Publications

Parekh, O. (2019). Almost optimal classical algorithms for a quantum generalization of Max Cut [Conference Poster]. https://www.osti.gov/biblio/1643365

Hughes, C., Voskuilen, G.R., Zhang, M., Rogers, T., & Rogers, T. (2019). The Structural Simulation Toolkit [Presentation]. https://www.osti.gov/biblio/1646385

Bachman, W.B., Wildey, T., & Wildey, T. (2019). Materials informatics: data-driven materials design and uncertainty quantification perspectives [Conference Poster]. https://www.osti.gov/biblio/1643479

Zhen, T., Klise, K.A., Cunningham, S., Marszal, E., Laird, C., & Laird, C. (2019). A mathematical programming approach for the optimal placement of flame detectors in petrochemical facilities. Process Safety and Environmental Protection, 132(C), pp. 47-58. https://doi.org/10.1016/j.psep.2019.08.030

Singh, B., Pozo, D., & Pozo, D. (2019). A Guide to Solar Power Forecasting using ARMA Models. 2019 IEEE PES Innovative Smart Grid Technologies Europe (ISGT-Europe). https://doi.org/10.1109/ISGTEurope.2019.8905430

Slota, G.M., Berry, J., Hammond, S., Olivier, S.L., Phillips, C.A., Rajamanickam, S., & Rajamanickam, S. (2019). Scalable generation of graphs for benchmarking HPC community-detection algorithms [Conference Poster]. International Conference for High Performance Computing, Networking, Storage and Analysis, SC. https://doi.org/10.1145/3295500.3356206

Trujillo, G., Trott, C.R., & Trott, C.R. (2019). Milestone CPP. https://doi.org/10.2172/1573930

Trujillo, G., Trott, C.R., & Trott, C.R. (2019). Milestone 1261. https://doi.org/10.2172/1573928

Trujillo, G., Trott, C.R., & Trott, C.R. (2019). Milestone ASC. https://doi.org/10.2172/1573929

Moreland, K. (2019). ECP ST Capability Assessment Report (CAR) for VTK-m (FY19). https://doi.org/10.2172/1573441

Pei, Y., Bosilca, G., Yamazaki, I., Ida, A., Dongarra, J., & Dongarra, J. (2019). Evaluation of Programming Models to Address Load Imbalance on Distributed Multi-Core CPUs: A Case Study with Block Low-Rank Factorization [Conference Poster]. Proceedings of PAW-ATM 2019: Parallel Applications Workshop, Alternatives to MPI+X, Held in conjunction with SC 2019: The International Conference for High Performance Computing, Networking, Storage and Analysis. https://www.scopus.com/inward/record.uri?partnerID=HzOxMe3b&scp=85084107961&origin=inward

Xie, B., Tan, Z., Carns, P., Chase, J.S., Harms, K., Lofstead, G.F., Oral, S., Vazhkudai, S.S., Wang, F., & Wang, F. (2019). Applying Learning Techniques to Understand the Write Performance of Large-scale Parallel Filesystems [Conference Poster]. https://www.osti.gov/biblio/1643318

Gupta, R., Raybourn, E.M., Milewicz, R.M., & Milewicz, R.M. (2019). Got agility? A lightweight technique for Productivity Sustainability Improvement Planning (PSIP) [Presentation]. https://www.osti.gov/biblio/1646300

Geraci, G., Blonigan, P.J., Rizzi, F., Gorodetsky, A., Carlberg, K., Eldred, M., & Eldred, M. (2019). An integrated and efficient framework for embedded Reduced Order Models for multifidelity Uncertainty Quantification [Conference Poster]. https://www.osti.gov/biblio/1643587

Ghazimirsaeed, S.M., Grant, R., Afsahi, A., & Afsahi, A. (2019). A dynamic, unified design for dedicated message matching engines for collective and point-to-point communications. Parallel Computing, 89(C). https://doi.org/10.1016/j.parco.2019.102547

