Publications

Cooper, M.A., Erikson, W.W., Oliver, M.S., & Oliver, M.S. (2021). Electrical conductivity of porous binary powder mixtures. Mechanics of Materials, 162. 10.1016/j.mechmat.2021.104026

Melton, C.A. (2021). Spin-Orbit Coupling in Quantum Monte Carlo [Presentation]. https://www.osti.gov/biblio/1899504

Kaplar, R., Allerman, A., Crawford, M.H., Gunning, B.P., Flicker, J.D., Armstrong, A., Yates, L., Dickerson, J., Binder, A., Abate, V.M., Smith, M.L., Pickrell, G.W., Sharps, P., Neely, J.C., Rashkin, L.J., Gill, L., Goodrick, K., Anderson, T., Gallagher, J., … Cooper, J.A. (2021). Recent Progress in Vertical Gallium Nitride Power Devices [Conference Presentation]. 10.2172/1900106

Heroux, M.A. (2021). HPC Software Platform Trends:The Evolution of Trilinos from 2001 to 2026 [Presentation]. https://www.osti.gov/biblio/1900327

Harris, C.T. (2021). Nanoscience Research at the Center for Integrated Nanotechnologies [Presentation]. https://www.osti.gov/biblio/1898489

Klingbeil, A. (2021). Ducted Fuel Injection and Cooled Spray Technologies for Particulate Control in Heavy-Duty Diesel Engines. 10.2172/1829263

Brost, R. (2021). HelioCon Roadmapping Workshop -- Advanced Manufacturing Breakout Session Recap [Presentation]. https://www.osti.gov/biblio/1899281

Bennett, N.L., Welch, D., Laity, G.R., Cuneo, M.E., & Cuneo, M.E. (2021). First principles model of electrode plasma formation in MA-scale accelerators [Conference Presentation]. https://doi.org/10.2172/1897372

Najm, H.N. (2021). Machine Learning in Computational Science [Conference Presentation]. 10.2172/1899485

Brown, A.L., Clemenson, M., Homan, T., Banko, A., Benson, M.J., Elkins, C.J., & Elkins, C.J. (2021). Computational Comparisons to the Multi-stack MRC/MRV Dispersion Dataset [Conference Presentation]. 10.2172/1896573

Tidwell, V.C. (2021). Energy-Water Nexus [Conference Presentation]. 10.2172/1899260

Smith, J.D., Galvan, E., & Galvan, E. (2021). CSRI Summer Proceedings 2021. 10.2172/1855061

Rothganger, F. (2021). N2A: a language and software tool for large-scale modeling [Conference Poster]. 10.2172/1899507

Hess, M.H., Evstatiev, E.G., & Evstatiev, E.G. (2021). Electron Dynamics within a MITL Containing a Load. IEEE Transactions on Plasma Science, 49(11), pp. 3398-3409. 10.1109/tps.2021.3116486

Plimpton, S.J. (2021). MDI for code coupling, fftMPI, future plans [Presentation]. https://www.osti.gov/biblio/1895551

Tidwell, V.C., Gunda, T., Hightower, M., Xu, P., Xu, X., Bernknopf, R., Broadbent, C., Malczynski, L.A., Jacobson, J., & Jacobson, J. (2021). Economic, Social. and Environmental Cost/Benefit Modeling of Fit-for-Purpose Treatment and Reuse of Produced Water [Conference Presentation]. 10.2172/2002973

Allendorf, M., Stavila, V., Duncan, C., Snider, J.L., Reynolds, J.E., el Gabaly, F., Sugar, J.D., Dizdar, C.B., Majzoub, E.H., Schlomberg, H., Lotsch, B.V., Urban, J.J., Wood, B.C., & Wood, B.C. (2021). Reversible Hydrogen Storage by Metastable Hydrides in Functionalized Porous Hosts [Conference Presentation]. 10.2172/1899682

