Results 211 to 220 of about 432,880 (298)

Configurational Entropy and Compositional Effects in Fe‐Based Oxide 2D Sheets for Nitrate Electroreduction

Advanced Energy Materials, EarlyView.
FeCuCoMnZnOx integrates diverse heteroatomic bridge‐site environments and composition‐dependent electronic structures to promote nitrate activation and sequential hydrogenation toward ammonia, demonstrating that nitrate reduction reaction performance is governed by the combined effects of composition and local coordination rather than configurational ...
Muhammad Usman, Zhehao Sun, Yi‐Lun Chen, Kaili Liu, Xuechen Jing, Soshan Cheong, Zeno R. Ramadhan, Jiayi Chen, Shuwen Cheng, Ary Anggara Wibowo, Daniel Macdonald, Lucy Gloag, Nicholas Cox, Richard D. Tilley, Zongyou Yin   +14 more
wiley   +1 more source

Sonocatalytic carbon dioxide reduction for syngas production over surface‐roughened CuxO catalyst

AIChE Journal, EarlyView.
Abstract The transition to a carbon‐circular economy requires efficient technologies for converting CO2 into value‐added chemical feedstocks. Sonocatalytic CO2 conversion has recently emerged as a compelling approach to drive this conversion. Here, we report a surface‐roughened CuxO catalyst for sonocatalytic CO2 reduction in aqueous media, achieving a
Dong Xia, Yi Qin, Hessan Khalid, Yagya N. Regmi, Laurie A. King, James Kwan   +5 more
wiley   +1 more source

Comparison of DeePMD, MTP, GAP, ACE and MACE Machine‐Learned Potentials for Radiation‐Damage Simulations: A User Perspective

Advanced Intelligent Discovery, EarlyView.
The authors evaluated six machine‐learned interatomic potentials for simulating threshold displacement energies and tritium diffusion in LiAlO2 essential for tritium production. Trained on the same density functional theory data and benchmarked against traditional models for accuracy, stability, displacement energies, and cost, Moment Tensor Potential ...
Ankit Roy, Ram Devanathan, Sarah Allec, Giridhar Nandipati, Andrew M. Casella, David J. Senor, Duane D. Johnson, Ganesh Balasubramanian, Ayoub Soulami   +8 more
wiley   +1 more source

Heterogeneous slab mantle hydration controls the chemical architecture of the Kamchatka arc. [PDF]

Sci Adv
Xue Q, Chen S, Fan J, Li J, Zhao D, Hoernle K, Portnyagin M, Sun W.   +7 more
europepmc   +1 more source

AI‐Driven Cancer Multi‐Omics: A Review From the Data Pipeline Perspective

Advanced Intelligent Discovery, EarlyView.
The exponential growth of cancer multi‐omics data brings opportunities and challenges for precision oncology. This review systematically examines AI's role in addressing these challenges, covering generative models, integration architectures, Explainable AI for clinical trust, clinical applications, and key directions for clinical translation.
Shilong Liu, Shunxiang Li, Kun Qian
wiley   +1 more source

Universal charge-tag labelling of undetectable polymers for mass spectrometric characterization. [PDF]

Chem Sci
Killeen C, Pestereva L, Turner MA, Swainson L, Wulff JE, McIndoe JS.   +5 more
europepmc   +1 more source

Catalyst‐Specialized Chemical Language Model Based on Transformer Variational Autoencoder for Catalyst Design and Discovery

Advanced Intelligent Discovery, EarlyView.
We present CatTransVAE, a catalyst‐specialized chemical language model (CLM) built on a transformer variational autoencoder (VAE), developed through pretraining on general compounds followed by fine‐tuning on diverse catalyst databases. A template‐guided generation framework is introduced to enable controlled catalyst design under structural ...
Apakorn Kengkanna, Masahito Ohue
wiley   +1 more source

Long-term ecological stability in the Pleistocene central Levantine corridor revealed by enamel isotopes from Lebanon. [PDF]

Commun Earth Environ
Russo G, Bibi F, Tsimopoulou C, Duval M, Hilbert YH, Haïdar-Boustani M, Drucker DG, El Zaatari S.   +7 more
europepmc   +1 more source

Evolutionary relationship between organellar DNA inheritance patterns and traits of seed plants

American Journal of Botany, EarlyView.
Abstract Premise In plants, organellar DNA is predominantly maternally inherited, but biparental and paternal inheritance have also been observed. Specific mechanisms, such as plastid exclusion during pollen mitosis or genome degradation, ensure maternal inheritance.
Takuya Konuma, Takashi Makino
wiley   +1 more source

The body temperature of <i>Tyrannosaurus rex</i>. [PDF]

Sci Adv
Flores RJ, Eagle RA, Trayler RB, Larocca Conte G, Kim SL, Chiarenza AA, Farnsworth A, Valdes PJ, Chiappe L, Tripati A.   +9 more
europepmc   +1 more source