Daniel O'Malley

Aleksandra Pachalieva, Daniel O'Malley, Dylan Robert Harp et al.

Avoiding over-pressurization in subsurface reservoirs is critical for applications like CO2 sequestration and wastewater injection. Managing the pressures by controlling injection/extraction are challenging because of complex heterogeneity in the subsurface. The heterogeneity typically requires high-fidelity physics-based models to make predictions on CO$_2$ fate. Furthermore, characterizing the heterogeneity accurately is fraught with parametric uncertainty. Accounting for both, heterogeneity and uncertainty, makes this a computationally-intensive problem challenging for current reservoir simulators. To tackle this, we use differentiable programming with a full-physics model and machine learning to determine the fluid extraction rates that prevent over-pressurization at critical reservoir locations. We use DPFEHM framework, which has trustworthy physics based on the standard two-point flux finite volume discretization and is also automatically differentiable like machine learning models. Our physics-informed machine learning framework uses convolutional neural networks to learn an appropriate extraction rate based on the permeability field. We also perform a hyperparameter search to improve the model's accuracy. Training and testing scenarios are executed to evaluate the feasibility of using physics-informed machine learning to manage reservoir pressures. We constructed and tested a sufficiently accurate simulator that is 400000 times faster than the underlying physics-based simulator, allowing for near real-time analysis and robust uncertainty quantification.

Manish Bhattarai, Javier E. Santos, Shawn Jones et al.

The advent of large language models (LLMs) has significantly advanced the field of code translation, enabling automated translation between programming languages. However, these models often struggle with complex translation tasks due to inadequate contextual understanding. This paper introduces a novel approach that enhances code translation through Few-Shot Learning, augmented with retrieval-based techniques. By leveraging a repository of existing code translations, we dynamically retrieve the most relevant examples to guide the model in translating new code segments. Our method, based on Retrieval-Augmented Generation (RAG), substantially improves translation quality by providing contextual examples from which the model can learn in real-time. We selected RAG over traditional fine-tuning methods due to its ability to utilize existing codebases or a locally stored corpus of code, which allows for dynamic adaptation to diverse translation tasks without extensive retraining. Extensive experiments on diverse datasets with open LLM models such as Starcoder, Llama3-70B Instruct, CodeLlama-34B Instruct, Granite-34B Code Instruct, and Mixtral-8x22B, as well as commercial LLM models like GPT-3.5 Turbo and GPT-4o, demonstrate our approach's superiority over traditional zero-shot methods, especially in translating between Fortran and CPP. We also explored varying numbers of shots i.e. examples provided during inference, specifically 1, 2, and 3 shots and different embedding models for RAG, including Nomic-Embed, Starencoder, and CodeBERT, to assess the robustness and effectiveness of our approach.

Austin Pechan, John Golden, Daniel O'Malley

Quantum linear system (QLS) algorithms offer the potential to solve large-scale linear systems exponentially faster than classical methods. However, applying QLS algorithms to real-world problems remains challenging due to issues such as state preparation, data loading, and efficient information extraction. In this work, we study the feasibility of applying QLS algorithms to solve discretized three-dimensional heterogeneous Poisson equations, with specific examples relating to groundwater flow through geologic fracture networks. We explicitly construct a block encoding for the 3D heterogeneous Poisson matrix by leveraging the sparse local structure of the discretized operator. While classical solvers benefit from preconditioning, we show that block encoding the system matrix and preconditioner separately does not improve the effective condition number that dominates the QLS runtime. This differs from classical approaches where the preconditioner and the system matrix can often be implemented independently. Nevertheless, due to the structure of the problem in three dimensions, the quantum algorithm achieves a runtime of $O(N^{2/3} \ \text{polylog } N \cdot \log(1/ε))$, outperforming the best classical methods (with runtimes of $O(N \log N \cdot \log(1/ε))$) and offering exponential memory savings. These results highlight both the promise and limitations of QLS algorithms for practical scientific computing, and point to effective condition number reduction as a key barrier in achieving quantum advantages.

Teeratorn Kadeethum, Daniel O'Malley, Youngsoo Choi et al.

