Poster Sessions

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Poster Title Author(s) Project Title Wednesday 7/24 Thursday 7/25 to Friday 7/26
Enhancing Global Biogeochemical Cycles in the Community Earth System Model F. Hoffman ACES4BGC Poster 58, Regency Room Board 10, Plaza I
Hydration structure of salt solutions from ab initio molecular dynamics (2.45 MB) A. Bankura, V. Carnevale, M. Klein Advanced Modeling of Ions in Solutions, on Surfaces and in Biological Environments Poster 13, Plaza I Board 15, Plaza I
Ab initio studies of ionization potentials of hydrated hydroxide and hydronium (1.99 MB) C. Swartz VI, X. Wu Advanced Modeling of Ions in Solutions, on Surfaces and in Biological Environments Poster 14, Plaza I Board 15, Plaza I
Pole Expansion and Selected Inversion Method for Accelerating Electronic Structure Calculation (911 KB) M. Jacquelin, R. Car, W. E. M. Klein, X. Wu, E. Ng, C. Yang, L. Lin Advanced Modeling of Ions in Solutions, on Surfaces and in Biological Environments Poster 43, Regency Room Board 15, Plaza I
ALCF Poster M. Papka ALCF Poster 61, Regency Room Board 32, Plaza I
Hadronic Parity Violation and Lattice QCD (646 KB) CalLat Collaboration CalLAT Poster 30, Plaza I Board 29, Plaza I
Generating Lattice Gauge Configurations on Sequoia and Vulcan (BG/Q) with further calculations on Edge (GPU) (1.10 MB) CalLat Collaboration CalLAT Poster 67, Regency Room Board 29, Plaza I
Direct Diabatization and Fitting of Coupled Potential Energy Surfaces for the Reactive Quenching of the Excited 2Σ+ State of OH by Molecular Hydrogen (1.53 MB) O. Tishchenko, D. Truhlar, B. Fu, J. Bowman, A. Jasper, E. Kamarchik Charge Transfer and Charge Transport in Photoactivated Systems: Developing Electron-Correlated Methods for Excited State Structure and Dynamics in the NWChem Software Suite Poster 01, Plaza I Board 2, Plaza I
New and ongoing developments and applications in real-time and linear-response TDDFT in NWChem (1.72 MB) N. Govind Charge Transfer and Charge Transport in Photoactivated Systems: Developing Electron-Correlated Methods for Excited State Structure and Dynamics in the NWChem Software Suite Poster 02, Plaza I Board 2, Plaza I
Advanced Computational Tools for the Energy Frontier (8.04 MB) P. Spentzouris, J. Cary, W. Mori, C. Ng, E. Ng, B. Norris, E. Prudencio, J.-L. Vay ComPASS Poster 42, Regency Room Board 22, Plaza I
Advanced Computational Tools for the Intensity Frontier (5.90 MB) P. Spentzouris, J. Cary, W. Mori, C. Ng, E. Ng, B. Norris, E. Prudencio, J.-L. Vay ComPASS Poster 47, Regency Room Board 22, Plaza I
SciDAC Project: Computation-Driven Discovery for the Dark Universe (1.73 MB) S. Habib, K. Heitmann, A. Slosar, S. Dodelson, P. Nugent, J. Ahrens, R. Wechsler  Computation-Driven Discovery for the Dark Universe Poster 31, Plaza I Board 36, Plaza I
Simulating the Lyman-α Forest with Nyx (14.49 MB) Z. Lukić, C. Stark, P. Nugent, M. White, A. Almgren Computation-Driven Discovery for the Dark Universe Poster 33, Plaza I Board 36, Plaza I
Multigrid with HYPRE for Lattice QCD (458 KB) A. Pochinsky Computing Properties of Hadrons, Nuclei and Nuclear Matter from Quantum Chromodynamics Poster 07, Plaza I Board 7, Plaza I
