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November 2024 Publications

December 3, 2024

Predicting Experimental Isotherms of MOFs? Internet Scale Robot Data Collection? Evolutionary Formulation Optimization? A selection of recent publications featuring research using the MGHPCC.

Attia L. et al (2024), Organic Solubility Prediction at the Limit of Aleatoric Uncertainty, via ChemRxiv, doi:10.26434/chemrxiv-2024-93qp3 

Bao, Ning et al (2024), Reinforced Disentanglers on Random Unitary Circuits, arXiv: 2411.09784 [quant-ph]  

Bennett, Daniel et al (2024), Accurate and efficient localized basis sets for two-dimensional materials, arXiv: 2411.12566 [cond-mat.mtrl-sci]

BICEP (2024), BICEP/Keck XIX: Extremely Thin Composite Polymer Vacuum Windows for BICEP and Other High Throughput Millimeter Wave Telescopes, arXiv: 2411.10428 

Byun, Chansup et al (2024), GPU Sharing with Triples Mode, arXiv: 2410.22254 [cs.DC] 

Cheng, Y., & McColl, K. A. (2024), Unexpected warming from land radiative management, Geophysical Research Letters, doi: 10.1029/2024GL112433 

Cheshire, James Ross, IV (2024), Generating Deepest-Yet Cosmic Microwave Background Polarization Maps with the BICEP/Keck Experiments, University of Minnesota Doctoral Dissertation, ProQuest Dissertations & Theses 31563252 

Cho, Yeongsu et al (2024), Assessing UFF and DFT-tuned Force Fields for Predicting Experimental Isotherms of MOFs, via ChemRxiv., doi: 10.26434/chemrxiv-2024-wh9m4 

Dong, Zhihuan et al (2024), Theory of Quantum Anomalous Hall Phases in Pentalayer Rhombohedral Graphene Moiré Structures, Physical Review Letters, doi: 10.1103/PhysRevLett.133.206502 

Douglas, Alexander et al (2024), Spin Squeezing with Magnetic Dipoles, arXiv: 2411.07219 [quant-ph] 

Herzog-Arbeitman, Abraham et al (2024), Controlled Gel Toughening with Tetrafunctional Cyclobutane Mechanophores, via ChemRxiv, doi: 10.26434/chemrxiv-2024-j366f 

Ji, Kaihua et al (2024), Quantitative Phase-Field Modeling of Rapid Alloy Solidification, arXiv: 2411.07953 [cond-mat.mtrl-sci]  

Kim, Junghwa et al (2024), Revealing the Interplay of Local Environments and Ionic Transport in Perovskite Solid Electrolytes, ACS Nano, doi: 10.1021/acsnano.4c09552 

Kwon, Seulki et al (2024), Exploring Free Energy Landscapes for Protein Partitioning into Membrane Domains in All-Atom and Coarse-Grained Simulations, Journal of Chemical Theory and Computation, doi: 10.1021/acs.jctc.4c00881 

​Larson, Daniel T. et al (2024), Stacking-dependent electronic structure of ultrathin perovskite bilayers, arXiv: 2411.16497 [cond-mat.mtrl-sci] 

Li, Chenguang (2024), Adding to and Building Up Very Small Nervous Systems, Harvard University Doctoral Dissertation, ProQuest Dissertations & Theses,  2024. 31560638 

Makhija, Neha and Wolfgang Gatterbauer (2024), A Unified and Practical Approach for Generalized Deletion Propagation​, arXiv: 2411.17603 [cs.DB] 

Morgan, Gareth J. et al (2024), Predicting Structural Consequences of Antibody Light Chain N-Glycosylation in AL Amyloidosis, Pharmaceuticals, doi: 10.3390/ph17111542 

Ngai, Tiffany et al (2024), Assessing polyomic risk to predict Alzheimer’s disease using a machine learning model, Alzheimer’s and Dementia, doi: 10.1002/alz.14319 

Park, Minjung et al (2024), α-MC: Self-consistent α-enhanced stellar population models covering
a wide range of age, metallicity, and wavelength, arXiv: 2410.21375  [astro-ph.GA]

Park, Younghyo et al (2024), DexHub and DART: Towards Internet Scale Robot Data Collection, arXiv: 2411.02214 [cs.RO] 