Data-driven modeling can suffer from a constant demand for data, leading to reduced accuracy and impractical for engineering applications due to the high cost and scarcity of information. To address this challenge, we propose a progressive reduced order modeling framework that minimizes data cravings and enhances data-driven modeling's practicality. Our approach selectively transfers knowledge from previously trained models through gates, similar to how humans selectively use valuable knowledge while ignoring unuseful information. By filtering relevant information from previous models, we can create a surrogate model with minimal turnaround time and a smaller training set that can still achieve high accuracy. We have tested our framework in several cases, including transport in porous media, gravity-driven flow, and finite deformation in hyperelastic materials. Our results illustrate that retaining information from previous models and utilizing a valuable portion of that knowledge can significantly improve the accuracy of the current model. We have demonstrated the importance of progressive knowledge transfer and its impact on model accuracy with reduced training samples. For instance, our framework with four parent models outperforms the no-parent counterpart trained on data nine times larger. Our research unlocks data-driven modeling's potential for practical engineering applications by mitigating the data scarcity issue. Our proposed framework is a significant step toward more efficient and cost-effective data-driven modeling, fostering advancements across various fields.

Daniel O'Malley, Christopher W. Johnson, Javier E. Santos et al.

Continental-scale knowledge of subsurface temperature is limited by the cost and sparsity of borehole measurements, but such information is essential for geothermal resource assessment and for understanding heat transport in the shallow crust. The thermal field reflects the interaction between lithology, crustal structure, radiogenic heat production, and advective fluid flow, sometimes producing sharp anomalies that are smoothed by conventional interpolation or difficult to capture with physical models. Here we introduce In-Context Earth, a transformer-based model that uses sparse local borehole observations as geological context to predict continuous temperature-at-depth fields with calibrated uncertainty. In the contiguous United States, the model achieves a mean absolute error of 4.7 °C, outperforming the physics-informed Stanford Thermal Model, a model based on AlphaEarth embeddings, the multimodal Transparent Earth model, and universal kriging, while resolving sharper thermal gradients in geothermal provinces. Its uncertainty estimates are well calibrated, with a Kolmogorov-Smirnov statistic of 2.5%. Without finetuning, the model adapts to Alberta, Australia, and the United Kingdom (UK) using only 20 local observations at inference time, maintaining high accuracy in geologically distinct test regions with a mean absolute error of 2.2 °C in Alberta, 6.2 °C in Australia, and 5.4 °C in the UK. Interpretability analyses show that the model learns internal representations of subsurface properties it never observes during training, including seismic velocities, geochemistry, and crustal structure, and uses these representations in physically consistent ways. More broadly, this work shows that in-context learning can use sparse borehole observations for continental-scale subsurface characterization, without requiring dense measurements or region-specific retraining.

Harun Ur Rashid, Mingxin Li, Aleksandra Pachalieva et al.

Accurate characterization of subsurface heterogeneity is challenging but essential for applications such as reservoir pressure management, geothermal energy extraction and CO$_2$, H$_2$, and wastewater injection operations. This challenge becomes especially acute in extreme pressure events, which are rarely observed but can strongly affect operational risk. Traditional history matching and inversion techniques rely on expensive full-physics simulations, making it infeasible to handle uncertainty and extreme events at scale. Purely data-driven models often struggle to maintain physics consistency when dealing with sparse observations, complex geology, and extreme events. To overcome these limitations, we introduce a physics-informed machine learning method that embeds a differentiable subsurface flow simulator directly into neural network training. The network infers heterogeneous permeability fields from limited pressure observations, while training minimizes both permeability and pressure losses through the simulator, enforcing physical consistency. Because the simulator is used only during training, inference remains fast once the model is learned. In an initial test, the proposed method reduces the pressure inference error by half compared with a purely data-driven approach. We then extend the test over eight distinct data scenarios, and in every case, our method produces significantly lower pressure inference errors than the purely data-driven model. We also evaluate our method on extreme events, which represent high-consequence data in the tail of the sample distribution. Similar to the bulk distribution, the physics-informed model maintains higher pressure inference accuracy in the extreme event regimes. Overall, the proposed method enables rapid, physics-consistent subsurface inversion for real-time reservoir characterization and risk-aware decision-making.

Bharat Srikishan, Daniel O'Malley, Mohamed Mehana et al.

