Materials for Clean Fuels Challenge program publications

List of the relevant publications for the Materials for Clean Fuels Challenge program.

Publications

• The porous transport layer in proton exchange membrane water electrolysis: perspectives on a complex component
• Redox-mediated electrosynthesis of ethylene oxide from CO2 and water | Nature Catalysis
• Continuum Model to Define the Chemistry and Mass Transfer in a Bicarbonate Electrolyzer
• Optimized feed-forward neural networks to address CO₂-equivalent emissions data gaps – Application to emissions prediction for unit processes of fuel life cycle inventories for Canadian provinces
• Golem: an algorithm for robust experiment and process optimization
• Two-dimensional Materials for Electrochemical CO₂ Reduction: Materials, In Situ/Operando Characterizations, and Perspective
• Carbonate Ion Crossover in Zero-Gap, KOH Anolyte CO₂ Electrolysis
• Chloride-mediated selective electrosynthesis of ethylene and propylene oxides at high current density
• Tuning OH binding energy enables selective electrochemical oxidation of ethylene to ethylene glycol
• How CO₂-to-Diesel Technology Could Help Reach Net-Zero Emissions Targets: A Canadian Case Study
• Neural evolution structure generation: High entropy alloys
• Optical lattice experiments at unobserved conditions with generative adversarial deep learning
• CO₂ Conversion to Acetate and CH₄ in a Microbial Electrosynthesis Cell Employing an electrically – Conductive Polymer Cathode Modified by Nickel-Based Coatings
• A comparison of microbial and bioelectrochemical approaches for biogas upgrade through carbon dioxide conversion to methane.
• In-situ Electrodeposition of Nickel on a Biocathode to Enhance Methane Production from Carbon Dioxide in a Microbial Electrosynthesis System  
• Identifying Activity and Selectivity Trends for the Electrosynthesis of Hydrogen Peroxide via Oxygen Reduction on Nickel−Nitrogen− Carbon Catalysts
• Judicious selection, validation, and use of reference electrodes for in situ and operando electrocatalysis studies
• Carbon dioxide conversion to C1 - C2 compounds in a microbial electrosynthesis cell with in situ electrodeposition of nickel and iron
• Leveraging Open Source Tools for Collaborative Macro-energy System Modeling Efforts
• A life cycle assessment of greenhouse gas emissions from direct air capture and Fischer–Tropsch fuel production
• Economic and Environmental Assessment of Integrated Carbon Capture and Utilization
• Scientific intuition inspired by machine learning generated hypotheses
• A Data Driven Framework for the Accelerated Discovery of CO₂ Reduction Electrocatalysts
• pH Matters When Reducing CO₂ in an Electrochemical Flow Cell
• Three-Dimensional Cathodes for Electrochemical Reduction of CO₂: From Macro- to Nano-Engineering
• Bipolar Membrane Electrode Assemblies for Water Electrolysis
• Learning to grow: Control of material self-assembly using evolutionary reinforcement learning
• Crystal Site Feature Embedding Enables Exploration of Large Chemical Spaces
• Development of Fukui Function-Based Descriptors for a Machine Learning Study of CO₂ Reduction
• Molecular enhancement of heterogeneous CO₂ reduction
• Adversarial generation of mesoscale surfaces from small scale chemical motifs
• Virtual Materials Intelligence for Design and Discovery of Advanced Electrocatalysts
• Combined energy storage and methane bioelectrosynthesis from carbon dioxide in a microbial electrosynthesis system