Steyer, A. (2019). IMEX and ETD Methods for NonHydrostatic Atmosphere [Presentation]. https://www.osti.gov/biblio/1646303

Silling, S.A. (2019). Peridynamic modeling of fatigue and fracture [Presentation]. https://www.osti.gov/biblio/1646216

Hughes, C., Green, R., Voskuilen, G.R., Zhang, M., Rogers, T., & Rogers, T. (2019). GPGPU-Sim Overview [Conference Poster]. https://www.osti.gov/biblio/1643091

Bradley, A.M. (2019). Algorithms and software for fast atmospheric tracer transport in E3SM [Presentation]. https://www.osti.gov/biblio/1646298

Bachman, W.B., Wang, Y., Furlan, J., Pagalthivarthi, K., Cutright, A., Garman, M., Visintainer, R., & Visintainer, R. (2019). WearGP: A machine learning wear prediction framework for slurry pump impellers and casings under different operating conditions [Conference Poster]. https://www.osti.gov/biblio/1643296

Aaziz, O., Vaughan, C.T., Cook, J., Cook, J., Kuehn, J., Richards, D., & Richards, D. (2019). Fine-Grained Analysis of Communication Similarity between Real and Proxy Applications [Conference Poster]. Proceedings of PMBS 2019: Performance Modeling, Benchmarking and Simulation of High Performance Computer Systems - Held in conjunction with SC 2019: The International Conference for High Performance Computing, Networking, Storage and Analysis. https://www.scopus.com/inward/record.uri?partnerID=HzOxMe3b&scp=85084037580&origin=inward

Moon, G.E., Newman-Griffis, D., Kim, J., Sukumaran-Rajam, A., Fosler-Lussier, E., Sadayappan, P., & Sadayappan, P. (2019). Parallel Data-Local Training for Optimizing Word2Vec Embeddings for Word and Graph Embeddings [Conference Poster]. https://doi.org/10.1109/MLHPC49564.2019.00010

Valentin, M.A., Clark, B.W., Robbins, J., Viertel, R., & Viertel, R. (2019). PLATO: Optimization-Based Design Ecosystem [Presentation]. https://www.osti.gov/biblio/1646245

Younge, A.J. (2019). SC 19 Tutorial: Best Practices [Conference Poster]. https://www.osti.gov/biblio/1643321

Rudinger, K.M. (2019). Benchmarking near-term quantum information processors [Presentation]. https://www.osti.gov/biblio/1646305

Younge, A.J. (2019). Astra and the state of ARM in HPC [Conference Poster]. https://www.osti.gov/biblio/1643325

Hughes, C., Green, R., Voskuilen, G.R., Zhang, M., Rogers, T., & Rogers, T. (2019). The Structural Simulation Toolkit and GPGPU-Sim [Conference Poster]. https://www.osti.gov/biblio/1643092

Hughes, C., Green, R., Voskuilen, G.R., Zhang, M., Rogers, T., & Rogers, T. (2019). The Structural Simulation Toolkit [Conference Poster]. https://www.osti.gov/biblio/1643100

Beltre, A.M., Saha, P., Govindaraju, M., Grant, R., Younge, A.J., & Younge, A.J. (2019). Enabling HPC Workloads on Cloud Infrastructure Using Kubernetes Container Orchestration Mechanisms [Conference Poster]. Proceedings of CANOPIE-HPC 2019: 1st International Workshop on Containers and New Orchestration Paradigms for Isolated Environments in HPC - Held in conjunction with SC 2019: The International Conference for High Performance Computing, Networking, Storage and Analysis. https://doi.org/10.1109/CANOPIE-HPC49598.2019.00007

Lofstead, G.F., Monnier, N., Lawson, M., Curry, M., & Curry, M. (2019). Profiling Platform Storage Using IO500 and Mistral [Conference Poster]. https://www.osti.gov/biblio/1643319

Younge, A.J. (2019). E4S and Supercontainers [Conference Poster]. https://www.osti.gov/biblio/1643324

Younge, A.J. (2019). SC19 BOF: Containers in HPC [Conference Poster]. https://www.osti.gov/biblio/1643326