Romero, A. (2021). SCRM Alerts [Conference Presentation]. 10.2172/1897596

Bar-Nes, G., Klein-Bendavid, O., Kosson, D., Gruber, C., Taylor, A., Brown, K., Delapp, R., Brown, L., Ayers, J., Meeusen, H., Matteo, E.N., Jove-Colon, C.F., Mitchell, C.A.M., Pyrak-Nolte, L., & Pyrak-Nolte, L. (2021). NUCLEAR WASTEFORM AND BARRIER MATRIX INTERACTIONS WITH GEOLOGIC STRATA IN THE SUBSURFACE OF THE YAMIN PLATEAU, NORTHERN NEGEV, ISRAEL [Presentation]. https://www.osti.gov/biblio/1899495

Powell, T.C., Cartwright, K., Grabowski, T.C., & Grabowski, T.C. (2021). Bremsstrahlung Diode Dose Optimization [Presentation]. https://www.osti.gov/biblio/1899855

Beeny, B.A. (2021). MELCOR HTGR Modeling/Development: Radionuclide Transport - Theory [Presentation]. https://www.osti.gov/biblio/1899663

Renk, T.J., Weber, B., & Weber, B. (2021). Use of a Dose-Rate Monitor Array to infer Intense Electron Beam Angle Change on the HERMES-III Accelerator at Sandia National Laboratories [Conference Presentation]. 10.2172/1897886

Harvey, E.C. (2021). A Common Tool for Building Trilinos: Introduction to GenConfig [Presentation]. https://www.osti.gov/biblio/1900099

Townsend, J.P. (2021). QMCPACK for Solids [Conference Presentation]. 10.2172/1899258

Small, L.J., Lee, R., Percival, S.J., Gross, M.S., Peretti, A.S., Foulk, J.W., Spoerke, E.D., & Spoerke, E.D. (2021). Understanding Electrochemical Processes in Molten Salt Catholytes for Low Temperature Molten Sodium Batteries [Conference Presentation]. 10.2172/1900348

Noble, D.R. (2021). Introduction to Krino [Conference Presentation]. 10.2172/1899670

Rajamanickam, S. (2021). Can Scientific Software Development Use the Outsourcing Model Successfully [Conference Paper]. https://www.osti.gov/biblio/1899526

Busch, S. (2021). Diesel-like Fuels, Combustion, and Emissions. 10.2172/1832084

Evans, A.S. (2021). U.S. Domestic Microreactor Security-by-Design. 10.2172/1832310

Woo, K.M., Betti, R., Thomas, C., Stoeckl, C., Zirps, B., Churnetski, K., Forrest, C., Regan, S., Collins, T., Theobald, W., Shah, R., Mannion, O.M., Patel, D., Cao, D., Knauer, J., Goncharov, V., Bahukutumbi, R., Rinderknecht, H., Epstein, R., … Marshall, F. (2021). Three-dimensional Hot-spot Reconstruction in Inertial Fusion Implosions [Conference Presentation]. 10.2172/1899276

Stein, E., Laforce, T.C., & Laforce, T.C. (2021). DECOVALEX-2023 Task F (Performance Assessment) Synthesis, Fall Meeting 2021 [Presentation]. https://www.osti.gov/biblio/1899513

Roberts, S.A., Donohoe, B.D., Martinez, C., Krygier, M., Hernandez-Sanchez, B.A., Foster, C.W., Collins, L.N., Greene, B., Noble, D.R., Norris, C., Potter, K.M., Roberts, C., Neal, K.D., Bernard, S.R., Schroeder, B.B., Trembacki, B., Labonte, T., Sharma, K., Ganter, T., … Smith, M.D. (2021). Credible, Automated Meshing of Images (CAMI) [Presentation]. https://www.osti.gov/biblio/1900115

Banerjee, S., Piryatinski, A., Kwan, T., Zhang, P., Huang, C., & Huang, C. (2021). Transverse properties of the electron beam emitted from a diamond nanotip [Conference Poster]. 10.2172/1897148

Laird, C., Jalving, J.H., Blakely, L., Eydenberg, M.S., Boukouvala, F., Kilwein, Z., & Kilwein, Z. (2021). Integration of Optimization and Machine Learning for Improving Electrical Grid Operation [Conference Presentation]. 10.2172/1896366