Porting Lattice QCD Calculations to Novel Architectures (649 KB) B. Joo, F. Winter Computing Properties of Hadrons, Nuclei and Nuclear Matter from Quantum Chromodynamics Poster 18, Plaza I Board 7, Plaza I
Computational techniques for accelerating quantum molecular dynamics simulations of the solid-electrolyte interface in Li-ion batteries (1.58 MB) C. Yang, L. Lin, M. Jacquelin, J. Pask, V. Lordi, M. Ong, E. Draeger Discontinuous methods for massively parallel QMD: Li-ion interface dynamics from first principles Poster 49, Regency Room Board 5, Plaza I
Discontinuous methods for accurate, massively parallel quantum molecular dynamics: Lithium ion interface dynamics from first principles (2.74 MB) M. Ong, V. Lordi, E. Draeger, J. Pask, C. Yang, L. Lin, M. Jacquelin Discontinuous methods for massively parallel QMD: Li-ion interface dynamics from first principles Poster 50, Regency Room Board 5, Plaza I
Extreme Scale Computing of Fusion Phyiscs in the Center for Edge Physics Simulation (6.03 MB) C. Chang, S. Ku, L. Sugiyama, S. Parker, M. Greenwald, G. Tynan, A. Kritz, D. Stotler EPSI Poster 19, Plaza I Board 26, Plaza I
Enabling Science and Technology in the Center for Edge Physics Simulation (3.02 MB) M. Shephard, M. Adams, E. D'Azevedo, J. Hesthaven, S. Klasky, R. Moser, M. Parashar, N. Podhorszki, P. Worley, C. Chang, S. Ku, EPSI Team EPSI Poster 21, Plaza I Board 26, Plaza I
Extreme Scale Fusion Physics and Enabling Technology in the Center for Edge Physics Simulation (6.73 MB) M. Adams, C. Chang, E. Azevedo, J. Hesthaven, S. Klasky, S. Ku, R. Moser, M. Parashar, N. Podhorszki, M. Shephard, L. Sugiyama, P. Worley EPSI Poster 26, Plaza I Board 26, Plaza I
Impact of FASTMath Structured Mesh Technologies (17.36 MB) M. Adams, S. Cornford, D. Martin, M. Dorr, J. Hittinger, P. McCorquodale, P. Colella, M. Adams, C. Kavouklis, B. Straalen, P. Nugent, Z. Lukić, M. White, C. Stark, A. Almgren, D. Trebotich, S. Molins, T. Ligocki, M. Adams, C. Shen, B. Straalen, L. Yang, J. Ajo-Franklin, C. Steefel FASTMath Poster 06, Plaza I Board 1, 4, 11, 20, 23, 33, Plaza I
Impact of FASTMath Solver Technologies on Scientific Applications (14.19 MB) A. Arsenlis, S. Aubry, G. Hommes, C. Woodward, D. Gardner, D. Reynolds, S. Price, M. Adams, D. Martin, E.G. Ng, S. Cornford, I. Kalashnikova, M. Perego, A. Salinger, R. Tuminaro, P. Worley, H.M. Aktulga, C. Yang, E.G. Ng, P. Maris, J.P. Vary FASTMath Poster 08, Plaza I Board 1, 4, 11, 20, 23, 33, Plaza I
FASTMath Iterative Solver Technologies (1.61 MB) B. Smith FASTMath Poster 15, Plaza I Board 1, 4, 11, 20, 23, 33, Plaza I
FASTMath Integrated Technologies M. Adams, G. Hansen FASTMath Poster 20, Plaza I Board 1, 4, 11, 20, 23, 33, Plaza I
FASTMath Direct Solver Technologies (990 KB) J. Demmel, S. Li, F. Rouet FASTMath Poster 45, Regency Room Board 1, 4, 11, 20, 23, 33, Plaza I
Applications of Unstructured Mesh Technologies (1.94 MB) K. Devine, K. Jansen, O. Sahni, A. Salinger, M. Shephard, T. Tautges FASTMath Poster 51, Regency Room Board 1, 4, 11, 20, 23, 33, Plaza I
FASTMath Structured Mesh Technologies (13.65 MB) P. Colella, M. Adams, A. Almgren, J. Bell, A. Dubey, D. Graves, T. Ligocki, M. Lijewski, B. Straalen FASTMath Poster 63, Regency Room Board 1, 4, 11, 20, 23, 33, Plaza I
