Publications

Henkelis, S., Rademacher, D.X., Vogel, D.J., Valdez, N.R., Rodriguez, M.A., Nenoff, T.M., & Nenoff, T.M. (2021). Competitive Adsorption of NOx/SOx/H2O in RE-DOBDC MOFs from a Complex Gas Stream [Conference Presentation]. 10.2172/1862903

Tidwell, V.C., Wortz, B., Foulk, J.W., Voisin, N., Turner, S., MacKnick, J., Cohen, S., Dyreson, A., Miara, A., & Miara, A. (2021). Integrating critical water issues into long-term planning for WECC [Presentation]. https://www.osti.gov/biblio/1862904

Lowry, T.S., Sabin, A., Ayling, B., Hinz, N., Arguello, R., Blake, K., Tiedeman, A., & Tiedeman, A. (2021). Deep Direct-Use: A Probabilistic Systems Analysis Approach for Techno-Economic Analysis [Conference Presentation]. 10.2172/1862906

Sikora, J. (2021). Technical Assistance for RingIR Aerosol Penetration Study with RingIR. 10.2172/1777072

Geissel, M. (2021). CY2020 Report for PECOS Activities. 10.2172/1777074

Spencer, S.J. (2021). Unmanned Systems & Autonomy R&D at Sandia [Presentation]. https://www.osti.gov/biblio/1862907

Freno, B.A., Matula, N., Johnson, W.A., & Johnson, W.A. (2021). Manufactured Solutions for the Method-of-Moments Implementation of the Electric-Field Integral Equation [Conference Presentation]. 10.2172/1863178

Miller, D.A., Samborsk, D.D., Stoffels, M.T., Voth, M.M., Nunemaker, J.D., Newhouse, K.J., Hernandez-Sanchez, B.A., & Hernandez-Sanchez, B.A. (2021). Summary of Marine and Hydrokinetic (MHK) Composites Testing at Montana State University [Presentation]. https://www.osti.gov/biblio/1863179

Heeger, D., Garigan, M., Plusquellic, J., Tsiropoulou, E.E., & Tsiropoulou, E.E. (2021). Secure LoRa firmware update with adaptive data rate techniques. Sensors, 21(7). 10.3390/s21072384

Beeny, B.A. (2021). MELCOR Best Practices for High Temperature Gas-cooled Reactor Modeling [Conference Presentation]. 10.2172/1863181

Bolintineanu, D.S., Frankel, A., Hamel, C., Long, K.N., Kramer, S.L.B., & Kramer, S.L.B. (2021). Machine learned constitutive models for foam mechanics and powder rheology [Conference Presentation]. 10.2172/1863182

Baczewski, A.D. (2021). State preparation for robust phase estimation in molecular systems [Conference Presentation]. 10.2172/1863183

Weers, J., Huggins, J., Driscoll, F., Copping, A., Whiting, J., Garavelli, L., Farr, H., Lansing, C., Ruehl, K.M., Castillo, C.R., Faltas, M.A., & Faltas, M.A. (2021). Waves of Data: Modern Challenges Facing the DOE Marine and Hydrokinetic Data Repository (MHKDR) and the Marine Energy Industry [Conference Poster]. 10.2172/1863184

Klise, K.A., Hart, D., Hogge, J.W., Villa, D.L., Haxton, T., & Haxton, T. (2021). Recent updates to the Water Network Tool for Resilience software [Conference Presentation]. 10.2172/1863185

Hecht, E.S. (2021). Scientific justification for updating the bulk liquid separation distance tables in NFPA 2 [Presentation]. https://www.osti.gov/biblio/1863186

Poudyal, A., Tamrakar, U., Trevizan, R.D., Fourney, R., Tonkoski, R., Hansen, T.M., & Hansen, T.M. (2021). Convolutional Neural Network-based InertiaEstimation using Local Frequency Measurements [Conference Presentation]. 10.2172/1863187

