Enhanced ozonation of pollutants by MgO nanoclusters/sewage sludge-derived hierarchal porous carbon: Experimental and theoretical study

2021 ◽  
Author(s):  
Siyang Li ◽  
Shujuan Zhan ◽  
Jingxiang Sun ◽  
Lingai Yao ◽  
Jinzhu Zhu ◽  
...  
Keyword(s):  
Sewage Sludge ◽  
Metal Oxides ◽  
Porous Carbon ◽  
Theoretical Study ◽  
First Time ◽  
Thermodynamic Instability

Highly reactive nanoclusters of metal oxides are extremely difficult to be synthesized due to the thermodynamic instability. For the first time, MgO nanoclusters supported on sewage sludge-derived hierarchal porous carbon...

scholarly journals A Sustainable Improvement of ω-Bromoalkylphosphonates Synthesis to Access Novel KuQuinones

Organics ◽  
2021 ◽  
Vol 2 (2) ◽  
pp. 107-117
Author(s):  
Mattia Forchetta ◽  
Valeria Conte ◽  
Giulia Fiorani ◽  
Pierluca Galloni ◽  
Federica Sabuzi
Keyword(s):  
Metal Oxides ◽  
Phosphonic Acid ◽  
Organic Molecules ◽  
Building Blocks ◽  
Reaction Conditions ◽  
Phosphonic Acids ◽  
Sustainable Improvement ◽  
Phosphonate Esters ◽  
First Time ◽  
Complex Organic

Owing to the attractiveness of organic phosphonic acids and esters in the pharmacological field and in the functionalization of conductive metal-oxides, the research of effective synthetic protocols is pivotal. Among the others, ω-bromoalkylphosphonates are gaining particular attention because they are useful building blocks for the tailored functionalization of complex organic molecules. Hence, in this work, the optimization of Michaelis–Arbuzov reaction conditions for ω-bromoalkylphosphonates has been performed, to improve process sustainability while maintaining good yields. Synthesized ω-bromoalkylphosphonates have been successfully adopted for the synthesis of new KuQuinone phosphonate esters and, by hydrolysis, phosphonic acid KuQuinone derivatives have been obtained for the first time. Considering the high affinity with metal-oxides, KuQuinones bearing phosphonic acid terminal groups are promising candidates for biomedical and photo(electro)chemical applications.

scholarly journals Theoretical study of the pyrolysis of β-1,4-xylan: a detailed investigation on unimolecular concerted reactions

2021 ◽  
Vol 23 (4) ◽  
pp. 2605-2621
Author(s):  
M. Goussougli ◽  
B. Sirjean ◽  
P.-A. Glaude ◽  
R. Fournet
Keyword(s):  
Thermal Decomposition ◽  
Theoretical Study ◽  
First Time

A theoretical study of the thermal decomposition of β-1,4-xylan, a model polymer of hemicelluloses, is proposed for the first time.

scholarly journals Asymptotic Behavior of a Viscoelastic Fluid in a Closed Loop Thermosyphon: Physical Derivation, Asymptotic Analysis, and Numerical Experiments

2013 ◽  
Vol 2013 ◽  
pp. 1-20 ◽  
Author(s):  
Justine Yasappan ◽  
Ángela Jiménez-Casas ◽  
Mario Castro
Keyword(s):  
Asymptotic Behavior ◽  
Viscoelastic Fluid ◽  
Closed Loop ◽  
Theoretical Study ◽  
Equations Of Motion ◽  
Asymptotic Properties ◽  
Inertial Manifold ◽  
Thermal Gradients ◽  
External Temperature ◽  
First Time

Fluids subject to thermal gradients produce complex behaviors that arise from the competition with gravitational effects. Although such sort of systems have been widely studied in the literature for simple (Newtonian) fluids, the behavior of viscoelastic fluids has not been explored thus far. We present a theoretical study of the dynamics of a Maxwell viscoelastic fluid in a closed-loop thermosyphon. This sort of fluid presents elastic-like behavior and memory effects. We study the asymptotic properties of the fluid inside the thermosyphon and the exact equations of motion in the inertial manifold that characterizes the asymptotic behavior. We derive, for the first time, the mathematical derivations of the motion of a viscoelastic fluid in the interior of a closed-loop thermosyphon under the effects of natural convection and a given external temperature gradient.

