FEBRUARY 15, 2024 Journal Article Capturing the Coverage Dependence of Aromatics' Adsorption Through Mean-Field Models ( Read More )
FEBRUARY 15, 2024 Journal Article Multilevel Computational Studies Reveal the Importance of Axial Ligand for Oxygen Reduction Reaction on Fe-N-C Materials ( Read More )
FEBRUARY 15, 2024 Journal Article Self-organization of 1-propanol at H-ZSM-5 Brønsted acid sites ( Read More )
FEBRUARY 15, 2024 Journal Article Speciation and reactivity control of Cu-Oxo clusters via extraframework Al in mordenite for methane oxidation ( Read More )
FEBRUARY 15, 2024 Journal Article Evaluating Uncertainty-Based Active Learning for Accelerating the Generalization of Molecular Property Prediction ( Read More )
FEBRUARY 15, 2024 Journal Article Mechanistic Insight into Low Temperature SCR by Ceria-Manganese Mixed Oxides Incorporated into Zeolites ( Read More )
FEBRUARY 15, 2024 Journal Article Exploring NaCl-PuCl3 Molten Salts with Machine Learning Interatomic Potentials and Graph Theory ( Read More )
FEBRUARY 15, 2024 Journal Article Efficient and Selective Dual-Pathway Polyolefin Hydro-Conversion over Unexpectedly Bifunctional M/TiO2-Anatase Catalysts ( Read More )
FEBRUARY 15, 2024 Journal Article Alkene adsorption and cracking on acidic zeolites – A gradual process of understanding ( Read More )
FEBRUARY 15, 2024 Journal Article (NH4)2[UO2Cl4]·2H2O, a new uranyl tetrachloride with ammonium charge-balancing cations ( Read More )
FEBRUARY 15, 2024 Journal Article Harnessing the Hybridization of a Metal-Organic Framework and Superbase-Derived Ionic Liquid for High-Performance Direct Air Capture of CO2 ( Read More )
FEBRUARY 15, 2024 Journal Article Biomimetic CO oxidation below-100 °C by a nitrate-containing metal-free microporous system ( Read More )
FEBRUARY 15, 2024 Journal Article The Role of Process-Directing Agents on Enamel Lesion Remineralization: Fluoride Boosters ( Read More )
FEBRUARY 15, 2024 Journal Article High-Performance CO2 Capture from Air by Harnessing the Power of CaO- and Superbase-Ionic-Liquid-Engineered Sorbents ( Read More )
FEBRUARY 15, 2024 Journal Article Ultrasmall Pd clusters in FER zeolite alleviate CO poisoning for effective low-temperature carbon monoxide oxidation ( Read More )
FEBRUARY 15, 2024 Journal Article ECCE sensitivity studies for single hadron transverse single spin asymmetry measurements ( Read More )
FEBRUARY 15, 2024 Journal Article Binding of Radionuclides and Surrogate to 18-Crown-6 Ether by Density Functional Theory ( Read More )
FEBRUARY 15, 2024 Journal Article Promotion of adsorptive and catalytic properties of zeolitic Brønsted acid sites by proximal extra-framework Si(OH)x groups ( Read More )
FEBRUARY 15, 2024 Journal Article A Perspective on Sustainable Computational Chemistry Software Development and Integration ( Read More )