Ilgen, A.G., Leung, K., Kabengi, N., & Kabengi, N. (2021). Adsorption of lanthanides at nanoconfined silica- and alumina-water interfaces [Conference Presentation]. 10.2172/1863188

Ross, L.C., Anderson, D.Z., & Anderson, D.Z. (2021). Watershed [Conference Poster]. 10.2172/1863189

Yager-Elorriaga, D.A., Gomez, M.R., Ruiz, D.E., Slutz, S.A., Harvey-Thompson, A.J., Jennings, C.A., Weis, M.R., Awe, T.J., Chandler, G.A., Myers, C., Fein, J.R., Geissel, M., Glinsky, M.E., Hansen, S.B., Harding, E.C., Lamppa, D.C., Foulk, J.W., Robertson, G.K., Savage, M.E., … Rochau, G.A. (2021). An overview of magneto-inertial fusion on the Z Machine at Sandia National Laboratories [Conference Paper]. https://www.osti.gov/biblio/1889036

Yager-Elorriaga, D.A., Gomez, M.R., Ruiz, D.E., Slutz, S.A., Harvey-Thompson, A.J., Jennings, C.A., Knapp, P.F., Schmit, P., Weis, M.R., Awe, T.J., Chandler, G.A., Mangan, M.A., Myers, C., Fein, J.R., Geissel, M., Glinsky, M.E., Hansen, S.B., Harding, E.C., Lamppa, D.C., … Sinars, D. (2021). An overview of magneto-inertial fusion on the Z Machine at Sandia National Laboratories [Conference Poster]. https://doi.org/10.2172/1863327

le Pham, T., Deng, K., Northen, T.R., Singer, S.W., Adams, P.D., Simmons, B.A., Sale, K.L., & Sale, K.L. (2021). Expression of fungal laccase in Pichia pastoris and characterization of their activity using nanostructure-initiator mass spectrometry assay [Conference Poster]. 10.2172/1863190

Bhujel, N., Tamrakar, U., Hansen, T.M., Byrne, R.H., Tonkoski, R., & Tonkoski, R. (2021). Model Predictive Integrated Voltage and Frequency Support in Microgrids [Conference Presentation]. 10.2172/1863192

Armijo, K.M. (2021). High/Low Power Arc & Ground-Fault Detection/Mitigation R&D [Presentation]. https://www.osti.gov/biblio/1863193

Dagel, A., Epstein, C., Finnegan, P.S., Goodner, R.N., Grover, S., Kernen, B.L., Mulcahy-Stanislawczyk, J., Thompson, K., West, R.D., & West, R.D. (2021). Mask design and fabrication for higher energy speckle-based XPCI [Conference Presentation]. 10.2172/1863194

Brown, N.J.K., Hoffman, M., Bussell, S.J., Gilletly, S.D., Cauthen, K.R., John, E.W.L., Nozick, L., & Nozick, L. (2021). Multi-Int Data Fusion for Proliferation Detection (NSARD 2021 presentation [final]) [Presentation]. https://www.osti.gov/biblio/1863195

Clayton, D.J. (2021). MACCS Code Applicability for Nearfield Consequence Analysis [Presentation]. https://www.osti.gov/biblio/1863196

Robbins, B., Coffin, P., Delgado, P.M., Smith, J., Dechant, L., Casper, K.M., Ray, J., & Ray, J. (2021). Aerospace Vehicle Random Vibration Research at Sandia National Laboratories [Presentation]. https://www.osti.gov/biblio/1863198

Silling, S., Fermen-Coker, M., & Fermen-Coker, M. (2021). Peridynamic Modeling of Microballistic Impact on Multilayer Graphene [Conference Presentation]. 10.2172/1863328

Monroe, E., Shinde, S.D., Carlson, J., Davis, R., & Davis, R. (2021). High performance biodiesel: Integrating fusel alcohol/fatty acid upgrading strategies for novel biodiesel fuels [Conference Presentation]. 10.2172/1863329

Clark, S.M. (2021). Quantum Hardware for All [Conference Presentation]. 10.2172/1863330

