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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 …
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 …
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 …
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 …
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) …
An insight to HOMO LUMO aspects in corrosion applications
HS Sujatha, M Lavanya - Canadian Metallurgical Quarterly, 2023 - Taylor & Francis
Quantum chemical simulations have been utilised to foresee the corrosion inhibitive
possibilities of new compounds and investigate their metal's surface activity methods. The …
possibilities of new compounds and investigate their metal's surface activity methods. The …
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 …
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 …
Proposal of a simple and effective local reactivity descriptor through a topological analysis of an orbital‐weighted fukui function
The prediction of reactivity is one of the long‐standing objectives of chemistry, contributing to
enforce the link between theory and experiment. In particular, the regioselectivity of aromatic …
enforce the link between theory and experiment. In particular, the regioselectivity of aromatic …