Comparative study of fast pyrolysis, hydropyrolysis and catalytic hydropyrolysis of poplar sawdust and rice husk in a modified Py-GC/MS microreactor system: Insights …
Fast pyrolysis, hydropyrolysis and catalytic hydropyrolysis are three important methods to
produce bio-oil from biomass and are of great interest to researchers. In this research, the …
produce bio-oil from biomass and are of great interest to researchers. In this research, the …
A novel method for screening deep eutectic solvent to recycle the cathode of Li-ion batteries
Deep eutectic solvents (DESs), as a green alternative technology, exhibit great potential to
recycle valuable elements from spent lithium-ion batteries (LIBs). However, due to the weak …
recycle valuable elements from spent lithium-ion batteries (LIBs). However, due to the weak …
Visible-light-driven photo-Fenton reactions using Zn1-1.5 xFexS/g-C3N4 photocatalyst: Degradation kinetics and mechanisms analysis
The visible-light responsive hybrid catalysts (Zn 0.94 Fe 0.04 S/gC 3 N 4 or ZCN) were
synthesized by a rapid microwave hydrothermal method. Our results showed that the …
synthesized by a rapid microwave hydrothermal method. Our results showed that the …
Chemical reactivity of atrazine employing the Fukui function
In the present work we calculated reactivity descriptors for atrazine at MP2/6–311++ G (2d,
2p)//B3LYP/6–311++ G (2d, 2p) level in order to analyze its reactivity. Reactivity descriptors …
2p)//B3LYP/6–311++ G (2d, 2p) level in order to analyze its reactivity. Reactivity descriptors …
Corrosion inhibition property of azomethine functionalized triazole derivatives in 1 mol L− 1 HCl medium for mild steel: Experimental and theoretical exploration
With the aim to explore the effect of heteroatoms on corrosion inhibiting efficacy of
structurally similar azomethine based organic molecules, namely, 5-((furan-2-yl) …
structurally similar azomethine based organic molecules, namely, 5-((furan-2-yl) …
One-step synthesis of a 3D/2D Bi2WO6/g-C3N4 heterojunction for effective photocatalytic degradation of atrazine: Kinetics, degradation mechanisms and ecotoxicity
C Yang, H Chai, P Xu, P Wang, X Wang, T Shen… - Separation and …, 2022 - Elsevier
Atrazine (ATZ), as a widely used s-triazine herbicide, has persistence and biological toxicity
in the environment. Photocatalytic technique is considered as sustainable and promising …
in the environment. Photocatalytic technique is considered as sustainable and promising …
Molecular structure, electronic properties, reactivity (ELF, LOL, and Fukui), and NCI-RDG studies of the binary mixture of water and essential oil of Phlomis bruguieri
Essential oils are volatile oil-like liquids with a characteristic strong smell and taste. They are
formed in plants and are then extracted. Essential oils have extremely strong physiological …
formed in plants and are then extracted. Essential oils have extremely strong physiological …
Multifunctional biocomposites based on cross-linked Shrimp waste-derived chitosan modified Zn2+@ Calcium apatite for the removal of methyl orange and …
RELK Billah, A Zaghloul, NA Oladoja… - Materials Today …, 2024 - Elsevier
In this work, the cross-linked chitosan composite modified with zinc-doped hydroxyapatite
was synthesized and grown in its polymer matrix. The final composite material was tested for …
was synthesized and grown in its polymer matrix. The final composite material was tested for …
Introducing “UCA-FUKUI” software: reactivity-index calculations
J Sánchez-Márquez, D Zorrilla… - Journal of molecular …, 2014 - Springer
Abstract A new software (UCA-FUKUI) has been developed to facilitate the theoretical study
of chemical reactivity. This program can calculate global parameters like hardness, softness …
of chemical reactivity. This program can calculate global parameters like hardness, softness …
[HTML][HTML] Silica aerogel-carbon nanotube composites: Mechanistic insights into condensation reactions
P Maximiano, PN Simões - Chemical Engineering Journal, 2024 - Elsevier
The mechanisms and energetics of condensation reactions between carboxyl or hydroxyl
groups of oxidized carbon nanotubes and silanol groups of a silica aerogel were unveiled in …
groups of oxidized carbon nanotubes and silanol groups of a silica aerogel were unveiled in …