Tezaur, I.K. (2021). My Career as a Computational Scientist at Sandia National Labs [Presentation]. https://www.osti.gov/biblio/1863331

Smartt, H.A., Benin, A.I., Corbin, W., Feng, P.L., Jones, A.R., Myllenbeck, N.R., Livesay, J., Pickett, C., & Pickett, C. (2021). Tamper-Indicating Enclosures with Visually Obvious Tamper Response (Final Project Report). 10.2172/1810221

Mullowney, P., Li, R., Thomas, S., Ananthan, S., Sharma, A., Rood, J., Williams, A.B., Sprague, M., & Sprague, M. (2021). Preparing an Incompressible-Flow Fluid Dynamics Code for Exascale-Class Wind Energy Simulations [Conference Paper]. 10.1145/3458817.3476185

Ehrhart, B.D. (2021). Trade-Offs and Current Efforts in Hydrogen for Rail [Presentation]. https://www.osti.gov/biblio/1863333

Senanayake, H.S., Greathouse, J.A., Ilgen, A.G., Thompson, W.H., & Thompson, W.H. (2021). Simulations of the IR and Raman spectra of water confined in amorphous silica slit pores [Conference Presentation]. 10.2172/1877812

Campbell, C., Celina, M.C., Martinez, E.J., Collino, R., Astorga, D., & Astorga, D. (2021). Printing of High Tg Thermosets by Selective Laser Sintering (SLS) via Controlled Conversion [Conference Presentation]. 10.2172/1888729

Najm, H.N. (2021). Some Comments on Bayesian Optimal Experimental Design [Presentation]. https://www.osti.gov/biblio/1882502

Allendorf, M. (2021). Metal Hydrides for Transportation Applications [Presentation]. https://www.osti.gov/biblio/1884105

Parks, M.L. (2021). Computational Aspects of Nonlocal Models [Presentation]. https://www.osti.gov/biblio/1883536

Wilbanks, J.J., Owens, B., & Owens, B. (2021). Introduction to Structural Dynamics and its Application to System Design [Presentation]. https://www.osti.gov/biblio/1877530

Frederick, E., Campbell, Q., Benavidez, A., Kolesnichenko, I.V., Pena, L.F., Anderson, E.M., Wheeler, D.R., Misra, S., & Misra, S. (2021). Solvothermal Chemistry to ?Ultradope? Si(100) [Conference Presentation]. 10.2172/1877798

Willenbring, J.M., Shende, S., & Shende, S. (2021). E4S: Extreme-Scale Scientific Software Stack [Presentation]. https://www.osti.gov/biblio/1882038

Willenbring, J.M. (2021). Software Development Kits [Presentation]. https://www.osti.gov/biblio/1877841

Willenbring, J.M. (2021). Summary [Presentation]. https://www.osti.gov/biblio/1877839

McClary, S.A., Long, D.M., Kotula, P.G., Rodriguez, M.A., Jungjohann, K.L., Zavadil, K.R., & Zavadil, K.R. (2021). Multimodal Characterization of Electrodeposited Calcium Metal and Its Native Interphases for Next-Generation Battery Applications [Conference Presentation]. 10.2172/1877848

Landera, A., Davis, R.W., George, A., & George, A. (2021). Equation of state methods for the development of accurate models in support of Co-Optima [Conference Presentation]. 10.2172/1863710

Foulk, J.W. (2021). Demonstration of MACCS Capabilities for Advanced Reactors [Conference Presentation]. 10.2172/1863522

Ronevich, J., san Marchi, C., Emery, J.M., Grimmer, P.W., Brooks, D.M., Foulk, J.W., Campbell, J., Davis, B.C., McNair, J.D., & McNair, J.D. (2021). R&D for Safety Codes and Standards:Materials and Components Compatibility [Presentation]. https://www.osti.gov/biblio/1863523

