OCTOBER 18, 2022 Journal Article Isolated [B2(CN)6]2-: Small Yet Exceptional Stable Nonmetal Dianion ( Read More )
OCTOBER 18, 2022 Journal Article Water defect stabilizes Bi3+ lone-pair electronic state leading to an unusual aqueous hydration structure ( Read More )
OCTOBER 18, 2022 Journal Article Uncovering Surface Plasmon Optical Resonances in Nanohole Arrays through Interferometric Photoemission Electron Microscopy ( Read More )
OCTOBER 14, 2022 Journal Article Structure of Gas Phase Monohydrated Nicotine: Implications for Nicotine’s Native Structure in the Acetylcholine Binding Protein ( Read More )
OCTOBER 13, 2022 Conference Paper Foundation Models of Scientific Knowledge for Chemistry: Opportunities, Challenges and Lessons Learned ( Read More )
OCTOBER 13, 2022 Journal Article Determining Overpotentials for the Oxidation of Alcohols by Molecular Electrocatalysts in Non-aqueous Solvents ( Read More )
OCTOBER 7, 2022 Journal Article Preparation and characterization of model homotopic catalysts: Rh adatoms, nanoparticles, and mixed oxide surfaces on Fe3O4(001) ( Read More )
OCTOBER 6, 2022 Journal Article Hydrogen Bond Arrangements in (H2O)20, 24, 28 Clathrate Hydrate Cages: Optimization and Many-Body Analysis ( Read More )
SEPTEMBER 30, 2022 Journal Article Influence of Intermolecular Interactions on the Infrared Complex Index of Refraction for Binary Liquid Mixtures ( Read More )
SEPTEMBER 29, 2022 Journal Article Characterization of Sequentially Extracted Soil Organic Matter by Electrospray Ionization and Atmospheric Pressure Photoionization Fourier Transform Ion Cyclotron Resonance Mass Spectrometry ( Read More )
SEPTEMBER 28, 2022 Journal Article Actinides in Complex Reactive Media: A Combined Ab Initio Molecular Dynamics and Machine Learning Analytics Study of Transuranic Ions in Molten Salts ( Read More )
SEPTEMBER 28, 2022 Journal Article The Many-Body Expansion for Metals I: The Alkaline Earth metals Be, Mg, and Ca ( Read More )
SEPTEMBER 24, 2022 Journal Article Burn Intensity Drives the Alteration of Phenolic Lignin to (Poly) Aromatic Hydrocarbons as Revealed by Pyrolysis Gas Chromatography-Mass Spectrometry (Py-GC/MS) ( Read More )
SEPTEMBER 24, 2022 Journal Article Identification of the mechanism of NO reduction with ammonia (SCR) on zeolite catalysts ( Read More )
SEPTEMBER 24, 2022 Journal Article Unraveling hydridic-to-protonic dihydrogen bond predominance in monohydrated dodecaborate clusters ( Read More )
SEPTEMBER 21, 2022 Journal Article Computational Approaches for XANES, VtC-XES, and RIXS using Linear-Response Time-Dependent Density Functional Theory Based Methods ( Read More )
SEPTEMBER 21, 2022 Journal Article A Resonant Electro-Physical Transmutation Method for Water Purification ( Read More )
SEPTEMBER 21, 2022 Journal Article Internal standard triggered-parallel reaction monitoring mass spectrometry enables multiplexed quantification of candidate biomarkers in plasma ( Read More )
SEPTEMBER 21, 2022 Journal Article Implementation and validation of constrained density functional theory forces in the CP2K package ( Read More )