Modeling the evolution of physical systems is critical to many applications in science and engineering. As the evolution of these systems is governed by partial differential equations (PDEs), there are a number of computational simulations which resolve these systems with high accuracy. However, as these simulations incur high computational costs, they are infeasible to be employed for large-scale analysis. A popular alternative to simulators are neural network surrogates which are trained in a data-driven manner and are much more computationally efficient. However, these surrogate models suffer from high rollout error when used autoregressively, especially when confronted with training data paucity. Existing work proposes to improve surrogate rollout error by either including physical loss terms directly in the optimization of the model or incorporating computational simulators as `differentiable layers' in the neural network. Both of these approaches have their challenges, with physical loss functions suffering from slow convergence for stiff PDEs and simulator layers requiring gradients which are not always available, especially in legacy simulators. We propose the Hybrid PDE Predictor with Reinforcement Learning (HyPER) model: a model-agnostic, RL based, cost-aware model which combines a neural surrogate, RL decision model, and a physics simulator (with or without gradients) to reduce surrogate rollout error significantly. In addition to reducing in-distribution rollout error by 47%-78%, HyPER learns an intelligent policy that is adaptable to changing physical conditions and resistant to noise corruption. Code available at https://github.com/scailab/HyPER.

Nishath Rajiv Ranasinghe, Shawn M. Jones, Michal Kucer et al.

Large Language Models (LLMs) are increasingly being leveraged for generating and translating scientific computer codes by both domain-experts and non-domain experts. Fortran has served as one of the go to programming languages in legacy high-performance computing (HPC) for scientific discoveries. Despite growing adoption, LLM-based code translation of legacy code-bases has not been thoroughly assessed or quantified for its usability. Here, we studied the applicability of LLM-based translation of Fortran to C++ as a step towards building an agentic-workflow using open-weight LLMs on two different computational platforms. We statistically quantified the compilation accuracy of the translated C++ codes, measured the similarity of the LLM translated code to the human translated C++ code, and statistically quantified the output similarity of the Fortran to C++ translation.

Agnese Marcato, Daniel O'Malley, Hari Viswanathan et al.

Recreating complex, high-dimensional global fields from limited data points is a grand challenge across various scientific and industrial domains. Given the prohibitive costs of specialized sensors and the frequent inaccessibility of certain regions of the domain, achieving full field coverage is typically not feasible. Therefore, the development of algorithms that intelligently improve sensor placement is of significant value. In this study, we introduce a general approach that employs differentiable programming to exploit sensor placement within the training of a neural network model in order to improve field reconstruction. We evaluated our method using two distinct datasets; the results show that our approach improved test scores. Ultimately, our method of differentiable placement strategies has the potential to significantly increase data collection efficiency, enable more thorough area coverage, and reduce redundancy in sensor deployment.

Arnab Mazumder, Javier E. Santos, Noah Hobbs et al.

We present the Transparent Earth, a transformer-based architecture for reconstructing subsurface properties from heterogeneous datasets that vary in sparsity, resolution, and modality, where each modality represents a distinct type of observation (e.g., stress angle, mantle temperature, tectonic plate type). The model incorporates positional encodings of observations together with modality encodings, derived from a text embedding model applied to a description of each modality. This design enables the model to scale to an arbitrary number of modalities, making it straightforward to add new ones not considered in the initial design. We currently include eight modalities spanning directional angles, categorical classes, and continuous properties such as temperature and thickness. These capabilities support in-context learning, enabling the model to generate predictions either with no inputs or with an arbitrary number of additional observations from any subset of modalities. On validation data, this reduces errors in predicting stress angle by more than a factor of three. The proposed architecture is scalable and demonstrates improved performance with increased parameters. Together, these advances make the Transparent Earth an initial foundation model for the Earth's subsurface that ultimately aims to predict any subsurface property anywhere on Earth.

Harun Ur Rashid, Aleksandra Pachalieva, Daniel O'Malley

Accurate subsurface reservoir pressure control is extremely challenging due to geological heterogeneity and multiphase fluid-flow dynamics. Predicting behavior in this setting relies on high-fidelity physics-based simulations that are computationally expensive. Yet, the uncertain, heterogeneous properties that control these flows make it necessary to perform many of these expensive simulations, which is often prohibitive. To address these challenges, we introduce a physics-informed machine learning workflow that couples a fully differentiable multiphase flow simulator, which is implemented in the DPFEHM framework with a convolutional neural network (CNN). The CNN learns to predict fluid extraction rates from heterogeneous permeability fields to enforce pressure limits at critical reservoir locations. By incorporating transient multiphase flow physics into the training process, our method enables more practical and accurate predictions for realistic injection-extraction scenarios compare to previous works. To speed up training, we pretrain the model on single-phase, steady-state simulations and then fine-tune it on full multiphase scenarios, which dramatically reduces the computational cost. We demonstrate that high-accuracy training can be achieved with fewer than three thousand full-physics multiphase flow simulations -- compared to previous estimates requiring up to ten million. This drastic reduction in the number of simulations is achieved by leveraging transfer learning from much less expensive single-phase simulations.

