Publications

Laird, C. (2021). Accelerating Impact on Global Challenges with High-Performance Optimization [Presentation]. https://www.osti.gov/biblio/1882114

Crockatt, M.M., Shadid, J.N., Conde, S., Pawlowski, R., & Mabuza, S. (2021). Development of an Algorithmic Framework for the Simulation of Partially-Ionized Multifluid Plasma Systems with Arbitrarily Many Species [Conference Presentation]. 10.2172/1884180

Plimpton, S.J. (2021). What's New in LAMMPS [Conference Presentation]. 10.2172/1888402

Maniaci, D.C., Naughton, J., Geraci, G., & King, R. (2021). Verification, Validation & Uncertainty Quantification [Presentation]. https://www.osti.gov/biblio/1883505

Ebeida, M., Laforce, T.C., Bishop, J.E., & McLendon, W. (2021). Recent Advances in the VoroCrust Algorithm for Automatic Generation of Conforming Voronoi Meshes [Conference Presentation]. 10.2172/1882078

Nichol, J., Peterson, M.G., & Peterson, K.J. (2021). Learning Why: Data-Driven Causal Evaluations of Climate Models [Conference Poster]. https://doi.org/10.2172/1884401

Trumbo, D., & Milewicz, R.M. (2021). Towards a Culture of Continuous Learning and Improvement within RSE Teams [Conference Poster]. 10.2172/1889366

Smith, C., Kouri, D.P., & Walsh, T. (2021). Risk Averse Optimal Experiment Design using R-Optimality for Vibration Control Inverse Problems [Conference Presentation]. 10.2172/1889064

McQuarrie, S.A., & van Bloemen Waanders, B. (2021). Goal-oriented data-driven reduced-order modeling guided by hyper-differential sensitivity analysis [Presentation]. https://www.osti.gov/biblio/1884436

Pearson, C., Wu, K., Chung, I., Xiong, J., & Hwu, W. (2021). TEMPI: An Interposed MPI Library with Canonical Representation of MPI Datatypes [Slides] [Conference Presentation]. 10.2172/1872311

Crockatt, M.M., & Shadid, J.N. (2021). Development, Implementation, and Verification of Partially-Ionized Collisional Multifluid Plasma Models in Drekar. 10.2172/1817837

Wofford, Q., Bridges, P.G., & Widener, P. (2021). A Layered Approach for Modular Container Construction and Orchestration in HPC Environments [Conference Paper]. ScienceCloud 2021 - Proceedings of the 11th Workshop on Scientific Cloud Computing. 10.1145/3452370.3466001

Gilletly, S.D., Jackson, N.D., & Staid, A. (2021). Quantifying Wildfire-Induced Impacts to Photovoltaic Energy Production in the western USA [Conference Paper]. Conference Record of the IEEE Photovoltaic Specialists Conference. 10.1109/PVSC43889.2021.9518514

Rodgers, T.M., Mitchell, J.A., Olson, A., Bolintineanu, D.S., Vackel, A., & Moore, N.W. (2021). Fast three-dimensional rules-based simulation of thermal-sprayed microstructures. Computational Materials Science, 194. https://doi.org/10.1016/j.commatsci.2021.110437

Bettencourt, M.T. (2021). Higher-order particle representation for particle-in-cell simulations. Journal of Computational Physics, 435. 10.1016/j.jcp.2021.110255

Radue, M.S., Baek, S., Farzaneh, A., Dwyer, K.J., Campbell, Q., Baczewski, A.D., Bussmann, E., Wang, G.T., Mo, Y., Misra, S., & Butera, R.E. (2021). AlCl3-Dosed Si(100)-2 × 1: Adsorbates, Chlorinated Al Chains, and Incorporated Al. Journal of Physical Chemistry C, 125(21), pp. 11336-11347. 10.1021/acs.jpcc.1c00691

Tranchida, J. (2021). LAMMPS, a brief overview and examples of modifications [Presentation]. https://www.osti.gov/biblio/1884410

Moore, S.G., Plimpton, S.J., & Gallis, M.A. (2021). Recent Improvements to the SPARTA DSMC Code [Conference Presentation]. 10.2172/1873259

Plimpton, S.J. (2021). MDI with LAMMPS [Conference Presentation]. 10.2172/1873062

Hartland, T., Stadler, G., Perego, M., Liegeois, K.A.J., & Petra, N. (2021). Hierarchical off-diagonal Hessian approximation for Bayesian inverse problems with application to the flow of the Greenland ice sheet [Conference Presentation]. 10.2172/1873285

Murdock, J.M., & Carroll, E.R. (2021). Simplifying and Visualizing the Ontology of Systems Engineering Models. 10.2172/1814061

Miller, N., Cook, J., & Hughes, C. (2021). Evaluation of oneAPI for FPGAs [Conference Presentation]. https://doi.org/10.2172/1874558

Magann, A.B., Grace, M.D., Rabitz, H.A., & Sarovar, M. (2021). Digital quantum simulation of molecular dynamics and control [Conference Poster]. Physical Review Research. https://www.scopus.com/inward/record.uri?partnerID=HzOxMe3b&scp=85115906740&origin=inward

Pearson, C., Wu, K., Chung, I., Xiong, J., & Hwu, W. (2021). TEMPI: An Interposed MPI Library with Canonical Representation of MPI Datatypes [Poster] [Conference Poster]. 10.2172/1873267

Perego, M. (2021). Advances in Modeling the Thermo-Mechanical state of Ice Sheets [Conference Presentation]. 10.2172/1873266