Unstructured Meshing Techniques (10.56 MB) K. Devine, L. Diachin, K.E. Jansen, M. Shephard, T. Tautges FASTMath Poster 65, Regency Room Board 1, 4, 11, 20, 23, 33, Plaza I
A scale-aware dissipation mechanism for variable-resolution grids in CAM (12.88) O. Guba, M. Levy, J. Overfelt, M. Taylor, P. Ullrich Multiscale Methods for Accurate, Efficient, and Scale-Aware Models of the Earth System Poster 38, Regency Room Board 3, Plaza I
NERSC Poster D. Skinner, J. Deslippe NERSC Poster 32, Plaza I Board 32, Plaza I
Scientific Discovery in NUCLEI through Collaboration (4.60) H. Nam, H. M. Aktulga, G. Fann, G. Hagen, D. Higdon, Q. Liu, P. Maris, J. McDonnell, W. Nazarewicz, E. Ng, N. Schunck, J. P. Vary, S. Wild, C. Yang NUCLEI Poster 55, Regency Room Board 19, Plaza I
Charge form factor and sum rules of electromagnetic response functions in 12C (1.18 MB) A. Lovato, S. Gandolfi, R. Butler, J. Carlson, E. Lusk, S.C. Pieper, R. Schiavilla NUCLEI Poster 56, Regency Room Board 19, Plaza I
Iterative structured-mesh Ginzburg-Landau solver on GPUs (8.99 MB) D. Karpeev, I. Aronson, G. Crabtree, A. Glatz, A. Koshelev, T. Munson, S. Wild Optimizing Superconductor Transport Properties through Large-Scale Simulation Poster 04, Plaza I Board 31, Plaza I
Iterative unstructured-mesh Ginzburg-Landau solver on MPI clusters (5.80 MB) D. Karpeev, I. Aronson, G. Crabtree, A. Glatz, A. Koshelev, T. Munson, S. Wild Optimizing Superconductor Transport Properties through Large-Scale Simulation Poster 05, Plaza I Board 31, Plaza I
PISCEES - Quantification of Uncertainty in Sea-Level Rise from Next Generation Ice Sheet Models (8.09 MB) C. Jackson, S. Price, M. Eldred, P. Heimbach, J. Jakeman, I. Kalashnikova, M. Perego, A. Salinger, G. Stadler PISCEES Poster 41, Regency Room Board 17, Plaza I
Ice Sheet Model Dynamical Core Development for PISCEES (8.61 MB) I. Kalashnikova, D. Martin, S. Price, M. Adams, S. Cornford, M. Gunzburger, L. Ji, M. Perego, A. Salinger, R. Tuminaro, P. Worley PISCEES Poster 68, Regency Room Board 17, Plaza I
Plasma-Surface Interactions (PSI): Atomistic Insights into He Transport and Agglomeration in Plasma-Exposed Tungsten (3.97 MB) L. Hu, L. Sandoval Plasma Surface Interactions: Bridging from the Surface to the Micron Frontier Through Leadership Class Computing Poster 22, Plaza I Board 18, Plaza I
Plasma Surface Interactions (PSI): XOLOTL-PSI: Code Development, Testing and Uncertainty Quantification Approaches (934 KB) J. Billings, A. Belt, D. Bernholdt, A. McCaskey, T. Yamaguchi-Phillips Plasma Surface Interactions: Bridging from the Surface to the Micron Frontier Through Leadership Class Computing Poster 24, Plaza I Board 18, Plaza I
Predictive computing for condensed matter (678 KB) S. Hirata, L. Wagner, P. Abbamonte, D. Ceperley, G. Chan, B. Clark, S. Ryu, S. Zhang Predictive Computing for Condensed Matter Poster 52, Regency Room Board 27, Plaza I
Anomalous spin and lattice coupling in La2CuO4 calculated by first-principles quantum Monte Carlo (3.68 MB) L. Wagner, P. Abbamonte Predictive Computing for Condensed Matter Poster 54, Regency Room Board 27, Plaza I
Algorithms for Sparse and Missing Data (5.12MB) K. Chowdhary, J. Jakeman, M. Eldred, C. Safta, H. Najm QUEST Poster 25, Plaza I Board 8, 12, 16, Plaza I
