Organic Materials of Tomorrow: Horizons of Artificial Intelligence
This review examines machine learning techniques accelerating the discovery of organic semiconductors by linking molecular structure to properties. Key methods include graph neural networks, generative models, and active learning. Applications to organic photovoltaics demonstrate practical impact.
Harold Mena +3 more
wiley +1 more source
Investigation of the operational and combustion performance of in-service gas cooktops fueled by hydrogen-enriched natural gas. [PDF]
Yuan M +7 more
europepmc +1 more source
Laser‐Assisted Phase Engineering of 2D MoS2 for Efficient Solution‐Processed Electronics
Here, local laser‐assisted phase transition from solution‐processed phase‐pure 1T′ to 2H MoS2 is shown to critically depend on the irradiation atmosphere. While processing in air leads to damaged insulating regions, inert conditions yield semiconducting 2H domains, enabling direct field‐effect transistor patterning with optimized lateral 1T′‐2H MoS2 ...
Anna Zhuravlova +10 more
wiley +1 more source
Retrofitted conversion of a Maruti Alto gasoline engine to compressed natural gas for sustainable mobility. [PDF]
Pandey RK +4 more
europepmc +1 more source
Switchable Magnonic Crystals Based on Spin Crossover/CrSBr Heterostructures
Multiscale modeling is employed to investigate the functionality of a light‐controlled, tunable magnonic crystal based on spin‐crossover Fe‐pz molecules integrated with a monolayer of CrSBr. Ab initio simulations confirm that the molecules remain functional on the CrSBr surface, while a semiclassical elastic model demonstrates that light‐induced ...
Andrei Shumilin +4 more
wiley +1 more source
Experimental Investigation of Flame and Emission Characteristics of Hydrogen-Enriched Natural Gas MixturesAn Innovative Approach for India's City Gas Distribution Network. [PDF]
Pallav, Gajbhiye KR, Bist N, Sircar A.
europepmc +1 more source
Resonant Domain Wall Dynamics in a Three‐Dimensional Magnetic Nano Double Helix
3D magnetic nanostructures promise exciting possibilities for magnetization dynamics. However, experimental realizations remain scarce. In nanoprinted cobalt double helices, time‐resolved X‐ray microscopy reveals harmonic domain wall dynamics. Simulations identify the mode and additional higher‐frequency resonances, revealing a rich dynamic landscape ...
Pamela Morales‐Fernández +15 more
wiley +1 more source
Molecular Simulation of the Adsorption Separation of Acidic Natural Gas Contaminants with Zeolites. [PDF]
Kristóf T, Fodor L.
europepmc +1 more source
Phase Engineering of Nanomaterials (PEN): Evolution, Current Challenges, and Future Opportunities
This review summarizes the synthesis, phase transition, advanced characterization spanning ex situ to in situ and operando techniques, and diverse applications of phase engineering of nanomaterials (PEN). It further outlines key challenges and future opportunities, such as phase stability, architecture control, and artificial intelligence (AI)‐driven ...
Ye Chen +7 more
wiley +1 more source
Modeling and Simulation of a New Proposed System for the Elimination of Nitrogen Contained in Natural Gas. [PDF]
Córdova-Quiroz AV +13 more
europepmc +1 more source

