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Construction of ternary TiO/CdS/IrO heterostructure photoanodes for efficient glycerol oxidation coupled with hydrogen evolution.
Dalton Trans
January 2025
Department of Chemistry, College of Sciences, Shanghai University, Shanghai 200444, China.
A TiO/CdS heterostructure has been widely investigated as a potential photoanode for photoelectrochemical (PEC) water splitting for hydrogen evolution. However, the efficiency and stability still remain challenging due to the sluggish reaction dynamics for water oxidation and easy photocorrosion of CdS. Here we report a ternary TiO/CdS/IrO heterostructure with IrO as a hole transport layer for PEC glycerol oxidation coupled with hydrogen evolution.
View Article and Find Full Text PDFDefect-assisted surface modification of a g-CN@WC heterostructure for tetracycline degradation: DFT calculations, degradation pathways, and nematode-based ecological assessment.
Nanoscale
January 2025
School of Chemical Engineering, Yeungnam University, Gyeongsan, 38541, South Korea.
Eliminating hazardous antibiotics from aquatic environments has become a major concern in recent years. Tetracycline (TC) compounds pose a challenge for the selective degradation of harmful chemical groups. In this study, we successfully designed carbon vacancies in a gCN@WC (GW) heterostructure for the effective removal of TC pollutants under visible light.
View Article and Find Full Text PDFComparative study of labour analgesia onset with injection of loading dose through epidural needle versus catheter: A prospective, double-blinded, randomised clinical trial.
Eur J Anaesthesiol
February 2025
From the Department of Anesthesia, Women's Hospital, Zhejiang University School of Medicine, Hangzhou, China (XC, YT, QY, LS, HL, LW, CJ, XC).
Background: Rapid onset of epidural analgesia is an important concern for the parturient. Commonly, the local anaesthetic mixture is administered through the epidural catheter. Drugs administered through the epidural needle might decrease the onset time and enhance the spread of medication within the epidural space.
View Article and Find Full Text PDFExpanding Horizons in Quantum Chemical Studies: The Versatile Power of MRSF-TDDFT.
Acc Chem Res
January 2025
Department of Chemistry, Seoul National University, Seoul 151-747, South Korea.
ConspectusWhile traditional quantum chemical theories have long been central to research, they encounter limitations when applied to complex situations. Two of the most widely used quantum chemical approaches, Density Functional Theory (DFT) and Time-Dependent Density Functional Theory (TDDFT), perform well in cases with relatively weak electron correlation, such as the ground-state minima of closed-shell systems (Franck-Condon region). However, their applicability diminishes in more demanding scenarios.
View Article and Find Full Text PDFFacile synthesis of g-CN@Sulfated titania nanocomposites with enhancement visible-light degradation of dyes and antibiotics: Mechanistic and DFT studies.
J Environ Manage
December 2024
Chemistry Department, Faculty of Science, Benha University, Benha, 13518, Egypt.
The photocatalytic efficiency of TiO has been opposed by the fast recombination speed of photogenerated carriers. Here, g-CN -modified sulfate-built-in TiO quantum dots (ST-QDs) were successfully created using a simple ultrasonication-thermal procedure. g-CN-enrapped ST QDs with a 10 nm size were revealed by the characterization results.
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