Raybourn, E.M., Gonsiorowski, E., Milewicz, R.M., Rogers, D., Sims, B., Watson, G., Willenbring, J.M., & Willenbring, J.M. (2021). Hands-on Tutorial with PSIP Progress Tracking Cards: A Lightweight Method for Improving Software Practices [Presentation]. https://www.osti.gov/biblio/1863524

Domino, S.P. (2021). A Historical Perspective on Sandia National Laboratories Fire Science Mod/Sim Philosophy: The Role of High Performance Computing and Unstructured Numerical Methods Advances [Presentation]. https://www.osti.gov/biblio/1863525

Boman, E.G., Bielich, D.R.W., Loe, J.A., Yamazaki, I., & Yamazaki, I. (2021). PEEKS Overview [Presentation]. https://www.osti.gov/biblio/1863514

Pierre, B.J. (2021). Control of High Voltage DC Links Between Interconnections for Small Signal Stability [Conference Presentation]. 10.2172/1863515

Kent, M.S., Martinez, D.V., Ruiz, J.A.R., Juarros, M., Martinez, E.J., Alam, T.M., Simmons, B.A., Sale, K.L., Singer, S.W., & Singer, S.W. (2021). Depolymerization of lignin for biological conversion through sulfonation and a chelator-mediated Fenton reaction [Conference Poster]. 10.2172/1863494

Kent, M.S., Martinez, D.V., Juarros, M., Bell, N.S., Martinez, E.J., Alam, T.M., Sale, K.L., Simmons, B.S., & Simmons, B.S. (2021). Polyacids from lignin [Conference Presentation]. 10.2172/1863495

Harbour, T. (2021). Feasibility Study of a Structural Electrolyte Containment Ring for use in Thermal Batteries. https://www.osti.gov/biblio/1777890

Burns, K., Aitkaliyeva, A., & Aitkaliyeva, A. (2021). Mitigating the Substrate Effect on Two-Dimensional Molybdenum Disulfide: The Case of Lattice Contraction/Expansion [Conference Poster]. 10.2172/1863496

Willenbring, J.M. (2021). Continuous Integration [Presentation]. https://www.osti.gov/biblio/1863497

Ehrhart, B.D., Bran Anleu, G.A., Mohmand, J.A., Klebanoff, L.E., Baird, A.R., & Baird, A.R. (2021). Rail Refueling Analysis [Presentation]. https://www.osti.gov/biblio/1863498

Kalinina, E.A., Ammerman, D., Grey, C.A., Flores, G., Lujan, L., Saltzstein, S.J., Michel, D., & Michel, D. (2021). Summary: 30 cm Horizontal Drop of a Surrogate 17x17 PWR Fuel Assembly [Conference Presentation]. 10.2172/1863500

Lakkaraju, K., Whetzel, J.H., & Whetzel, J.H. (2021). Experiences in running a public distributed wargame [Conference Presentation]. 10.2172/1863501

Hahn, N.T., Zavadil, K.R., & Zavadil, K.R. (2021). Multivalent Electrolytes: Controlling Interfacial Resiliency Through Selective Cation Coordination [Conference Presentation]. 10.2172/1863502

Gross, M.S., Percival, S.J., Lee, R.Y., Peretti, A.S., Rodriguez, M.A., Spoerke, E.D., Small, L.J., & Small, L.J. (2021). High-Performance Low-Temperature Molten Sodium Batteries Enabled by Improved Charge Transfer Across Interfaces [Conference Poster]. 10.2172/1863516

Wang, C., Bartelt, N.C., Thurmer, K., & Thurmer, K. (2021). Nano-scale Insights Into Nascent Soot Formation [Presentation]. https://www.osti.gov/biblio/1863517

Ehrhart, B.D., Lafleur, A., Hecht, E.S., Glover, A.M., Baird, A.R., Mohmand, J.A., Sims, C., Blaylock, M.L., & Blaylock, M.L. (2021). Hydrogen Quantitative Risk Assessment [Presentation]. https://www.osti.gov/biblio/1863518

