General chemistry
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- Why Electrochemical–Thermal–Mechanical Understanding is Needed to Explain Knees in Lithium-Ion Batteries Degradation
- RaX-DT: An Open-Source Platform for Automated Molecular Docking Workflows and Reproducible Pipeline Validation
- Designing Cure Kinetics in Polyester Networks: Tuning Initiator Content to Control Gelation and Glass-Transition Development
- Multimodal Representation Learning for Exploring Natural Product Chemical Space
- Perovskite Photovoltaics in January-June 2026: The Certified Frontier From Cell to Module
- Study of neutron-induced effects on cultural heritage linen fabrics using fluorescence spectroscopy
- Incoherent Transport Signatures in Ferrocene and Ferrocenium-based Molecular Wires
- Additive manufacturing of micro-architected carbide ceramics via molten salt conversion
- Fiber-Scale Discrete Element Modeling Approach for Microstructural Evolution in Carbon Felt Electrode Manufacturing
- VIBE-QC: an open-source, general-purpose electronic-structure code for molecules and solids developed with generative AI
- Molecule–Metal Nanostructure Interactions in Plasmonic Chemistry
- Addressing the nature and reductive stability of alkylthiol-modified Cu electrode surfaces
- Reducing Synthetic Complexity: A Fluorine-Free Benzodithiophene-Thienopyrrolodione Donor Polymer by Direct Arylation Polycondensation for Organic Photovoltaics
- Experimental Data Analysis and Improved Cytochrome P450 Site-of-Metabolism Prediction for Drug Discovery
- Collaborative Laboratory Edge Networks
- Transitional Band Gaps During Polarization Switching in Wurtzite Ferroelectrics
- A Vanadium(II) Photosensitizer Delivered by Human Serum Albumin for Photodynamic Therapy
- A photochromic reaction to design original laboratory sessions for studying kinetics and uncertainties.
- DFT Modelling of Cu Segregation in Al-Cu Alloys Covered by an Ultrathin Oxide Film and Possible Links with Passivity
- Electrospray ion beam deposition of small peptides on solid surfaces: A molecular level description of the glutathione/copper interface
- Tokenising quantum data for label-efficient training of molecular models
- An open implementation of MSEVB for reactive force field simulation with simple energy-based coupling
- The CO₂ Concentration Inversion Effect: *CO Generation Rate and *CO C–C Coupling Efficiency as Dual Kinetic Descriptors for Catalyst-Dependent C₂₊ Selectivity in Dilute CO₂ Electroreduction¹
- From Rim to Core: Nitrile Coordination Creates an Electronic Gradient across Cu12 Nanocluster Nodes for CO2-to-Formate Electrosynthesis
- Do topological and quantum-inspired molecularrepresentations add value? Evidence from Africannatural-product-inspired antimalarial chemical space