SEPTEMBER 27, 2024 Journal Article Isotope effects in supercooled H2O and D2O and a corresponding-states-like rescaling of the temperature and pressure ( Read More )
SEPTEMBER 20, 2024 Journal Article Deciphering the Cofilin Oligomers via Intermolecular Disulfide Bond Formation: A Coarse-grained Molecular Dynamics Approach to Understanding Cofilin’s Regulation on Actin Filaments ( Read More )
SEPTEMBER 19, 2024 Journal Article Exploiting a derivative discontinuity estimate for accurate G0W0 ionization potentials and electron affinities ( Read More )
SEPTEMBER 19, 2024 Journal Article Healable and Conductive Sulfur Iodide for Solid-State Li-S Batteries ( Read More )
SEPTEMBER 19, 2024 Journal Article Core/shell-like Localized Emission at Atomically Thin Semiconductor-Au Interface ( Read More )
SEPTEMBER 19, 2024 Journal Article Driving forces for particle-based crystallization: from experiments to theory and simulations ( Read More )
SEPTEMBER 19, 2024 Journal Article PUFFIn – A user friendly fast interface for calculating and visualizing the dose distribution in materials ( Read More )
SEPTEMBER 19, 2024 Journal Article QC-GN2oMS2: a Graph Neural Net for High Resolution Mass Spectra Prediction ( Read More )
SEPTEMBER 19, 2024 Journal Article Role of dynamic polarization interactions in the electrical double layer at calcite (104) interfaces with aqueous solutions ( Read More )
SEPTEMBER 19, 2024 Conference Paper Deriving the Infrared Complex Refractive Indices of Organic Powders for Optical Modeling: Comparison of Methods ( Read More )
SEPTEMBER 19, 2024 Journal Article Hydrogen Spillover is Regulating Minority Rh1 Active Sites on TiO2 in Room-Temperature Ethylene Hydrogenation ( Read More )
SEPTEMBER 19, 2024 Journal Article IsoForma: An R Package for Quantifying and Visualizing Positional Isomers in Top-Down LC-MS/MS Data ( Read More )
SEPTEMBER 19, 2024 Journal Article Classical vs Quantum Plasmon-Induced Molecular Transformations at Metallic Nanojunctions ( Read More )
AUGUST 13, 2024 Journal Article pH dependent reactivity of boehmite surfaces from first principles molecular dynamics ( Read More )
AUGUST 6, 2024 Conference Paper A Deep Multimodal Representation Learning Framework for Accurate Molecular Properties Prediction ( Read More )
AUGUST 6, 2024 Journal Article Visualizing nanoscale heterogeneity in perylene thin films via tip-enhanced photoluminescence with unsupervised machine learning ( Read More )
AUGUST 1, 2024 Journal Article Developmental ethanol exposure impacts Purkinje cells but not microglia in the young adult cerebellum. ( Read More )
AUGUST 1, 2024 Journal Article Influence of Time and Ageing Conditions on the Properties of Ferrihydrite ( Read More )
JULY 31, 2024 Journal Article Time’s dance with gold: tracking the isomeric fluctuations of Au clusters ( Read More )