APRIL 23, 2025 Journal Article Unleashed from Constrained Optimization: Quantum Computing for Quantum Chemistry Employing Generator Coordinate Inspired Method ( Read More )
APRIL 11, 2025 Journal Article Exploring the exact limits of the real-time equation-of-motion coupled cluster cumulant Green's functions ( Read More )
APRIL 8, 2025 Journal Article Pairing a global optimization algorithm with EXAFS to characterize lanthanide structures in solution ( Read More )
APRIL 4, 2025 Conference Paper Accelerating GNNs on GPU Sparse Tensor Cores through N:M Sparsity-Oriented Graph Reordering ( Read More )
APRIL 4, 2025 Conference Paper ATTNChecker: Highly-Optimized Fault Tolerant Attention for Large Language Model Training ( Read More )
APRIL 3, 2025 Conference Paper ChemComp: A Compilation Framework for Computing with Chemical Reaction Networks ( Read More )
MARCH 28, 2025 Conference Paper FTTN: Feature-Targeted Testing for Numerical Properties of NVIDIA & AMD Matrix Accelerators ( Read More )
MARCH 6, 2025 Journal Article Electronic structure simulations in the cloud computing environment ( Read More )
MARCH 5, 2025 Conference Paper Privacy-Preserving Artificial Intelligence on Edge Devices: A Homomorphic Encryption Approach ( Read More )
MARCH 5, 2025 Conference Paper An Efficient Checkpointing System for Large Machine Learning Model Training ( Read More )
FEBRUARY 20, 2025 Report Algorithms and file structures to extend and enhance liquid chromatography and ion mobility mass spectrometry workflows (CRADA 465) Final Report ( Read More )
FEBRUARY 14, 2025 Journal Article ARQUIN : Architectures for Multinode Superconducting Quantum Computers ( Read More )
FEBRUARY 11, 2025 Journal Article Analyzing Inference Workloads for Spatiotemporal Modeling ( Read More )
JANUARY 15, 2025 Journal Article The accuracies of effective interactions in downfolding coupled-cluster approaches for small-dimensionality active spaces ( Read More )
JANUARY 15, 2025 Journal Article WFOT: a Wave Function Overlap Tool Between Single- and Multi-Reference Electronic Structure Methods for spectroscopy Simulation ( Read More )
JANUARY 8, 2025 Conference Paper CHEMREASONER: Heuristic Search over a Large Language Model’s Knowledge Space using Quantum-Chemical Feedback ( Read More )
JANUARY 8, 2025 Journal Article Machine Learning Prediction of Nitric Acid Extraction Behavior in PUREX Process ( Read More )
JANUARY 8, 2025 Conference Paper Bridging the Gap Between LLMs and LNS with Dynamic Data Format and Architecture Codesign ( Read More )