Forrest, C., Cao, D., Goncharov, V., Gopalaswamy, V., Knauer, J., Mannion, O.M., Mohamed, Z., Regan, S., Shah, R., Stoeckl, C., Woo, K.M., & Woo, K.M. (2021). Inference of Isotropic and Anisotropic Flow in Laser Direct-Drive Cryogenic DT Implosions on OMEGA [Conference Presentation]. 10.2172/1896579

Ruiz, D.E., Yager-Elorriaga, D.A., Gomez, M.R., Slutz, S.A., Weis, M.R., Harvey-Thompson, A.J., Jennings, C.A., Harding, E.C., Foulk, J.W., Shipley, G.A., Ampleford, D.J., Beckwith, K., & Beckwith, K. (2021). Studying scaling physics of the MagLIF platform on the Z accelerator facility [Conference Poster]. 10.2172/1899522

Myers, C. (2021). Experimental demonstration of the lossless coupling of 20 MA of current through scaled transmission lines stressed at >50 MA conditions [Conference Presentation]. 10.2172/1899440

Rajamanickam, S. (2021). Portability in Trilinos [Presentation]. https://www.osti.gov/biblio/1895552

Lafleur, A., Putorti, A.D., Taylor, G., & Taylor, G. (2021). Report on High Energy Arcing Fault Experiments. 10.2172/1854750

Regan, S., Mannion, O.M., Forrest, C., McClow, H., Mohamed, Z., Kalb, A., Kwiatkowski, J., Knauer, J., Stoeckl, C., Shah, R., Theobald, W., Churnetski, K., Betti, R., Gopalaswamy, V., Rinderknecht, H., Igumenshchev, I., Radha, B., Goncharov, V., Edgell, D., … Colaitis, A. (2021). Systematic Trends of Hot-Spot Flow Velocity in Laser-Direct-Drive Implosions on OMEGA [Conference Presentation]. 10.2172/1896865

Durbin, S., Phillips, J., Casella, A., Lanza, M., & Lanza, M. (2021). Modeling of Aerosol Depletion in Spent Nuclear Fuel Dry Storage [Presentation]. https://www.osti.gov/biblio/1897152

Schorr, N.B., Kolesnichenko, I.V., Merrill, L.C., Wygant, B.R., Harrison, K.L., Lambert, T.N., & Lambert, T.N. (2021). High Capacity Retention in Lithium Batteries Utilizing Nano Iron Sulfide Particles [Conference Presentation]. 10.2172/1900097

Morgans-Harrer, K. (2021). ASMT-783246, Assessment Report for Department 635 Analysis of Fiscal Year 2021 ES&H Events. 10.2172/1832976

Foulk, J.W., Tranchida, J., & Tranchida, J. (2021). Multi-fidelity Gaussian process and Bayesian optimization for materials design: Application to ternary random alloys [Conference Presentation]. 10.2172/1898471

McLain, M. (2021). Radiation Effects in Electronics: From Basic Physics to Experimental and Simulation Capabilities [Presentation]. https://www.osti.gov/biblio/1900110

Landin, K.T. (2021). Toward a Science of Abstraction Design in Software [Conference Paper]. https://www.osti.gov/biblio/1899470

Chance, F.S. (2021). Lessons from dragonflies for neuromorphic computing [Presentation]. https://www.osti.gov/biblio/1898473

Mounho, M., Young, J., Mankowski, J., Neuber, A., Stephens, J., Hopkins, M.M., & Hopkins, M.M. (2021). Characterization of a low-jitter Marx generator triggering system for time-resolved diagnostics application [Conference Poster]. 10.2172/1899690

Galloway, B.R., Slutz, S.A., Kimmel, M., Rambo, P.K., Schwarz, J., Geissel, M., Harvey-Thompson, A.J., Weis, M.R., Jennings, C.A., Field, E., Kletecka, D., Looker, Q.M., Colombo, A., Edens, A., Smith, I.C., Shores, J., Speas, C.S., Speas, R.J., Spann, A.P., … Porter, J.L. (2021). Lasergate: A windowless gas target for enhanced laser preheat in magnetized liner inertial fusion. Physics of Plasmas, 28(11). https://doi.org/10.1063/5.0059334