Proctor, T.J., Rudinger, K.M., Young, K.C., Nielsen, E., Blume-Kohout, R.J., & Blume-Kohout, R.J. (2019). Demonstrating Scalable Benchmarking of Quantum Computers [Conference Poster]. https://www.osti.gov/biblio/1643250

Younge, A.J. (2019). A Case for Portability and Reproducibility of HPC Containers [Conference Poster]. https://www.osti.gov/biblio/1643331

Sahasrabudhe, D., Phipps, E.T., Rajamanickam, S., Berzins, M., & Berzins, M. (2019). A Portable SIMD Primitive in Kokkos for Heterogeneous Architectures [Conference Poster]. https://www.osti.gov/biblio/1643357

Canon, R.S., Younge, A.J., & Younge, A.J. (2019). A Case for Portability and Reproducibility of HPC Containers [Conference Poster]. Proceedings of CANOPIE-HPC 2019: 1st International Workshop on Containers and New Orchestration Paradigms for Isolated Environments in HPC - Held in conjunction with SC 2019: The International Conference for High Performance Computing, Networking, Storage and Analysis. https://doi.org/10.1109/CANOPIE-HPC49598.2019.00012

Younge, A.J. (2019). SC 19 Tutorial: Getting Started with Containers on HPC [Conference Poster]. https://www.osti.gov/biblio/1643320

Hollman, D.S., Lelbach, B.A., Edwards, H.C., Hoemmen, M.F., Sunderland, D., Trott, C.R., & Trott, C.R. (2019). mdspan in C++: A Case Study in the Integration of Performance Portable Features into International Language Standards [Presentation]. https://doi.org/10.1109/P3HPC49587.2019.00011

Cardwell, S.G., Bennett, C., Aimone, J.B., Dellana, R., Aggarwal, S., & Aggarwal, S. (2019). Evaluating complexity and resilience trade-offs in emerging memory inference machines [Conference Poster]. https://www.osti.gov/biblio/1643292

Younge, A.J. (2019). Astra and the state of ARM in HPC [Conference Poster]. https://www.osti.gov/biblio/1643323

Slota, G.M., Berry, J., Hammond, S., Olivier, S.L., Phillips, C.A., Rajamanickam, S., & Rajamanickam, S. (2019). Scalable Generation of Graphs for Benchmarking HPC Community-Detection Algorithms [Conference Poster]. https://doi.org/10.1145/3295500.3356206

Kramer, S., Bolintineanu, D.S., Long, K., Waymel, R., Quintana, E.C., Jones, R.E., Roberts, S.A., Newcomer, J.T., Stracuzzi, D.J., Swiler, L.P., & Swiler, L.P. (2019). Mechanics of Materials Utilizing Machine Learning: Examples at Sandia National Laboratories [Conference Poster]. https://www.osti.gov/biblio/1643105

Phillips, C.A. (2019). Advanced Data Structures for National Cyber Security [Presentation]. https://www.osti.gov/biblio/1646225

Aimone, J.B. (2019). Preparing for the Next Generation of AI [Conference Poster]. https://www.osti.gov/biblio/1643272

Wildey, T., Bruder, L., Bui-Thanh, T., Butler, T., Jakeman, J.D., Marvin, B., Bachman, W.B., Walsh, S., & Walsh, S. (2019). Moving Beyond Forward Simulation to Enable Data-informed Physics-based Predictions [Presentation]. https://www.osti.gov/biblio/1646273

Wheeler, L.B., Roesler, E.L., Bolstad, M., & Bolstad, M. (2019). Earth System Viz: Enabling Discovery of Science at Scale [Presentation]. https://www.osti.gov/biblio/1646293

Brugger, E., Crossno, P.J., Dubois, J., Guilbaud, C., Patchett, J., Woods, N., & Woods, N. (2019). NNSA/CEA Collaboration: Visualization SC19 Update [Presentation]. https://www.osti.gov/biblio/1646294

