Machine learning interatomic potentials bridge quantum accuracy and computational efficiency for materials discovery. Architectures from Gaussian process regression to equivariant graph neural networks, training strategies including active learning and foundation models, and applications in solid‐state electrolytes, batteries, electrocatalysts ...
In Kee Park +19 more
wiley +1 more source
Screening and Identification of Diesel Biodegrading Bacteria Isolated From Petroleum Hydrocarbon Contaminated Garage Soils of Kericho County, Kenya. [PDF]
Yegon Z +4 more
europepmc +1 more source
Sputtering Mechanism of an Unsintered Organic–Inorganic Sputtering Target for Perovskite Solar Cells
An unsintered MAPbI3 sputtering target fabricated via a mechanochemical route enables large‐area vacuum deposition of perovskite absorber layers, while revealing an ion–photon coupled decomposition mechanism that governs target erosion and film composition under RF plasma exposure.
Doha Lim +9 more
wiley +1 more source
Characterization of the Biosurfactant Produced by Indigenous Bacteria from Mature Fine Tailings. [PDF]
Shojaei S, Mulligan CN.
europepmc +1 more source
A Gd‐doped Cu2O electrocatalyst disrupts rigid interfacial hydrogen‐bonding networks, creating a free‐water‐rich microenvironment. This accelerates proton‐coupled electron transfer, enabling selective high‐rate CO2‐to‐ethanol conversion with 48.5% Faradaic efficiency at industrially relevant current densities.
Hyunwoo Kim +11 more
wiley +1 more source
Simulation of liquid hydrocarbon production via n-tetradecane reforming: A renewable energy approach. [PDF]
Farajzadeh A, Bahadori F.
europepmc +1 more source
Modulation of Local Environment for Selective Bicarbonate Conversion to Multi‐Carbon Products
Highly porous Cu electrode partially coated with an ionomer/carbon composite enables efficient conversion of bicarbonate to multi‐carbon products. By regulating the local reaction microenvironment, this strategy overcomes selectivity and reaction‐rate limitations, achieving Faradaic efficiencies of 43% for ethylene and 60% for total multi‐carbon ...
Tai Nguyen +15 more
wiley +1 more source
Interaction mechanisms between liquid organic matter and solid bitumen. [PDF]
Lin XH, Liang T, Zou YR, Wang Y, Zou Y.
europepmc +1 more source
High Power Density, Low Temperature, Solid Oxide Fuel Cells at Elevated Oxygen Partial Pressure
Elevated pO2${{p}_{{{{\mathrm{O}}}_2}}}$ improves oxygen reduction reaction (ORR) kinetics, thus reducing electrode area specific resistance (ASR). The effect of pO2${{p}_{{{{\mathrm{O}}}_2}}}$ in open circuit potential (OCP) and ASR is demonstrated on both Sr0.5Sm0.5CoO3‐δ‐Gd0.1Ce0.9O2‐δ (SSC‐GDC) composite cathodes and our recently developed nano‐PSC
Samuel A. Horlick +7 more
wiley +1 more source
Topological regions and experimental carcinogenicity data of polycyclic aromatic hydrocarbons: a comprehensive resource for prediction models. [PDF]
Welearegay M +5 more
europepmc +1 more source