Ekoto, I.W. (2021). An Overview of Sandia National Laboratories Alternative Ignition Research [Conference Presentation]. 10.2172/1899497

Rushdi, A. (2021). Multifidelity data fusion in convolutional encoder/decoder assembly networks for computational fluid dynamics [Conference Paper]. https://www.osti.gov/biblio/1897598

Leone, R.C. (2021). Crystalline Task F: Modelling Approach to Full Crystalline Repository [Presentation]. https://www.osti.gov/biblio/1899503

Shand, L. (2021). Integrative data-driven approaches for characterization & prediction of aerosol-cloud processes [Conference Presentation]. 10.2172/1899681

Mangan, M.A., Fittinghoff, D., Harvey-Thompson, A.J., Seguin, F.H., Frenje, J., Whitlow, G.M., Lake, P., Ampleford, D.J., & Ampleford, D.J. (2021). One-dimensional, axially resolved and time-integrated neutron images from MagLIF experiments at Sandia?s Z Pulsed Power Facility [Conference Poster]. 10.2172/1899455

Yale, C.G., Lobser, D., Landahl, A.J., Clark, S.M., & Clark, S.M. (2021). Low-level Access and Collaborations: Case Studies from the Quantum Scientific Computing Open User Testbed (QSCOUT) [Conference Paper]. https://www.osti.gov/biblio/1899246

Lofstead, G.F., Glickman, M.R., & Glickman, M.R. (2021). The Opportunity and Challenge of Serverless Computing and Large Scale Computational Science [Conference Paper]. https://www.osti.gov/biblio/1899683

Hattar, K. (2021). TailoringHelium InducedBlistering in Tritide Materials [Conference Presentation]. 10.2172/1899487

Glover, A.M., Lafleur, A., & Lafleur, A. (2021). BayoTech Risk and Modeling Support. 10.2172/1832974

Loe, J.A., Rajamanickam, S., & Rajamanickam, S. (2021). Mixed Precision in Trilinos [Conference Presentation]. 10.2172/1900352

Rogers, T. (2021). 3D Printing Center of Excellence (Dept. 2479) [Presentation]. https://www.osti.gov/biblio/1899452

Johnson, E.S. (2021). Solution Techniques for Large-Scale Optimization Problems on the Transmission Grid [Presentation]. https://www.osti.gov/biblio/1899687

Brownell, M., Frischknecht, A.L., Wilson, M.A., & Wilson, M.A. (2021). Atomistic Modeling of Elastomer Performance During Exposure to High-Pressure Hydrogen [Conference Presentation]. 10.2172/2002980

Powell, T.C., Cartwright, K., Grabowski, T.C., & Grabowski, T.C. (2021). BREMSSTRAHLUNG DIODE DOSE IMPROVEMENTS USING SHAPED ANODE AND CATHODE GEOMETRIES [Conference Poster]. 10.2172/2002956

Foulk, J.W., Knapp, P.F., Harding, E.C., Beckwith, K., & Beckwith, K. (2021). Convolutional Neural Networks for MagLIF Stagnation Image Applications [Conference Poster]. 10.2172/1896363

Mounce, A.M., Kaehr, B.J., Titze, M., Bielejec, E.S., Byeon, H., & Byeon, H. (2021). Single Photon Emitters Coupled to Photonic Wire bonds. 10.2172/1828645

Kirsch, J., Hubbard, J.A., & Hubbard, J.A. (2021). Complementary Study of Radiative Heat Transfer and Flow Physics from Moderate-scale Hydrocarbon Pool Fire Simulations. 10.2172/1832312

Leute, J.E. (2021). MACCS Initiatives for Advanced Reactor Consequence Analyses [Conference Presentation]. 10.2172/1897366

Grabowski, T.C., Powell, T.C., Mitra, S.S., Cartwright, K., Biller, A., Pointon, T., Renk, T.J., & Renk, T.J. (2021). Characterization of an Improved MITL Extension for the HERMES III Accelerator [Conference Poster]. 10.2172/2002962