Sprague, M., Ananthan, S., Binyahib, R., Brazell, M., de Frahan, M.H., King, R.A., Mullowney, P., Rood, J., Sharma, A., Thomas, S.A., Vijayakumar, G., Crozier, P., Berger-Vergiat, L., Cheung, L., Dement, D.C., Develder, N., Glaze, D.J., Hu, J.J., Knaus, R.C., … Sitaraman, J. (2021). ExaWind: Exascale Predictive Wind Plant Flow Physics Modeling [Conference Poster]. 10.2172/1863503

Moreland, K.D. (2021). VTK-m Update 2021 [Presentation]. https://www.osti.gov/biblio/1863504

Gentile, A.C., Brandt, J.M., Cook, J., Hammond, S., Poliakoff, D., Schwaller, B., Surjadidjaja, V., Tucker, T.O., & Tucker, T.O. (2021). Enabling Application and System Data Fusion [Conference Presentation]. 10.2172/1863505

Oblapenko, G., Goldstein, D., Varghese, P., Moore, C.H., & Moore, C.H. (2021). Modeling of rarefied ionized flows with the QUIPS and velocity-space hybrid methods [Presentation]. https://www.osti.gov/biblio/1863506

Foulk, J.W., Miles, J., Nicolae, B., Teranishi, K., & Teranishi, K. (2021). Performance Portable Fault Tolerance with Kokkos-Resilience [Conference Presentation]. 10.2172/1863507

Davis, W.L. (2021). In-Situ Machine Learning for Intelligent Data Capture on Exascale Platforms [Presentation]. https://www.osti.gov/biblio/1863508

Hecht, E.S. (2021). R&D for Safety Codes and Standards: Hydrogen Behavior [Conference Presentation]. 10.2172/1863509

Shinde, S.D., Sarnaik, A., Nguyen, M., Jansen, A., Smith, D., Sarwar, M., George, A., Varman, A., Davis, R.W., & Davis, R.W. (2021). Engineered production of lactate and acetate short-chain esters in Escherichia coli [Conference Presentation]. 10.2172/1863510

Yamazaki, I. (2021). Solvers and Kernels for Exascale (SAKE) project: Exascle Trilinos Solvers project [Conference Presentation]. 10.2172/1863511

Osborn, D., Williams, A.D., Wyss, G.D., Caskey, S., Clark, A.J., & Clark, A.J. (2021). Risk-Informed Approaches for Physical Security [Conference Paper]. https://www.osti.gov/biblio/1863519

Trageser, J., Jones, R.E., Rimsza, J., Hogancamp, J., & Hogancamp, J. (2021). Modeling of concrete degradation with peridynamics [Conference Presentation]. 10.2172/1863520

Swiler, L.P. (2021). Statistical Methods used in the Born Qualified LDRD Project [Presentation]. https://www.osti.gov/biblio/1863692

Vogel, D.J. (2021). Competitive Adsorption and Reactive Chemical Species Identification in RE-DOBDC MOFs via AIMD [Conference Presentation]. 10.2172/1863693

Vogel, D.J. (2021). Ab initio Molecular Dynamics of Isotope Separation in Porous Organic Cages [Conference Presentation]. 10.2172/1863694

Reinhardt, J.C. (2021). Cyber Risk Framework: Overview [Presentation]. https://www.osti.gov/biblio/1863695

Younge, A.J., Agelastos, A.M., Lawson, G., Foulk, J.W., & Foulk, J.W. (2021). Containers at Sandia [Conference Presentation]. 10.2172/1863696

Rodriguez, L.G., Mueller, J.A., Gill, L., Neely, J.C., & Neely, J.C. (2021). A High-Voltage Cascaded Solid-State DC Circuit Breaker Using Normally-ON SiC JFETs [Conference Paper]. 10.1109/ECCE-Asia49820.2021.9479388

Cohn, B., Sandt, E., Prescott, S., Christian, R., Osborn, D., & Osborn, D. (2021). Integration of Nuclear Power Plant Safety and Security Codes Through EMRALD [Conference Paper]. https://www.osti.gov/biblio/1863699

