Efficient degradation of formaldehyde based on DFT-screened metal-doped C 3 N 6 monolayer photocatalysts: Performance evaluation and mechanistic insights

M Chen, H Wang, J Wang, M Sun, Y Hu… - Physical Chemistry …, 2023 - pubs.rsc.org
Photocatalytic oxidation is an efficient and promising technology for reducing indoor
pollution levels of formaldehyde (HCHO). However, develo** efficient and low-cost …

Synergistic effect of diatomic materials on efficient formaldehyde sensing and degradation

Z Zhu, H Tao, R Zhang, L Gan, Y Zhou - Journal of Materials Chemistry …, 2024 - pubs.rsc.org
A high-sensitivity sensor for formaldehyde (HCHO) is crucial in environmental detection and
human health studies. However, the development of sensing materials with remarkable …

A MoNi4 (312) surface preferred reconstruction enhancing hydrogen evolution

S **e, C Huang, H Dong, B Xu, Y Miao, B Gao… - Applied Catalysis B …, 2025 - Elsevier
Abstract Nickel-molybdenum (Ni-Mo) alloys have garnered significant attention for superior
electrocatalytic hydrogen evolution reaction (HER). Generally, catalysts undergo …

Metal dimers anchored on boron nitride monolayers with boron divacancy as an effective nitrogen fixation electrocatalyst: A computational study

Z Wang, Z Liu, A Ma, X Liu, F Xu, D Wu, F Wu… - International Journal of …, 2024 - Elsevier
As a fascinating approach for sustainable NH 3 production, the electrocatalytic nitrogen
reduction reaction (NRR) is still hampered by low Faraday efficiency due to high energy …

Computational identification of most potent atom pair catalysts for electrocatalytic nitrogen reduction reaction over hydrogen evolution reaction

TS Verma, AH Dar, MA Dar, K Selvaraj… - International Journal of …, 2024 - Elsevier
Robust electrocatalytic atom pair compositions (APCs) where Nitrogen Reduction Reaction
(NRR) is more enhanced over competing Hydrogen Evolution Reaction (HER) is searched …

NiCoP cocatalyst modified g-C3N4 as ohmic junction photocatalyst for efficient degradation of tetracycline under visible light

Q Gu, C Feng, J Rong, Y Zhang, X Zheng, J Mei… - Environmental …, 2024 - Elsevier
Increasing the electron-hole recombination rate in gC 3 N 4 can effectively improve its
photocatalytic performance. In this work, NiCoP/gC 3 N 4 (NCP/PCN) composites with ohmic …

Computational screening of pyrazine-based graphene-supported transition metals as single-atom catalysts for the nitrogen reduction reaction

M Zhang, C **a, L Li, A Wang, D Cao, B Zhang… - Dalton …, 2024 - pubs.rsc.org
Electrochemical synthesis of NH3 from N2 utilizing single-atom catalysts (SACs) is a
promising strategy for industrial nitrogen fixation and chemical raw material production. In …

Effective periodate activation of direct Z-scheme g-C3N4/Cu2O heterojunction for photocatalytic norfloxacin degradation, anti-bacterial activity and toxicity assessment

Q Gu, J Rong, Y Zhang, X Zheng, Z Zhou, Z Li… - Chemical Engineering …, 2025 - Elsevier
Advanced oxidation technology based on photocatalytic activation of periodate (PI) is
considered an effective method for treating contaminants in water. This paper studied the …

“Blocking and rebalance” mechanism-guided design strategies of bimetallic doped 2D α-phosphorus carbide as efficient catalysts for N2 electroreduction

C He, J Ma, S **, W Zhang - Journal of Energy Chemistry, 2024 - Elsevier
Compared to single atom catalysts (SACs), the introduction of dual atom catalysts (DACs)
has a significantly positive effect on improving the efficiency in the electrocatalytic nitrogen …

High-Throughput screening of TM1TM2/N6–1 (TM= Sc, Ti, V, Cr, Mn, Fe, Co, Ni, Mo) as effective electrocatalysts for nitrogen fixation

Y Su, X Cheng, H Zhang - Molecular Catalysis, 2024 - Elsevier
The electrochemical nitrogen reduction reaction (NRR) is an emerging nitrogen fixation
method in recent years. Double-atom catalysts compensate for the disadvantage of single …