Clark, S.M., Ivory, M.K., Yale, C.G., & Yale, C.G. (2021). Maximizing the beneficial effects of testbeds: case studies from QSCOUT [Conference Paper]. https://www.osti.gov/biblio/1899665

Bai, X., Kustas, A.B., Mann, J.B., Chandrasekar, S., Trumble, K.P., & Trumble, K.P. (2021). Shear-based deformation processing of age-hardened aluminum alloy for single-step sheet production. Journal of Manufacturing Science and Engineering, 144(6). 10.1115/1.4052441

Bartelt, N.C., Thurmer, K., & Thurmer, K. (2021). Structure and energetics of the elbows in the Au(111) herringbone reconstruction. Physical Review B, 104(16). 10.1103/physrevb.104.165425

Duwal, S., Root, S., Farfan, B.G., Reinhart, W.D., Alexander, C.S., & Alexander, C.S. (2021). Dynamic compression of TiO2to 221 GPa. Journal of Applied Physics, 130(16). 10.1063/5.0069501

Ivanov, V.Y., Xu, D., Dwelle, M.C., Sargsyan, K., & Sargsyan, K. (2021). Breaking Down the Computational Barriers to Real-Time Urban Flood Forecasting. Geophysical Research Letters, 48(20). 10.1029/2021gl093585

Johnson, N., Paquette, J.A., Bortolotti, P., Bolinger, M., Camarena, E., Anderson, E.M., Ennis, B.L., & Ennis, B.L. (2021). Big Adaptive Rotor Phase I Final Report. 10.2172/1828112

Zwier, T.S., Harrilal, C.P., Deblase, A.F., McLuckey, S.A., & McLuckey, S.A. (2021). Two-Color IRMPD Applied to Conformationally Complex Ions: Probing Cold Ion Structure and Hot Ion Unfolding. Journal of Physical Chemistry A, 125(42), pp. 9394-9404. 10.1021/acs.jpca.1c08388

Hanson, K., Sankar, K.M., Weck, P.F., Startt, J.K., Dingreville, R., Deo, ., Sugar, J.D., Singh, ., & Singh, . (2021). Effect of excess Mg to control corrosion in molten MgCl₂ and KCl eutectic salt mixture. Corrosion Science, 194. 10.1016/j.corsci.2021.109914

Li, B., Wang, S., Nami, M., Armstrong, A., Han, J., & Han, J. (2021). Etched-And-Regrown GaN P–N Diodes with Low-Defect Interfaces Prepared by In Situ TBCl Etching. ACS Applied Materials and Interfaces, 13(44). 10.1021/acsami.1c16221

Porritt, R.W., Conley, A.C., & Conley, A.C. (2021). Challenges and Potential of Waveform Modeling for Crustal Scale Predictions. 10.2172/1827491

Allardice, A., Bowman, B., Rollins, A., Walton, E., & Walton, E. (2021). LANL MLU Truck Shipment Surveys Document. 10.2172/1828643

Horner, J.S., Whang, G., Ashby, D.S., Kolesnichenko, I.V., Lambert, T.N., Dunn, B.S., Talin, A.A., Roberts, S.A., & Roberts, S.A. (2021). Electrochemical Modeling of GITT Measurements for Improved Solid-State Diffusion Coefficient Evaluation. ACS Applied Energy Materials, 4(10), pp. 11460-11469. https://doi.org/10.1021/acsaem.1c02218

Henry, M.D., Davids, P., Esteves, G., Young, T., Wolfley, S., Smith, S.W., Fields, S., Ihlefeld, J.F., & Ihlefeld, J.F. (2021). Stabilization of ferroelectric phase of Hf_0.6Zr_0.4O₂ on NbN and Nb [slides] [Conference Presentation]. 10.2172/1892451

Parker, T., Silva-Quis, D., Wang, G.T., Teplyakov, A.V., & Teplyakov, A.V. (2021). Chemistry of Titanium Deposition Precursors for Area-Selective Deposition of Functionalized Silicon [Posters] [Conference Poster]. 10.2172/1893287

Furtney, J., Varun, V., Radakovic-Guzina, Z., Damjanac, B., Hardin, E., & Hardin, E. (2021). Fuel/Basket Degradation Modeling Summary. 10.2172/1832089

