Maohong Fan

Effect of Al Location and Ga Species in ZSM ‐5 on Adsorption of Soluble Coke

Jinping Liu, Hongyan Liu, Lixia Ling, Caiping Ma et autres

ABSTRACT During the methanol‐to‐hydrocarbons process catalyzed by H‐ZSM‐5, coke deposition occurs and can severely hinder the reaction. The effect of Al location and Ga species in ZSM‐5 on the adsorption of soluble coke was investigated using density functional theory calculations with the …

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Engineering Intersection Cobalt Sites in Silicalite-1 for Enhanced Ethane Dehydrogenation

Xiaoru Ma, Chengkai Pan, Shaojia Song, Baojun Wang et autres

Abstract Zeolite-supported single-atom catalysts have demonstrated notable performance in alkane dehydrogenation reactions, yet the precise location of active sites and their regulatory role in catalytic behavior remain poorly understood. Herein, the combined theoretical and experimental study aims to elucidate the location-dependent ethane …

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Predictive Design of Single-Atom Catalysts for Ethane Dehydrogenation: A DFT-ML-Experimental Approach to Optimize Metal Identity and Its Coordination Environment

Yajie Cao, Zhongkui Zhao, Shaojia Song, Lixia Ling et autres

Abstract The rational design of high-performance single-atom catalysts (SACs) requires precise optimizing of both the metal identity and its local coordination environments. In this study, a combined DFT, machine learning (ML), and experiment approach is employed to systematically screen ethane direct dehydrogenation …

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Coal to carbon quantum dots via Fenton’s reagent

Alexander Prlina, Zhe Chen, Terry Arthur Ring, Tongtong Wang et autres

CO 2 ‐Derived Graphite: A Critical Material for Terrestrial and Martian Sustainability

Jie Ding, Xiaoli Tan, Mingjia Zhang, Y Huang et autres

ABSTRACT CO 2 , one of the major contributors to global climate change, is a promising carbon feedstock for graphite synthesis. Graphite is the only carbon‐based critical material recognized by numerous countries and international organizations, with various applications including energy storage on …

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Highly selective adsorption of methylene blue and malachite green by a biochar-sodium alginate composite: experimental and molecular-level mechanistic insights

Zhiju Chen, Bin Wang, Shiyun Guo, Yueli Wen et autres

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Sustainable and ultra-stable biochar–hydroxyapatite composites for synergistic adsorption of Cu(II) and Ni(II) from simulated electroplating wastewater

Shiyun Guo, Bing Wang, Zhiju Chen, Yueli Wen et autres

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Unraveling the evolution of oxygen species and its role in adjusting catalytic performance over LaAlO3-based catalysts in oxidative coupling of methane

Yaqian Zhang, Xingxu Wang, Baojun Wang, Lixia Ling et autres

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In situ photocatalytic formation of carbon quantum dots from corn stover via interfacial hydrogen peroxide generation

Xuejing Kang, Qian Yang, Sean Tang, Zhe Chen et autres

A solar-driven, low-cost, low-temperature process converts corn stover into high-purity, uniform CQDs with a robust quantum yield, pow ered by spontaneous H 2 O-to-H 2 O 2 conversion at water–gas microdroplet interfaces without external catalysts.

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Core-shell Cu@nPd1Cu3(n = 1–4) catalysts for C2H2 semi-hydrogenation: Unraveling the role of shell thickness in modulating catalytic performance

Haojie Han, Chengkai Pan, Lixia Ling, Maohong Fan

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Revealing the mechanism of xylene from trimethylcyclopentane in MTA catalyzed by Ga-ZSM-5

Junzhuo Xu, Hongyan Liu, Furong Sun, Hairong Zhang et autres

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Halogen-free CO2 cycloaddition with ethylene oxide over ZnO and M−ZnO Catalysts: Roles of metal dopant and crystal facet in Tuning catalytic performance

Jianqi Xi, Zun Guan, Baojun Wang, Maohong Fan et autres

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