Anantha Padmanabha et al.
Multi-material 3D printing, particularly through polymer jetting, enables the fabrication of digital materials by mixing distinct photopolymers at the micron scale within a single build to create a composite with tunable mechanical properties. This work presents an integrated experimental and computational investigation into the composition-dependent mechanical behavior of 3D printed digital materials. We experimentally characterize five formulations, combining soft and rigid UV-cured polymers under uniaxial tension and torsion across three strain and twist rates. The results reveal nonlinear and rate-dependent responses that strongly depend on composition. To model this behavior, we develop a physics-augmented neural network (PANN) that combines a partially input convex neural network (pICNN) for learning the composition-dependent hyperelastic strain energy function with a quasi-linear viscoelastic (QLV) formulation for time-dependent response. The pICNN ensures convexity with respect to strain invariants while allowing non-convex dependence on composition. To enhance interpretability, we apply $L_0$ sparsification. For the time-dependent response, we introduce a multilayer perceptron (MLP) to predict viscoelastic relaxation parameters from composition. The proposed model accurately captures the nonlinear, rate-dependent behavior of 3D printed digital materials in both uniaxial tension and torsion, achieving high predictive accuracy for interpolated material compositions. This approach provides a scalable framework for automated, composition-aware constitutive model discovery for multi-material 3D printing.