Younge, A.J. (2019). Enabling HPC workloads on Cloud Infrastructure using Kubernetes Container Orchestration Mechanisms [Conference Poster]. https://www.osti.gov/biblio/1883546

Younge, A.J. (2019). Advancing the Usage and Scalability of Containers in HPC [Conference Poster]. https://www.osti.gov/biblio/1643322

Jakeman, J.D., Eldred, M.S., Geraci, G., Gorodetsky, A., & Gorodetsky, A. (2019). Adaptive multi-index collocation for uncertainty quantification and sensitivity analysis. https://doi.org/10.2172/1574406

Russo, A., Baczewski, A.D., Morrison, B., Rudinger, K.M., & Rudinger, K.M. (2019). Benchmarking quantum comptuers with robust phase estimation of molecular hydrogen [Conference Poster]. https://www.osti.gov/biblio/1643624

Jakeman, J.D. (2019). Uncertainty Quantification: An Overview [Conference Poster]. https://www.osti.gov/biblio/1643293

Trask, N.A., Huang, A., & Huang, A. (2019). Physics informed machine learning at SNL [Presentation]. https://www.osti.gov/biblio/1646432

Schultz, P.A., Tranchida, J., Chandross, M., Thompson, A.P., & Thompson, A.P. (2019). From First-Principles toward atomistic understanding of mechanical properties in High-Entropy Alloys [Conference Poster]. https://www.osti.gov/biblio/1643633

Vineyard, C., Helinski, R., Koc, C., Green, S., & Green, S. (2019). RAPDARTS: Resource-Aware Progressive Differentiable Architecture Search [Conference Poster]. https://www.osti.gov/biblio/1643262

Berry, J., Butcher, N., Catalyurek, U., Kogge, P., Lin, P., Olivier, S.L., Phillips, C.A., Rajamanickam, S., Slota, G.M., Voskuilen, G.R., Yasar, A., Young, J.S., & Young, J.S. (2019). Multi-Level Memory Algorithmics for Large, Sparse Problems. https://doi.org/10.2172/1574408

Nichol, J.J., Peterson, M.G., Peterson, K., Stracuzzi, D.J., Fricke, M., Moses, M., & Moses, M. (2019). FEATURE COMPARISON OF ARCTIC OBSERVATIONS AND CLIMATE MODELS [Conference Poster]. https://www.osti.gov/biblio/1643593

Trask, N.A. (2019). Compatible meshfree discretization [Presentation]. https://www.osti.gov/biblio/1646410

Gao, X., Mamaluy, D., Anderson, E.M., de Campbell, A., Grine, A., Katzenmeyer, A.M., Lu, T., Schmucker, S.W., Tracy, L.A., Ward, D.R., Misra, S., & Misra, S. (2019). Modeling Assisted Atomic Precision Advanced Manufacturing (APAM) Towards Room Temperature Operation [Conference Poster]. https://www.osti.gov/biblio/1643549

Staid, A. (2019). Consequence Modeling for Multi-Sector Resilience Analysis [Conference Poster]. https://www.osti.gov/biblio/1643243

Knueven, B. (2019). Scalable Models for Multi-Sector Resources [Conference Poster]. https://www.osti.gov/biblio/1643253

Marts, W.P., Dosanjh, M.G.F., Grant, R., Bridges, P., & Bridges, P. (2019). The Case for Modular Generalizable Proxy Applications for Systems Software Research [Conference Poster]. https://www.osti.gov/biblio/1643346

Milewicz, R.M. (2019). How to Write Code You?re Not Embarrassed to Share [Presentation]. https://www.osti.gov/biblio/1646316

Olivier, S.L. (2019). User Level Threading: Qthreads and OpenMP [Conference Poster]. https://www.osti.gov/biblio/1643628

Ellis, J.A., Devine, K., & Devine, K. (2019). Task Placement for Improvement of Parallel Scalability [Conference Poster]. https://www.osti.gov/biblio/1643629

