DECEMBER 19, 2024 Journal Article Probing the Electronic Structure of [B10H10]2- Dianion Encapsulated by an Octamethylcalix[4]pyrrole Molecule ( Read More )
DECEMBER 19, 2024 Journal Article Photodetachment photoelectron spectroscopy shows isomer-specific proton-coupled electron transfer reactions in phenolic nitrate complexes ( Read More )
DECEMBER 12, 2024 Journal Article Molecular Understanding of Nitrogen Oxide Fixation of Water-Lean Carbon Capture Solvents by Atomistic Modeling ( Read More )
NOVEMBER 21, 2024 Report Efficient Hybrid Attack Graph Generation for Cyber-Physical System Resilience Experimentation: Final Project Report ( Read More )
NOVEMBER 18, 2024 Journal Article A Closer Look at Tip-Enhanced Raman Chemical Reaction Nanoimages ( Read More )
NOVEMBER 18, 2024 Journal Article Assessment of DFT Methods for the Prediction of Detachment Energies and Electronic Structures of Complex and Multiply Charged Anions ( Read More )
NOVEMBER 18, 2024 Journal Article Strong Surface Enhanced Coherent Phonon Generation in van der Waals Materials ( Read More )
NOVEMBER 18, 2024 Report Characterize and control the multi-range structure of solution-phase systems with resonant x-ray scattering ( Read More )
NOVEMBER 18, 2024 Journal Article A Cryogenic Photoelectron Spectroscopic and Theoretical Study of the Electronic and Geometric Structures of Undercoordinated Osmium Chloride Anions OsCln- (n=3–5) ( Read More )
NOVEMBER 18, 2024 Journal Article Spin-orbit coupling in molecular complexes beyond the van der Waals regime: Key factors for further splitting of the 2P3/2 ground state ( Read More )
OCTOBER 8, 2024 Journal Article Mean-Field Ring Polymer Rates Using a Population Dividing Surface ( Read More )
OCTOBER 8, 2024 Journal Article Photoelectron Spectroscopy and Computational Study on Microsolvated [B10H10]2– Clusters and Comparisons to their [B12H12]2– Analogues ( Read More )
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 19, 2024 Journal Article Exploiting a derivative discontinuity estimate for accurate G0W0 ionization potentials and electron affinities ( Read More )
SEPTEMBER 19, 2024 Journal Article Classical vs Quantum Plasmon-Induced Molecular Transformations at Metallic Nanojunctions ( 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 Healable and Conductive Sulfur Iodide for Solid-State Li-S Batteries ( 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 Driving forces for particle-based crystallization: from experiments to theory and simulations ( Read More )
SEPTEMBER 19, 2024 Conference Paper Deriving the Infrared Complex Refractive Indices of Organic Powders for Optical Modeling: Comparison of Methods ( Read More )