OCTOBER 14, 2023 Conference Paper Comparison of methods to derive infrared optical constants for organic materials for optical modeling ( Read More )
OCTOBER 14, 2023 Conference Paper Using synthetic infrared spectra derived from n/k optical constants for standoff detection of chemical deposits ( Read More )
OCTOBER 14, 2023 Journal Article Development of a Systematic and Extensible Force Field for Peptoids (STEPs) ( Read More )
OCTOBER 13, 2023 Conference Paper A Unification Framework for Euclidean and Hyperbolic Graph Neural Networks ( Read More )
OCTOBER 13, 2023 Journal Article Physics-informed machine learning of redox flow battery based on a two-dimensional unit cell model ( Read More )
OCTOBER 13, 2023 Journal Article HT Model: Using the Molecular Transformer for predicting hydrotreating reactions ( Read More )
OCTOBER 13, 2023 Conference Paper Auto-HPCnet: An Automatic Framework to Build Neural Network-based Surrogate for High-Performance Computing Applications ( Read More )
OCTOBER 13, 2023 Journal Article Uncovering the 3d and 4d Electronic Interactions in Solvated Ru Complexes with 2p3d Resonant Inelastic X-ray Scattering ( Read More )
OCTOBER 13, 2023 Conference Paper Physics-Informed Machine Learning for Modeling and Control of Dynamical Systems ( Read More )
OCTOBER 13, 2023 Journal Article Disaster Risk and Artificial Intelligence: A Framework to Characterize Conceptual Synergies and Future Opportunities ( Read More )
OCTOBER 12, 2023 Journal Article Electric Field Gradients at Rubidium Sites in Rubidium Uranyl Nitrate and Quadrupole Moments in 85Rb and 87Rb ( Read More )
OCTOBER 10, 2023 Report Graman: Graph Network Based Simulator for Forecasting Molecular Polarizability ( Read More )
OCTOBER 5, 2023 Journal Article Ferricyanide photo-aquation pathway revealed by combined femtosecond Kß main line and valence-to-core x-ray emission spectroscopy ( Read More )
SEPTEMBER 28, 2023 Journal Article Solvent-dependent structural dynamics in the ultrafast photodissociation reaction of triiodide observed with Time-Resolved X-ray Solution Scattering ( Read More )
SEPTEMBER 20, 2023 Conference Paper Fiber Bundle Morphisms as a Framework for Modeling Many-to-Many Maps ( Read More )
SEPTEMBER 20, 2023 Report “Shoulda, Coulda, Woulda”: Conceptualizing the Differences in Trust Between Human-Human Teaming and Human-Machine Teaming ( Read More )
SEPTEMBER 20, 2023 Journal Article Photogeneration of Singlet Oxygen Catalyzed by Hexafluoroisopropanol for Selective Degradation of Dyes ( Read More )
SEPTEMBER 19, 2023 Conference Paper Learning Distributed Geometric Koopman Operator for Sparse Networked Dynamical Systems ( Read More )
SEPTEMBER 16, 2023 Conference Paper A General Spatiotemporal Imputation Framework for Missing Sensor Data ( Read More )
SEPTEMBER 14, 2023 Journal Article A Combined Wave Function and Density Functional Approach for K-Edge X-ray Absorption Near-Edge Spectroscopy: A Case Study of Hydrated First-Row Transition Metal Ions ( Read More )