Rajamanickam, S. (2019). Kokkos Kernels: Library Based Approach for Performance Portable Sparse/Dense linear algebra and Graph Kernels [Conference Poster]. https://www.osti.gov/biblio/1643356

Valentin, M.A. (2019). Optimization-Based Design [Presentation]. https://www.osti.gov/biblio/1646449

Adams, B.M. (2019). Computer Science and Cybersecurity R&D Careers at Sandia National Laboratories [Presentation]. https://www.osti.gov/biblio/1646264

Bynum, M., Castillo, A., Knueven, B., Siirola, J.D., Laird, C., & Laird, C. (2019). Decomposing Optimization-Based Bounds Tightening Problems Via Graph Partitioning [Conference Poster]. https://www.osti.gov/biblio/1643284

Trott, C.R. (2019). TheKokkosC++ Performance Portability Programming Model [Conference Poster]. https://www.osti.gov/biblio/1643332

Steyer, A., Krause, C.F., & Krause, C.F. (2019). Exponential Integrators for the HOMME-NH Nonhydrostatic Dycore [Presentation]. https://www.osti.gov/biblio/1721477

Fox, J.S., Rajamanickam, S., & Rajamanickam, S. (2019). How Robust Are Graph Neural Networks to Structural Noise? [Conference Poster]. https://www.osti.gov/biblio/1643354

Wright, C., Rajamanickam, S., & Rajamanickam, S. (2019). Predicting Molecular Toxicity from Structural Identity [Conference Poster]. https://www.osti.gov/biblio/1643355

Brickson, M.I. (2019). Device-level modeling of quantum dots for quantum computing and analog quantum simulation [Presentation]. https://www.osti.gov/biblio/1646456

Bartlett, R. (2019). Staying on top of a lot of CDash builds/tests: cdash_analyze_and_report.py [Conference Poster]. https://www.osti.gov/biblio/1643277

Schonbein, W., Grant, R., Dosanjh, M.G.F., Arnold, D., & Arnold, D. (2019). INCA: In-Network Compute Assistance [Conference Poster]. https://doi.org/10.1145/3295500.3356153

Hart, J.L. (2019). Hyper-Differential Sensitivity Analysis to Support Geophysical Inverse Problems [Conference Poster]. https://www.osti.gov/biblio/1643269

Boman, E.G., Darve, E., Lehoucq, R.B., Rajamanickam, S., Tuminaro, R.S., Yamazaki, I., & Yamazaki, I. (2019). Fast and Robust Linear Solvers based on Hierarchical Matrices (LDRD Final Report). https://doi.org/10.2172/1574609

Thompson, K. (2019). Entangled Vertex Cover is in P [Conference Poster]. https://www.osti.gov/biblio/1643571

Vineyard, C.M. (2019). Neural-inspired Computing at Sandia Labs - Enabling and Performing Advanced Computation [Conference Poster]. https://www.osti.gov/biblio/1643305

Chen, C., Cambier, L., Boman, E.G., Rajamanickam, S., Tuminaro, R.S., Darve, E., & Darve, E. (2019). A robust hierarchical solver for ill-conditioned systems with applications to ice sheet modeling. Journal of Computational Physics, 396(C), pp. 819-836. https://doi.org/10.1016/j.jcp.2019.07.024

Karim, M., Germann, T., Kadau, K., Narasimhachary, S., Silling, S.A., & Silling, S.A. (2019). Peridynamics Modeling of Damage Nucleation From Forging Flaws in Rotor Components [Conference Poster]. https://www.osti.gov/biblio/1643260

Pinar, A., Benz, Z.O., Castillo, A., Hart, W.E., Swiler, L.P., Tarman, T.D., & Tarman, T.D. (2019). SECURE: An Evidence-based Approach to Cyber Experimentation [Conference Poster]. Proceedings - 2019 Resilience Week, RWS 2019. https://doi.org/10.1109/RWS47064.2019.8971976

D'Elia, M., Bochev, P., & Bochev, P. (2019). Formulation analysis and computation of an optimization-based local-to-nonlocal coupling method. https://doi.org/10.2172/1572228

