Monday, March 4, 2024
11:30AM - 12:06PM
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B60.00001: Decomposition of Response Tensors for Materials Design
Invited Speaker:
Turan Birol
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Monday, March 4, 2024
12:06PM - 12:18PM
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B60.00002: FluxGAN: A Physics-Aware Generative Adversarial Network Model for Discovery of Microstructures That Maintain Target Heat Flux
Sanghamitra Neogi, Artem Pimachev, Manoj Settipalli
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Monday, March 4, 2024
12:18PM - 12:30PM
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B60.00003: Discovery and prediction of multiphase nanoparticle interface morphologies using a Monte Carlo Potts approach
Elodie Sandraz, Christopher M Wolverton
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Monday, March 4, 2024
12:30PM - 12:42PM
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B60.00004: Design of Novel Metal Organic Chalcogenolates via High-Throughput Crystal Structure Generation and Density Functional Theory
Adriana Ladera, Aria Mansouri Tehrani, Tess E Smidt
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Monday, March 4, 2024
12:42PM - 12:54PM
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B60.00005: A General Machine Learning Force field for Structure Prediction of 2D Organic-Inorganic Perovskites
Nima Karimitari, William Baldwin, Gabor Csanyi, Christopher Sutton
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Monday, March 4, 2024
12:54PM - 1:06PM
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B60.00006: Data-mining and High-throughput Approaches to Predict Novel Perovskite Materials
FARHA NAAZ, D. L. V. K. PRASAD
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Monday, March 4, 2024
1:06PM - 1:18PM
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B60.00007: High-throughput Wannierizations and screening of novel materials
Junfeng Qiao, Giovanni Pizzi, Nicola Marzari
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Monday, March 4, 2024
1:18PM - 1:30PM
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B60.00008: High Throughput Simulations of Monovalent Cation Selectivity in Nanoporous Membranes
Naomi Trampe, Salman bin Kashif, J. Ilja Siepmann, Sapna Sarupria
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Monday, March 4, 2024
1:30PM - 1:42PM
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B60.00009: Theory guided design of wide-bandgap semiconductors for the next generation of quantum devices: diamond, silicon carbide and beyond
Igor A. Abrikosov
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Monday, March 4, 2024
1:42PM - 1:54PM
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B60.00010: Automated Workflow for High-Throughput Calculations of Band Gaps with a Wannier-localized Optimally-Tuned Screened Range-Separated Hybrid Functional
Francesco Ricci, Stephen E Gant, Francisca Sagredo, Sijia Ke, Guy Ohad, Leoor Kronik, Jeffrey B Neaton
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Monday, March 4, 2024
1:54PM - 2:06PM
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B60.00011: Preferential cyber defense for power grids
Mohammadamin Moradi, Yang Weng, Ying-Cheng Lai
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Monday, March 4, 2024
2:06PM - 2:18PM
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B60.00012: Role of oxide support in stabilizing Ag single atom catalyst and subsequent NH3 adsorption
Syeda F sherazi, Duy Le, Talat S Rahman
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Monday, March 4, 2024
2:18PM - 2:30PM
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B60.00013: Scalable Differentiable Programming via Trajectory Reweighting
Ryan Krueger, Megan C Engel, Chrisy Xiyu Du, Michael P Brenner
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