Agnese Marcato, Aleksandra Pachalieva, Ryley G. Hill et al.

Accurately predicting when and how materials fail is critical to designing safe, reliable structures, mechanical systems, and engineered components that operate under stress. Yet, fracture behavior remains difficult to model across the diversity of materials, geometries, and loading conditions in real-world applications. While machine learning (ML) methods show promise, most models are trained on narrow datasets, lack robustness, and struggle to generalize. Meanwhile, physics-based simulators offer high-fidelity predictions but are fragmented across specialized methods and require substantial high-performance computing resources to explore the input space. To address these limitations, we present a data-driven foundation model for fracture prediction, a transformer-based architecture that operates across simulators, a wide range of materials (including plastic-bonded explosives, steel, aluminum, shale, and tungsten), and diverse loading conditions. The model supports both structured and unstructured meshes, combining them with large language model embeddings of textual input decks specifying material properties, boundary conditions, and solver settings. This multimodal input design enables flexible adaptation across simulation scenarios without changes to the model architecture. The trained model can be fine-tuned with minimal data on diverse downstream tasks, including time-to-failure estimation, modeling fracture evolution, and adapting to combined finite-discrete element method simulations. It also generalizes to unseen materials such as titanium and concrete, requiring as few as a single sample, dramatically reducing data needs compared to standard ML. Our results show that fracture prediction can be unified under a single model architecture, offering a scalable, extensible alternative to simulator-specific workflows.

Roman Colman, Minh Vu, Manish Bhattarai et al.

For decades, corporations and governments have relied on scanned documents to record vast amounts of information. However, extracting this information is a slow and tedious process due to the sheer volume and complexity of these records. The rise of Vision Language Models (VLMs) presents a way to efficiently and accurately extract the information out of these documents. The current automated workflow often requires a two-step approach involving the extraction of information using optical character recognition software and subsequent usage of large language models for processing this information. Unfortunately, these methods encounter significant challenges when dealing with noisy scanned documents, often requiring computationally expensive language models to handle high information density effectively. In this study, we propose PatchFinder, an algorithm that builds upon VLMs to improve information extraction. First, we devise a confidence-based score, called Patch Confidence, based on the Maximum Softmax Probability of the VLMs' output to measure the model's confidence in its predictions. Using this metric, PatchFinder determines a suitable patch size, partitions the input document into overlapping patches, and generates confidence-based predictions for the target information. Our experimental results show that PatchFinder, leveraging Phi-3v, a 4.2-billion-parameter VLM, achieves an accuracy of 94% on our dataset of 190 noisy scanned documents, outperforming ChatGPT-4o by 18.5 percentage points.

Daniel O'Malley, Manish Bhattarai, Nishath Rajiv Ranasinghe et al.

We present a novel benchmark designed to rigorously evaluate the capabilities of large language models (LLMs) in mathematical reasoning and algorithmic code synthesis tasks. The benchmark comprises integer sequence generation tasks sourced from the Online Encyclopedia of Integer Sequences (OEIS), testing LLMs' abilities to accurately and efficiently generate Python code to compute these sequences without using lookup tables. Our comprehensive evaluation includes leading models from OpenAI (including the specialized reasoning-focused o-series), Anthropic, Meta, and Google across a carefully selected set of 1000 OEIS sequences categorized as ``easy'' or ``hard.'' Half of these sequences are classical sequences from the early days of OEIS and half were recently added to avoid contamination with the models' training data. To prevent models from exploiting memorized sequence values, we introduce an automated cheating detection mechanism that flags usage of lookup tables, validated by comparison with human expert evaluations. Experimental results demonstrate that reasoning-specialized models (o3, o3-mini, o4-mini from OpenAI, and Gemini 2.5-pro from Google) achieve substantial improvements in accuracy over non-reasoning models, especially on more complex tasks. However, overall model performance on the hard sequences is poor, highlighting persistent challenges in algorithmic reasoning. Our benchmark provides important insights into the strengths and limitations of state-of-the-art LLMs, particularly emphasizing the necessity for further advancements to reliably solve complex mathematical reasoning tasks algorithmically.