Sandia Software Enabling Extreme-Scale Uncertainty Quantification (6.00 MB) M. Eldred, C. Safta, K. Sargsyan, B. Debusschere, J. Jakeman, K. Chowdhary, H. Najm QUEST Poster 37, Regency Room Board 8, 12, 16, Plaza I
Adaptive approximations of computationally intensive models for uncertainty propagation and inference (313 KB) P. Conrad, Y. Marzouk QUEST Poster 40, Regency Room Board 8, 12, 16, Plaza I
QUEST Interactions with the SciDAC projects: NUCLEI and Computation-Driven Discovery for the Dark Universe D. Higdon QUEST Poster 53, Regency Room Board 8, 12, 16, Plaza I
The Parallel Library QUESO for Uncertainty Quantification (8.39 MB) E. Prudencio, K. Estacio-Hiroms, K. Schulz QUEST Poster 60, Regency Room Board 8, 12, 16, Plaza I
Algorithms for a Nonlinear Hermitian Eigenproblem (1.45 MB) G. Schofield, J. Chelikowsky, Y. Saad Scalable Computational Tools for Discovery and Design--Excited State Phenomena in Energy Materials Poster 39, Regency Room Board 14, Plaza I
What's New in Berkeley GW Excited State Code (1.12 MB) J. Deslippe, C. Yang, J. Neaton, A. Canning, S. Louie, Y. Saad, A. Demkov, J. Chelikowsky Scalable Computational Tools for Discovery and Design--Excited State Phenomena in Energy Materials Poster 44, Regency Room Board 14, Plaza I
SDAV's Data-Intensive Management Techniques and Tools (2.64 MB) D. Boyuka, S. Byna, P. Carns, J. Dayal, G. Eisenhauer, Z. Gong, T. Jin, S. Kumar, S. Klasky, S. Lakshminarasimhan, R. Latham, Q. Liu, M. Parashar, V. Pascucci, N. Podhorszki, R. Ross, N. Samatova, K. Schwan, E. Schendel, A. Shoshani, Q. Sun, V. Vishwanath, M. Wolf, J. Wu, F. Zhang, X. Zhang SDAV Poster 11, Plaza I Board 24, 25, 28, 34, 35, Plaza I
SDAV's Software Infrastructure and Tools (962 KB) H. Childs, B. Geveci, S. Klasky SDAV Poster 16, Plaza I Board 24, 25, 28, 34, 35, Plaza I
Data Intensive Analysis Techniques and Tools (A) (4.36 MB) M. Patwary, A. Agrawal, W. Liao, A. Choudhary, S. Habib, R. Vatsavai, J. Xie, H. Yu, K.-L. Ma SDAV Poster 17, Plaza I Board 24, 25, 28, 34, 35, Plaza I
Exploring fusion science with SDAV's technologies (12.06 MB) J. Choi, J. Dayal, G. Eisenhauer, T. Jin, S. Klasky, Q. Liu, N. Podhorszki, M. Parashar, D. Pugmire, K-L. Ma, A. Sanderson, N. Samatova, K. Schwan, A. Shoshani, B. Whitlock, M. Wolf, J. Wu,F. Zhang, Y. Zhang, F. Zheng, X. Zhang, SDAV Team SDAV Poster 27, Plaza I Board 24, 25, 28, 34, 35, Plaza I
Exploring Combustion Science with SDAV's Technologies (2.10 MB) H. Abbasi, J. Bennett, H. Bhatia, P. Bremer, A. Gyulassy, S. Klasky, K. Ma, M. Parashar, V. Pascucci, N. Podhorszki, H. Yu SDAV Poster 28, Plaza I Board 24, 25, 28, 34, 35, Plaza I
Data Intensive Analysis Techniques and Tools (B) (7.11 MB) W. Bethel P.-T. Bremer, H. Childs, A. Gyulassy, K. Joy, V. Pascucci, T. Peterka, R. Ross, O. Rübel SDAV Poster 29, Plaza I Board 24, 25, 28, 34, 35, Plaza I
The Scalable Data Management, Analysis, and Visualization Institute Visualization Technologies and Applications (16.04 MB) J. Ahrens, C. Sewell, J. Patchett, E. Bethel, H. Childs, G. Weber, H. Krishnan, O. Ruebel, E. Brugger, B. Geveci, K. Ma, K. Joy, H. Obermaier, K. Moreland, V. Pascucci, K Potter, C. Hansen, A. Sanderson, H. Shen, T. Peterka SDAV Poster 29, Plaza I Board 24, 25, 28, 34, 35, Plaza I