Loe, J.A., Boman, E.G., & Boman, E.G. (2021). Polynomial Preconditioning in Trilinos [Conference Presentation]. 10.2172/1863700

Younge, A.J. (2021). Supercontainers and E4S [Conference Presentation]. 10.2172/1863701

Rajamanickam, S., Berger-Vergiat, L., Boman, E.G., Yamazaki, I., & Yamazaki, I. (2021). Sake: Solvers and Kernels for Exascale [Conference Presentation]. https://doi.org/10.2172/1863702

Berger-Vergiat, L., Rajamanickam, S., Dang, V.Q., Ellingwood, N.D., Kelley, B.M., Harvey, E.C., Wilke, J., Acer, S., & Acer, S. (2021). Kokkos Kernels: FY20 update [Conference Presentation]. https://doi.org/10.2172/1863703

Schoenwald, D.A. (2021). Improving the Accuracy of Modeling/Simulation Solvers to Better Understand the Impact of Inverter-Based Resources and other Fast Dynamics on Power Grids [Conference Presentation]. 10.2172/1863711

Moreno, M. (2021). MONTE CARLO PERTURBATION ANALYSIS OF FUEL TEMPERATURE VARIATIONS IN THE MCNP MODEL OF THE ANNULAR CORE RESEARCH REACTOR. https://www.osti.gov/biblio/1778633

Granzow, B.N., Bond, S.D., Martin, M.R., Hamlin, N.D., Stagg, A.K., Voth, T.E., & Voth, T.E. (2021). FLEXO: Development of a Portably Performant AMR Code for XHMD [Conference Presentation]. 10.2172/1863704

Harris, J.M. (2021). 1997 Fatality at Oak Ridge [Presentation]. https://www.osti.gov/biblio/1863705

Robertson, E.D. (2021). Measurement Techniques for Extreme Impedance RF Nano-Electronic Devices. https://www.osti.gov/biblio/1778631

Robertson, E.D. (2021). Measurement Techniques for Extreme Impedance RF Nano-Electronic Devices. https://www.osti.gov/biblio/1778632

Clemmer, J.T., Bolintineanu, D.S., Lechman, J.B., & Lechman, J.B. (2021). Applications of large-scale discrete element models in deformation and fracture of brittle solid and particulate systems [Conference Presentation]. 10.2172/1863706

Blondal, K., Sargsyan, K., Bross, D., Ruscic, B., Goldsmith, C.F., & Goldsmith, C.F. (2021). Including anharmonicity in adsorbate partition functions: Effect on equilibrium constant estimates in heterogeneous catalysis [Conference Presentation]. 10.2172/1863707

Witman, M.D. (2021). Accelerating data-driven discovery of materials for hydrogen storage and generation [Presentation]. https://www.osti.gov/biblio/1863708

Rider, W.J. (2021). Sandia ATDM: Performance and Portability Accomplishments [Conference Presentation]. 10.2172/1863709

Raybourn, E.M., Moulton, J.D., Rogers, D.M., Sims, B., Willenbring, J.M., Gonsiorowski, E., Milewicz, R.M., Watson, G., & Watson, G. (2021). ECP Virtual Organization: A Team of Teams? [Presentation]. https://www.osti.gov/biblio/1863712

Bhujel, N., Tamrakar, U., Hansen, T.M., Tonkoski, R., Byrne, R.H., & Byrne, R.H. (2021). Optimization-Based Estimation of Microgrid Equivalent Parameters for Voltage and Frequency Dynamics [Conference Proceeding]. 10.1109/PowerTech46648.2021.9494858

Kagay, B., Ronevich, J., san Marchi, C., & san Marchi, C. (2021). EFFECT OF INTERNAL HYDROGEN ON FATIGUE CRACK INITIATION SITES IN 316L AUSTENITIC STAINLESS STEEL [Conference Paper]. 10.1115/PVP2021-62944

Younge, A.J. (2021). Container Support at DOE Compute Facilities 2021 [Presentation]. https://www.osti.gov/biblio/1863715