MAY 23, 2025 Journal Article Graph Characterization of Higher-Order Structure in Atmospheric Chemical Reaction Mechanisms ( Read More )
MAY 22, 2025 Journal Article Crystallographic Analysis of Intertwined Nano-domain Microstructure of y-Al2O3 ( Read More )
MAY 16, 2025 Journal Article Maximum Impact of Ionic Strength on Acid-Catalyzed Reaction Rates Induced by a Zeolite Microporous Environment ( Read More )
MAY 16, 2025 Journal Article Additive manufacturing of soft magnetic high entropy alloys: A Review ( Read More )
MAY 15, 2025 Journal Article Effects of co-adsorbed water on different bond cleavages involved in acetic acid decomposition on Pt (111) ( Read More )
MAY 13, 2025 Journal Article Insights into acetic acid binding and ketene formation on anatase TiO2(101) ( Read More )
MAY 13, 2025 Journal Article Integrated Capture and Conversion of CO2 to Methanol in a Post-Combustion Capture Solvent: Heterogenous catalysts for selective C–N bond cleavage ( Read More )
MAY 13, 2025 Journal Article GALIC: Hybrid Multi-Qubitwise Pauli Grouping for Quantum Computing Measurement ( Read More )
MAY 13, 2025 Journal Article Collision integrals within the Chapman-Enskog theory for a generalized Lennard-Jones potential ( Read More )
MAY 9, 2025 Journal Article Capturing Coupled Structural and Electronic Motions During Excited-State Intramolecular Proton Transfer via Computational Multiedge Resonant Inelastic X-ray Scattering ( Read More )
MAY 8, 2025 Journal Article CAPTURING SURFACE COVERAGE EFFECTS IN HETEROGENEOUS CATALYSIS ( Read More )
MAY 8, 2025 Journal Article Developing Robust Ceria-Supported Catalysts for Catalytic NO Reduction and CO/Hydrocarbon Oxidation ( Read More )
MAY 6, 2025 Journal Article A coarse-grained model of clay colloidal aggregation and consolidation with explicit representation of the electrical double layer ( Read More )
MAY 6, 2025 Journal Article Effective Many-body Interactions in Reduced-Dimensionality Spaces Through Neural Network Models ( Read More )
APRIL 30, 2025 Journal Article Uncertainty Quantification for Neural Network Potential Foundation Models ( Read More )
APRIL 23, 2025 Journal Article Capturing many-body correlation effects with quantum and classical computing ( Read More )
APRIL 23, 2025 Journal Article Unleashed from Constrained Optimization: Quantum Computing for Quantum Chemistry Employing Generator Coordinate Inspired Method ( Read More )
APRIL 23, 2025 Journal Article Cooperative Atomically Dispersed Fe-N4 and Sn-Nx Moieties for Durable and More Active Oxygen Electroreduction in Fuel Cells ( Read More )
APRIL 18, 2025 Journal Article Elucidating The Impact of Cis-Trans Organic Structure Directing Agent Isomer Ratios on the Aluminum Distribution within SSZ-39 ( Read More )
APRIL 18, 2025 Journal Article Shallow Rate-Redox Potential Scaling in Aqueous Molecular Oxygen Reduction Electrocatalysis Across a Family of Iron Macrocycles ( Read More )