Purwitasari, Winda et al (2024), Topological insulating phase in nonsymmorphic bulk AX2 (A = Ca, Sr, or Ba; and X = As, Sb, or Bi) compounds, Appl. Phys. Lett., doi: 10.1063/5.0237667 

Saccardi, B et al (2024), Toward modeling continental‐scale inland water carbon dioxide emissions, AGU Advances, doi: 10.1029/2024AV001294 

Sakhya, A.P. et al (2024), Diverse electronic landscape of the kagome metal YbTi3Bi4, Commun Mater, doi: 10.1038/s43246-024-00681-3

Samuthpongtorn, C. et al (2024), F. prausnitzii potentially modulates the association between citrus intake and depression, Microbiome , doi: 10.1186/s40168-024-01961-3 

Semenov, V. (2024), Capturing Turbulence with Numerical Dissipation: a Simple Dynamical Model for Unresolved Turbulence in Hydrodynamic Simulations, arXiv: 2410.23339 [astro-ph.GA] 

Shao, Sen et al (2024), A Predictive First-Principles Framework of Chiral Charge Density Waves, arXiv: 2411.03664 [cond-mat.mtrl-sci] 

Wang, Baokai et al (2024), Topological Orbital Hall Effect, arXiv: 2411.00315 [cond-mat.mes-hall]  

Woodward, S.M. et al (2024), An Instrumental Variables Framework to Unite Spatial Confounding Methods, arXiv: 2411.10381 [stat.ME]

Wu, G. et al (2024), Autonomous Discovery of Functional Random Heteropolymer Blends through Evolutionary Formulation Optimization, via ChemRxiv., doi: 10.26434/chemrxiv-2024-nh0xn 

Do you have news about research using computing resources at the MGHPCC? If you have an interesting project that you want to tell people about or a paper you would like listed, contact 

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MGHPCC Publications

Research projects

A Future of Unmanned Aerial Vehicles
Yale Budget Lab
Volcanic Eruptions Impact on Stratospheric Chemistry & Ozone
The Rhode Island Coastal Hazards Analysis, Modeling, and Prediction System
Towards a Whole Brain Cellular Atlas
Tornado Path Detection
The Kempner Institute – Unlocking Intelligence
The Institute for Experiential AI
Taming the Energy Appetite of AI Models
Surface Behavior
Studying Highly Efficient Biological Solar Energy Systems
Software for Unreliable Quantum Computers
Simulating Large Biomolecular Assemblies
SEQer – Sequence Evaluation in Realtime
Revolutionizing Materials Design with Computational Modeling
Remote Sensing of Earth Systems
QuEra at the MGHPCC
Quantum Computing in Renewable Energy Development
Pulling Back the Quantum Curtain on ‘Weyl Fermions’
New Insights on Binary Black Holes
NeuraChip
Network Attached FPGAs in the OCT
Monte Carlo eXtreme (MCX) – a Physically-Accurate Photon Simulator
Modeling Hydrogels and Elastomers
Modeling Breast Cancer Spread
Measuring Neutrino Mass
Investigating Mantle Flow Through Analyses of Earthquake Wave Propagation
Impact of Marine Heatwaves on Coral Diversity
IceCube: Hunting Neutrinos
Genome Forecasting
Global Consequences of Warming-Induced Arctic River Changes
Fuzzing the Linux Kernel
Exact Gravitational Lensing by Rotating Black Holes
Evolution of Viral Infectious Disease
Evaluating Health Benefits of Stricter US Air Quality Standards
Ephemeral Stream Water Contributions to US Drainage Networks
Energy Transport and Ultrafast Spectroscopy Lab
Electron Heating in Kinetic-Alfvén-Wave Turbulence
Discovering Evolution’s Master Switches
Dexterous Robotic Hands
Developing Advanced Materials for a Sustainable Energy Future
Detecting Protein Concentrations in Assays
Denser Environments Cultivate Larger Galaxies
Deciphering Alzheimer’s Disease
Dancing Frog Genomes
Cyber-Physical Communication Network Security
Avoiding Smash Hits
Analyzing the Gut Microbiome
Adaptive Deep Learning Systems Towards Edge Intelligence
Accelerating Rendering Power
ACAS X: A Family of Next-Generation Collision Avoidance Systems
Neurocognition at the Wu Tsai Institute, Yale
Computational Modeling of Biological Systems
Computational Molecular Ecology
Social Capital and Economic Mobility
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