Clark, A.J., Fink, M.S., & Fink, M.S. (2021). Development of Integrated Safety and Security Models for Comprehensive Reliability and Resiliency Evaluation. 10.2172/1827066

Park, J.E., Bare, Z.J.L., Morelock, R.J., Rodriguez, M.A., Ambrosini, A., Musgrave, C.B., McDaniel, A.H., Coker, E.N., & Coker, E.N. (2021). Computationally Accelerated Discovery and Experimental Demonstration of Gd0.5La0.5Co0.5Fe0.5O3 for Solar Thermochemical Hydrogen Production. Frontiers in Energy Research, 9. https://doi.org/10.3389/fenrg.2021.750600

Foulk, J.W., Eldred, M., McCann, S., Wang, Y., & Wang, Y. (2021). srMO-BO-3GP: A sequential regularized multi-objective Bayesian optimization for constrained design applications using an uncertain Pareto classifier. Journal of Mechanical Design, 144(3). 10.1115/1.4052445

Lu, P. (2021). Tailorable multifunctionalities in ultrathin 2D Bi-based layered supercell structures. Nanoscale, 13(39), pp. 16672-16679. 10.1039/d1nr04975e

Allardice, A., Hanson, C.B., Bowman, B., & Bowman, B. (2021). Outgoing Vehicle Process Knowledge Document. 10.2172/1826863

Allardice, A., Walton, E., Bowman, B., Kegeler, S., Martinez, D., Molina, V., Rollins, A., Tafoya, D., & Tafoya, D. (2021). LANL MLU TRUPACT Loading Survey Document. 10.2172/1828239

Moorman, M.W., Miller, P., Whiting, J., Sammon, J.P., Pfeifer, K.B., Carlson, L., Brusseau, C., & Brusseau, C. (2021). Next Generation Chemical Agent Detection Architecture [Poster] [Conference Poster]. 10.2172/1892443

Gilbert, S.M. (2021). When should we care about new technology in the nuclear domain? Assessing emerging technologies impacts on stability. 10.2172/1826457

Kaplar, R., Anderson, T., Chowdhury, S., Akta, O., & Akta, O. (2021). Targeting Medium-Voltage Power Electronics with Vertical GaN Devices. Compound Semiconductor, 27(VII). https://www.osti.gov/biblio/1834147

Savage, M.E., Austin, K.N., Grabowski, T.C., McLane, M., & McLane, M. (2021). Fielding and analyzing performance of a prototype high voltage output gas switch for Saturn. 10.2172/1826265

Karamati, S., Young, J., Conte, T., Hemmert, K.S., Grant, R., Hughes, C., Vuduc, R., & Vuduc, R. (2021). Computational Offload with BlueField Smart NICs. 10.2172/1832297

Valdivia, L., Elliott, N., & Elliott, N. (2021). Fade Study of the Thermo Model 8825 Whole Body Dosimeter, Algorithm (V.2). 10.2172/1826266

Allardice, A., Bowman, B., Walton, E., Rollins, A., Molina, V., & Molina, V. (2021). Preliminary and Incoming LANL MLU Surveys Document. 10.2172/1828107

Hill, A., Vineyard, C.M., & Vineyard, C.M. (2021). An introduction to neuromorphic computing and its potential impact for unattended ground sensors. 10.2172/1826263

Subedi, S., Guruwacharya, N., Tamrakar, U., Cicilio, P., Fourney, R., Rekabdarkolaee, H.M., Tonkoski, R., Hansen, T.M., & Hansen, T.M. (2021). Computationally Efficient Partitioned Modeling of Inverter Dynamics with Grid Support Functions [Slides] [Conference Presentation]. 10.2172/1890911

Prasadan, A. (2021). Sketching Algorithms in Distributed Systems. 10.2172/1826094

Kinnan, M., Burton, P.D., Greathouse, J.A., Priest, C., Leverant, C.J., Fisher, T., Rempe, S., Alam, T.M., McGarvey, D.J., Creasy, B., & Creasy, B. (2021). CB10412: Bulk CWA Destruction. 10.2172/1835015