Aleksandra Pachalieva, Jeffrey D. Hyman, Daniel O'Malley et al.

We perform a set of flow and reactive transport simulations within three-dimensional fracture networks to learn the factors controlling mineral reactions. CO$_2$ mineralization requires CO$_2$-laden water, dissolution of a mineral that then leads to precipitation of a CO$_2$-bearing mineral. Our discrete fracture networks (DFN) are partially filled with quartz that gradually dissolves until it reaches a quasi-steady state. At the end of the simulation, we measure the quartz remaining in each fracture within the domain. We observe that a small backbone of fracture exists, where the quartz is fully dissolved which leads to increased flow and transport. However, depending on the DFN topology and the rate of dissolution, we observe a large variability of these changes, which indicates an interplay between the fracture network structure and the impact of geochemical dissolution. In this work, we developed a machine learning framework to extract the important features that support mineralization in the form of dissolution. In addition, we use structural and topological features of the fracture network to predict the remaining quartz volume in quasi-steady state conditions. As a first step to characterizing carbon mineralization, we study dissolution with this framework. We studied a variety of reaction and fracture parameters and their impact on the dissolution of quartz in fracture networks. We found that the dissolution reaction rate constant of quartz and the distance to the flowing backbone in the fracture network are the two most important features that control the amount of quartz left in the system. For the first time, we use a combination of a finite-volume reservoir model and graph-based approach to study reactive transport in a complex fracture network to determine the key features that control dissolution.

Teeratorn Kadeethum, Francesco Ballarin, Daniel O'Malley et al.

We propose a unified data-driven reduced order model (ROM) that bridges the performance gap between linear and nonlinear manifold approaches. Deep learning ROM (DL-ROM) using deep-convolutional autoencoders (DC-AE) has been shown to capture nonlinear solution manifolds but fails to perform adequately when linear subspace approaches such as proper orthogonal decomposition (POD) would be optimal. Besides, most DL-ROM models rely on convolutional layers, which might limit its application to only a structured mesh. The proposed framework in this study relies on the combination of an autoencoder (AE) and Barlow Twins (BT) self-supervised learning, where BT maximizes the information content of the embedding with the latent space through a joint embedding architecture. Through a series of benchmark problems of natural convection in porous media, BT-AE performs better than the previous DL-ROM framework by providing comparable results to POD-based approaches for problems where the solution lies within a linear subspace as well as DL-ROM autoencoder-based techniques where the solution lies on a nonlinear manifold; consequently, bridges the gap between linear and nonlinear reduced manifolds. Furthermore, this BT-AE framework can operate on unstructured meshes, which provides flexibility in its application to standard numerical solvers, on-site measurements, experimental data, or a combination of these sources.

Marta D'Elia, Hang Deng, Cedric Fraces et al.

The "Workshop on Machine learning in heterogeneous porous materials" brought together international scientific communities of applied mathematics, porous media, and material sciences with experts in the areas of heterogeneous materials, machine learning (ML) and applied mathematics to identify how ML can advance materials research. Within the scope of ML and materials research, the goal of the workshop was to discuss the state-of-the-art in each community, promote crosstalk and accelerate multi-disciplinary collaborative research, and identify challenges and opportunities. As the end result, four topic areas were identified: ML in predicting materials properties, and discovery and design of novel materials, ML in porous and fractured media and time-dependent phenomena, Multi-scale modeling in heterogeneous porous materials via ML, and Discovery of materials constitutive laws and new governing equations. This workshop was part of the AmeriMech Symposium series sponsored by the National Academies of Sciences, Engineering and Medicine and the U.S. National Committee on Theoretical and Applied Mechanics.

Teeratorn Kadeethum, Daniel O'Malley, Jan Niklas Fuhg et al.

This work is the first to employ and adapt the image-to-image translation concept based on conditional generative adversarial networks (cGAN) towards learning a forward and an inverse solution operator of partial differential equations (PDEs). Even though the proposed framework could be applied as a surrogate model for the solution of any PDEs, here we focus on steady-state solutions of coupled hydro-mechanical processes in heterogeneous porous media. Strongly heterogeneous material properties, which translate to the heterogeneity of coefficients of the PDEs and discontinuous features in the solutions, require specialized techniques for the forward and inverse solution of these problems. Additionally, parametrization of the spatially heterogeneous coefficients is excessively difficult by using standard reduced order modeling techniques. In this work, we overcome these challenges by employing the image-to-image translation concept to learn the forward and inverse solution operators and utilize a U-Net generator and a patch-based discriminator. Our results show that the proposed data-driven reduced order model has competitive predictive performance capabilities in accuracy and computational efficiency as well as training time requirements compared to state-of-the-art data-driven methods for both forward and inverse problems.

