Chemical Papers, Journal Year: 2024, Volume and Issue: 78(10), P. 5833 - 5850
Published: May 23, 2024
Language: Английский
Chemical Papers, Journal Year: 2024, Volume and Issue: 78(10), P. 5833 - 5850
Published: May 23, 2024
Language: Английский
Ceramics International, Journal Year: 2024, Volume and Issue: unknown
Published: Nov. 1, 2024
Language: Английский
Citations
2ACS Omega, Journal Year: 2023, Volume and Issue: 9(1), P. 157 - 165
Published: Dec. 20, 2023
A mixture of three distinct cerium precursors (Ce(NO3)3·6H2O, CeCl3·7H2O, and Ce(CH3COO)3·H2O) was used to prepare oxide nanoparticles (CeO2 NPs) in a polyol-mediated synthesis. Different ratios diethylene glycol (DEG) H2O were utilized the The properties synthesized CeO2 NPs, such as structural morphological properties, investigated observe effect mixed precursors. Crystallite sizes 7–8 nm obtained for all samples, samples confirmed be cubic phase. average particle spherical between 9 13 nm. successful synthesis can also via vibrational band Ce–O from FTIR. Antidiabetic NPs using α-glucosidase enzyme inhibition assay, concentration varied study. biocompatibility cytotoxicity tests, it found that materials showed no cytotoxic at lower concentrations (62.5–125 μg/mL).
Language: Английский
Citations
6Journal of Computational Chemistry, Journal Year: 2024, Volume and Issue: 45(19), P. 1643 - 1656
Published: March 29, 2024
Abstract Ni‐CeO 2 nanoparticles (NPs) are promising nanocatalysts for water splitting and gas shift reactions due to the ability of ceria temporarily donate oxygen catalytic reaction accept after is completed. Therefore, elucidating how different properties Ni‐Ceria NPs relate activity selectivity reaction, crucial importance development novel catalysts. In this work active learning (AL) method based on machine regression its uncertainty used global optimization Ce (4‐x) Ni x O (8‐x) (x = 1, 2, 3) nanoparticles, employing density functional theory calculations. Additionally, further investigation by mass‐scaled parallel‐tempering Born‐Oppenheimer molecular dynamics resulted in same putative minimum structures found AL, demonstrating robustness our AL search learn from small datasets assist complex electronic structure systems.
Language: Английский
Citations
1Journal of Materials Science Materials in Electronics, Journal Year: 2024, Volume and Issue: 35(12)
Published: April 1, 2024
Language: Английский
Citations
1Chemical Papers, Journal Year: 2024, Volume and Issue: 78(10), P. 5833 - 5850
Published: May 23, 2024
Language: Английский
Citations
1