Foulk, J.W., Granzow, B.N., Mota, A., Ibanez-Granados, D.A., & Ibanez-Granados, D.A. (2019). An error estimation driven adaptive tetrahedral workflow for full engineering models. https://doi.org/10.2172/1572227

Cowen, B., el-Genk, M.S., Hattar, K., Briggs, S.A., & Briggs, S.A. (2019). Investigations of irradiation effects in crystalline and amorphous SiC. Journal of Applied Physics, 126(13). https://doi.org/10.1063/1.5085216

Lee, K., Carlberg, K., & Carlberg, K. (2019). Deep Conservation: A latent dynamics model for exact satisfaction of physical conservation laws [Report]. https://doi.org/10.2172/1569346

Morris, J., Cowen, B., Teysseyre, S., Hecht, A.A., & Hecht, A.A. (2019). Molecular dynamics investigation of threshold displacement energies in CaF₂. Computational Materials Science, 172(C). https://doi.org/10.1016/j.commatsci.2019.109293

Glusa, C., D'Elia, M., Antil, H., Weiss, C.J., van Bloemen Waanders, B.G., & van Bloemen Waanders, B.G. (2019). A Fast Solver for the Fractional Helmholtz Equation. https://doi.org/10.2172/1569144

Ebeida, M. (2019). An Anisotropic Adaptive Voronoi Meshing Method. https://doi.org/10.2172/1568991

Aksar, B., Schwaller, B., Aaziz, O., Ates, E., Brandt, J.M., Coskun, A., Egele, M., Leung, V.J., & Leung, V.J. (2019). AD for Machine Learning Approach to Understanding HPC Application Performance Variation Poster [Conference Poster]. https://www.osti.gov/biblio/1642788

Mariner, P.E., Debusschere, B.J., Jerden, J., Seidl, D.T., Swiler, L.P., Vo, J., & Vo, J. (2019). Lessons Learned in the Development of Source Term Surrogate Models for Repository Performance Assessment [Conference Poster]. https://www.osti.gov/biblio/1643084

Jacobson, N.T. (2019). Insights into spin-orbit coupling at the Si/SiO2 interface using an intervalley hot spot singlet/triplet qubit [Conference Poster]. https://www.osti.gov/biblio/1642783

Ibanez-Granados, D.A. (2019). Omega_h: Cutting-edge Adaptation Algorithms with HPC Portability [Conference Poster]. https://www.osti.gov/biblio/1642779

Baczewski, A.D., Brickson, M.I., Campbell, Q.T., Jacobson, N.T., Maurer, L., Witzel, W., Misra, S., Luhman, D.R., & Luhman, D.R. (2019). Modeling the electronic structure and dynamics of semiconductor quantum devices [Conference Poster]. https://www.osti.gov/biblio/1642785

Gao, X., Mamaluy, D., Goldflam, M., & Goldflam, M. (2019). FAIR DEAL GC Thrust 2: APAM modeling [Presentation]. https://www.osti.gov/biblio/1646191

Swiler, L.P., Geraci, G., Debusschere, B.J., Crussell, J., & Crussell, J. (2019). Uncertainty Quantification in Cyber Emulation [Conference Poster]. https://www.osti.gov/biblio/1642954

Silling, S.A. (2019). The Mechanics of Unstable Peridynamic Materials [Conference Poster]. https://www.osti.gov/biblio/1642955

Schwaller, B., Aksar, B., Aaziz, O., Ates, E., Brandt, J.M., Coskun, A., Egele, M., Leung, V.J., & Leung, V.J. (2019). A Machine Learning Approach to Understanding HPC Application Performance Variation [Conference Poster]. https://www.osti.gov/biblio/1642784

Lehoucq, R.B., Lipton, R.P., Jha, P.K., & Jha, P.K. (2019). Complex Fracture Nucleation and Evolution with Nonlocal Elastodynamics. Journal of Peridynamics and Nonlocal Modeling, 1(2), pp. 122-130. https://doi.org/10.1007/s42102-019-00010-0