Cristina Garcia-Cardona, M. Giselle Fernández-Godino, Daniel O'Malley et al.

Simulation of the crack network evolution on high strain rate impact experiments performed in brittle materials is very compute-intensive. The cost increases even more if multiple simulations are needed to account for the randomness in crack length, location, and orientation, which is inherently found in real-world materials. Constructing a machine learning emulator can make the process faster by orders of magnitude. There has been little work, however, on assessing the error associated with their predictions. Estimating these errors is imperative for meaningful overall uncertainty quantification. In this work, we extend the heteroscedastic uncertainty estimates to bound a multiple output machine learning emulator. We find that the response prediction is accurate within its predicted errors, but with a somewhat conservative estimate of uncertainty.

Daniel O'Malley, John K. Golden

Homomorphic encryption has been an area of study in classical computing for decades. The fundamental goal of homomorphic encryption is to enable (untrusted) Oscar to perform a computation for Alice without Oscar knowing the input to the computation or the output from the computation. Alice encrypts the input before sending it to Oscar, and Oscar performs the computation directly on the encrypted data, producing an encrypted result. Oscar then sends the encrypted result of the computation back to Alice, who can decrypt it. We describe an approach to homomorphic encryption for quantum annealing based on spin reversal transformations and show that it comes with little or no performance penalty. This is in contrast to approaches to homomorphic encryption for classical computing, which incur a significant additional computational cost. This implies that the performance gap between quantum annealing and classical computing is reduced when both paradigms use homomorphic encryption. Further, homomorphic encryption is critical for quantum annealing because quantum annealers are native to the cloud -- a third party (such as untrusted Oscar) performs the computation. If sensitive information, such as health-related data subject to the Health Insurance Portability and Accountability Act, is to be processed with quantum annealers, such a technique could be useful.

John Golden, Daniel O'Malley

It was recently shown that quantum annealing can be used as an effective, fast subroutine in certain types of matrix factorization algorithms. The quantum annealing algorithm performed best for quick, approximate answers, but performance rapidly plateaued. In this paper, we utilize reverse annealing instead of forward annealing in the quantum annealing subroutine for nonnegative/binary matrix factorization problems. After an initial global search with forward annealing, reverse annealing performs a series of local searches that refine existing solutions. The combination of forward and reverse annealing significantly improves performance compared to forward annealing alone for all but the shortest run times.

Daniel O'Malley, John K. Golden, Velimir V. Vesselinov

Inverse problems often involve matching observational data using a physical model that takes a large number of parameters as input. These problems tend to be under-constrained and require regularization to impose additional structure on the solution in parameter space. A central difficulty in regularization is turning a complex conceptual model of this additional structure into a functional mathematical form to be used in the inverse analysis. In this work we propose a method of regularization involving a machine learning technique known as a variational autoencoder (VAE). The VAE is trained to map a low-dimensional set of latent variables with a simple structure to the high-dimensional parameter space that has a complex structure. We train a VAE on unconditioned realizations of the parameters for a hydrological inverse problem. These unconditioned realizations neither rely on the observational data used to perform the inverse analysis nor require any forward runs of the physical model, thus making the computational cost of generating the training data minimal. The central benefit of this approach is that regularization is then performed on the latent variables from the VAE, which can be regularized simply. A second benefit of this approach is that the VAE reduces the number of variables in the optimization problem, thus making gradient-based optimization more computationally efficient when adjoint methods are unavailable. After performing regularization and optimization on the latent variables, the VAE then decodes the problem back to the original parameter space. Our approach constitutes a novel framework for regularization and optimization, readily applicable to a wide range of inverse problems. We call the approach RegAE.

Daniel O'Malley, Velimir V. Vesselinov, Boian S. Alexandrov et al.

D-Wave quantum annealers represent a novel computational architecture and have attracted significant interest, but have been used for few real-world computations. Machine learning has been identified as an area where quantum annealing may be useful. Here, we show that the D-Wave 2X can be effectively used as part of an unsupervised machine learning method. This method can be used to analyze large datasets. The D-Wave only limits the number of features that can be extracted from the dataset. We apply this method to learn the features from a set of facial images.