Scalable Data Management, Analysis and Visualization of Particle Accelerator Simulation Data (5.08 MB) O.Rübel, C. Geddes, M. Chen, E. Cormier-Michel, J. Qiang, R. Ryne, J. Vay, D. Grote, H. Karimabadi, V. Roytershteyn, W. Daughton, J. Chou, K. Wu, S. Byna, M. Howison, Prabhat, B. Austin, A. Shoshani, E. Bethel SDAV Poster 46, Regency Room Board 24, 25, 28, 34, 35, Plaza I
Exploring Cosmology with SDAV Technologies (11.20 MB) T. Peterka, V. Vishwanath, J. Insley, J. Kwan, A. Pope, H. Finkel, K. Heitmann, S. Habib, J. Woodring, C. Sewell, J. Ahrens, G. Zagaris, R. Maynard, B. Geveci, W. Liao, M. Potwary, A. Agrawal, S. Sehrish, A. Choudhary SDAV Poster 48, Regency Room Board 24, 25, 28, 34, 35, Plaza I
Recent Achievements in Visual Data Exploration and Analysis for Climate Science (2.07 MB) E. Bethel, R. Ross, W. Liao, K. Schuchardt, D. Pugmire, H. Krishnan, Prabhat, M. Wehner, A. Sanderson, V. Pascucci, P. Bremer, S. Byna, J. Wu, M. Wehner, J. Woodring, H. Shen, K. Ma, J. Xie, H. Yu, D. Williams SDAV Poster 59, Regency Room Board 24, 25, 28, 34, 35, Plaza I
Lattice QCD on the BGQ: Achieving 1 PFlops Production Jobs (5.25 MB) R. Mawhinney Searching for Physics Beyond the Standard Model: Strongly-Coupled Field Theories at the Intensity and Energy Frontiers Poster 10, Plaza I Board 6, Plaza I
QUDA: QCD in CUDA for Multi-GPU Lattice Field Theory (5.68 MB) R. Brower Searching for Physics Beyond the Standard Model: Strongly-Coupled Field Theories at the Intensity and Energy Frontiers Poster 12, Plaza I Board 6, Plaza I
A perturbative Approximation to RAS-nSF for Excited States and Strong Correlations (3.89 MB) N. Mayhall, M. Head-Gordon Simulating the Generation, Evolution and Fate of Electronic Excitations in Molecular and Nanoscale Materials with First Principles Methods Poster 64, Regency Room Board 30, Plaza I
Efficient Implementation of Post Hartree-Fock Methods Using a General Block Tensor Library and Reduced-Rank Tensor Representations E. Epifanovsky, D. Zuev, X. Feng, A. Krylov Simulating the Generation, Evolution and Fate of Electronic Excitations in Molecular and Nanoscale Materials with First Principles Methods Poster 66, Regency Room Board 30, Plaza I
SUPER Computer Performance: Analysis and Optimization (4.29 MB) J. Chame, M. Hall, J. Hollingsworth, A. Malony, K. Huck, S. Moore, B. Norris, L. Oliker, S. Williams, P. Worley, P. Roth SUPER Poster 03, Plaza I Board 9, 13, 21, Plaza I
SUPER Energy-efficiency HPC Research (1.73 MB) L. Carrington, A. Tiwari, R. Fowler, D. Terpstra SUPER Poster 09, Plaza I Board 9, 13, 21, Plaza I
Resilience Assessment and Enhancement (2.45 MB) B. Supinski, M. Casas-Guix, T. Gamblin, K. Mohror, P. Diniz, B. Lucas, G. Gopalakrishnan, G. Bosilca, T. Herault SUPER Poster 23, Plaza I Board 9, 13, 21, Plaza I
SUPER Optimization of Power, Energy, Performance and More! (1.76 MB) P. Balaprakash, R. Chen, P. Hovland, J. Hollingsworth, A. Tiwari, S. Wild SUPER Poster 57, Regency Room Board 9, 13, 21, Plaza I
HEP-ASCR R&D Effort Towards Geant4 Re-engineering (1.89 MB) B. Norris, P. Ruth, R. Fowler, P. Diniz, R. Lucas, M. Asai, A. Dotti, R. Mount, P. Canal, D. Elvira, S. Jun, J. Kowalkowski, M. Paterno, R. Roser SUPER Poster 62, Regency Room Board 9, 13, 21, Plaza I

 

 

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