JANUARY 1, 2026 Journal Article Energy barriers for H2 uptake and release by defects in boron nitride ( Read More )
JANUARY 1, 2026 Report Sustainable Tire Production: Catalytic Upgrading of Ethanol into Butadiene (CRADA 636) Abstract ( Read More )
DECEMBER 30, 2025 Journal Article Investigation of the Iodate Sorption Mechanism by CoAl LDH through Experiments and Ab Initio Molecular Dynamics Simulations ( Read More )
DECEMBER 30, 2025 Report Energy-efficient, Large-scale Molecular Dynamics Simulations via Hardware- and Algorithm-level Optimization ( Read More )
DECEMBER 30, 2025 Report Leveraging High-resolution Molecular Composition of Soil Organic Matter to Enhance Carbon Cycling Modeling ( Read More )
DECEMBER 30, 2025 Journal Article An investigation of the physical and chemical changes of Pd nanoparticles on carbon supports in response to the release of hydrogen from aqueous formate solutions ( Read More )
DECEMBER 30, 2025 Report A spline-based method to obtain spatially dependent viscosity in confined flows ( Read More )
DECEMBER 30, 2025 Report CarbStor: Development, Analysis and Modification of Carbon Storing Model Soil Communities ( Read More )
DECEMBER 30, 2025 Report Autonomous Infrared and Small (Wide) Angle X-Ray Scattering (IR-S(W)AXS) Capability ( Read More )
DECEMBER 30, 2025 Conference Paper Guiding Application Users via Estimation of Computational Resources for Massively Parallel Chemistry Computations ( Read More )
DECEMBER 30, 2025 Journal Article Dual aging pathways of Cu-SSZ-13 SCR catalysts: Hydrothermal vs. sulfur-induced deactivation ( Read More )
DECEMBER 20, 2025 Journal Article A Roadmap for the Future of Systems Biology in Cancer Research ( Read More )
DECEMBER 20, 2025 Journal Article The congenital APOA1 K107del mutation disrupts the lipid-free conformation of monomeric APOA1 and impairs oligomerization ( Read More )
DECEMBER 20, 2025 Journal Article Confinement-controlled selective CO2 insertion into a dicopper dihydride core: A multiscale mechanistic study ( Read More )
DECEMBER 20, 2025 Journal Article A Perspective on Quantum Computing Applications in Quantum Chemistry using 25--100 Logical Qubits ( Read More )
DECEMBER 18, 2025 Journal Article A Global Soil Plasmidome Resource Unveils Functional and Ecological Roles of Plasmids in Soil Microbiomes ( Read More )
DECEMBER 18, 2025 Journal Article A Deep Generative Model for Deciphering Cellular Dynamics and In Silico Drug Discovery in Complex Diseases ( Read More )
DECEMBER 17, 2025 Journal Article Defect Structure in Quantum-Cutting Yb3+-Doped CsPbCl3 Perovskites Probed by X-Ray Absorption and Atomic Pair Distribution Function Analysis ( Read More )