Defects and polarization charge cooperatively optimized Z-scheme NVs-g-C3N4/Bi/BiO1-I heterojunction for full-spectrum catalytic organic pollutants mineralization and NO deep oxidation DOI
Min Wang,

Dehua Xin,

Guoqiang Tan

и другие.

Journal of Alloys and Compounds, Год журнала: 2025, Номер unknown, С. 180651 - 180651

Опубликована: Апрель 1, 2025

Язык: Английский

Study of a medium-temperature eutectic composite phase change material with effective thermal management in lithium-ion batteries DOI

Fulin Shi,

Haokun Shi,

Min Du

и другие.

International Journal of Heat and Mass Transfer, Год журнала: 2025, Номер 240, С. 126661 - 126661

Опубликована: Янв. 6, 2025

Язык: Английский

Процитировано

1
Advancements and challenges in g-C3N4/ZnIn2S4 heterojunction photocatalysts DOI
Yi Lu, Zanyong Zhuang, Lingyun Li

и другие.

Journal of Materials Chemistry A, Год журнала: 2025, Номер unknown

Опубликована: Янв. 1, 2025

In this review, a comprehensive summation of the heterojunction types, synthesis methodologies, engineering approaches, and potential photocatalytic applications pertaining to g-C 3 N 4 /ZnIn 2 S heterojunctions has been presented in-depth discussed.

Язык: Английский

Процитировано

1
Effect of Metal Site Mobility of Single-Atom Catalyst on Photocatalytic Water Oxidation DOI

Yin-xiao Sheng,

Cun‐biao Lin,

Zhi-rui Luo

и другие.

The Journal of Physical Chemistry Letters, Год журнала: 2025, Номер 16(9), С. 2166 - 2174

Опубликована: Фев. 20, 2025

Understanding the impact of catalytic site diffusion on photocatalytic performance is crucial to rational design water oxidation photocatalysts. In this study, we combined ab initio nonadiabatic molecular dynamics (NAMD) with density functional theory (DFT) calculations investigate single-atom transition metals (Ni, Pd) loaded HfS2 and their effects oxidation. Transition state indicated that barriers (0.58 eV) enable possibility between most stable HS metastable HHf for Pd/1T-HfS2. Moreover, electronic structure simulations reveal distinct properties Pd/1T-HfS2:Pd adsorption at generate a deep defect (∼0.5 eV above valence band maximum (VBM)), while introduces shallow near VBM (∼0.2 VBM). Compared pristine 1T-HfS2 (6.2 ns), electron-hole recombination time extends 7 ns Pd(HS)/1T-HfS2 but decreases 1.7 Pd(HHf)/1T-HfS2, driven by position Pd-induced states. Thermodynamically, Pd(HHf)/1T-HfS2 show pronounced difference, approximately 0.08 V in limiting potential. Generally, study enhances understanding dynamic catalysts.

Язык: Английский

Процитировано

1
Dual-atom cobalt induced dual-Z-scheme heterojunction promotes photocatalytic hydrogen evolution by enhanced interlayer charge delocalization DOI
Yajuan Wei,

Lin Jin,

Demeng Kong

и другие.

Chemical Engineering Journal, Год журнала: 2025, Номер unknown, С. 164123 - 164123

Опубликована: Май 1, 2025

Язык: Английский

Процитировано

0
Defects and polarization charge cooperatively optimized Z-scheme NVs-g-C3N4/Bi/BiO1-I heterojunction for full-spectrum catalytic organic pollutants mineralization and NO deep oxidation DOI
Min Wang,

Dehua Xin,

Guoqiang Tan

и другие.

Journal of Alloys and Compounds, Год журнала: 2025, Номер unknown, С. 180651 - 180651

Опубликована: Апрель 1, 2025

Язык: Английский

Процитировано

0