Metallasilsesquioxane-derived ultrathin porous carbon nanosheet 3D architectures via an “in situ dual templating” strategy for ultrafast sodium storage

2021 ◽  
Vol 9 (10) ◽  
pp. 6423-6431
Author(s):  
Xieji Lin ◽  
Yue Dong ◽  
Xiaohong Chen ◽  
Haiyan Liu ◽  
Zhaobin Liu ◽  
...  
Keyword(s):  
Porous Carbon ◽  
Carbon Sources ◽  
Carbon Nanosheets ◽  
Different Dimensions ◽  
First Time ◽  
Sodium Storage

It is the first time that metallasilsesquioxanes are introduced into the synthesis of porous carbon nanosheets. Lithium hepta(i-butyl)silsesquioxane trisilanolate is a multifunctional precursor for both carbon sources and templates with different dimensions.

Theoretical study of the Cl(2P) + SiH4 reaction: Global potential energy surface and product pair-correlated distributions. Comparison with experiment.

2021 ◽  
Author(s):  
J. Espinosa-Garcia ◽  
Jose Carlos Corchado
Keyword(s):  
Potential Energy ◽  
Potential Energy Surface ◽  
Energy Surface ◽  
Theoretical Study ◽  
Title Reaction ◽  
Comparison With Experiment ◽  
Explicitly Correlated ◽  
High Level ◽  
First Time ◽  
Product Pair

For the theoretical study of the title reaction, an analytical full-dimensional potential energy surface named PES-2021 was developed for the first time, by fitting high-level explicitly-correlated ab initio data. This...

CHARACTERISTICS OF AGE-DEPENDENT CHANGES IN THE URINE'S PROTEOM COMPOSITION OF THE HEALTHY PERSONS (EXPERIMENTAL AND THEORETICAL STUDY)

2020 ◽  
pp. 735-740
Author(s):  
Л. Х. Пастушкова ◽  
Д. Н. Каширина ◽  
А. Г. Гончарова ◽  
Н. Б. Захарова ◽  
Е. С. Тийс ◽  
...  
Keyword(s):  
Signaling Pathway ◽  
Insulin Signaling ◽  
Defense Mechanisms ◽  
Theoretical Study ◽  
Clinical Manifestations ◽  
Age Dependent ◽  
First Time ◽  
Healthy Persons ◽  
Over Time

Впервые описаны белки, достоверно увеличивающиеся и уменьшающиеся в моче с возрастом в интервале 20-60 лет. Охарактеризованы комбинации белков, связанных с изменением иммунных процессов, нарушением реологии крови, в том числе риском коагулопатии, противоопухолевых защитных механизмов, инсулинового сигнального пути, с изменением характеристик клеточного деления и качества новообразованной ткани. Таким образом, возрастная динамика основных процессов запускает каскад реакций, проявляющихся в замыкании «патологических биохимических кругов», которые формируют предпосылки к развитию заболеваний и, с течением времени, клинические проявления. For the first time proteins are described, reliably increasing and decreasing in urine with age in the range of 20 to 60 years. The combinations of proteins associated with changes in immune processes, violation of blood reology, including the risk of coagulopathy, anticancer defense mechanisms, insulin signaling pathway, changes in cell characteristics are characterized division and quality of the newly formed fabric. Thus, the age dynamics of the main processes triggers a cascade of reactions manifested in the closure of «pathological biochemical circles» that form the prerequisites for the development of diseases and, over time, clinical manifestations.

scholarly journals Easy approach to synthesize N/P/K co-doped porous carbon microfibers from cane molasses as a high performance supercapacitor electrode material

RSC Advances ◽  
2014 ◽  
Vol 4 (66) ◽  
pp. 34739-34750 ◽  
Author(s):  
Alfin Kurniawan ◽  
L. K. Ong ◽  
Fredi Kurniawan ◽  
C. X. Lin ◽  
Felycia E. Soetaredjo ◽  
...  
Keyword(s):  
Electrode Material ◽  
Porous Carbon ◽  
High Performance ◽  
Electrode Materials ◽  
Supercapacitor Electrode ◽  
Cane Molasses ◽  
Electrochemical Application ◽  
Carbon Microfibers ◽  
First Time ◽  
Co Doped

For the first time, porous carbon microfibers co-doped with N/P/K were synthesized from cane molasses by combination of electrospinning and carbonization techniques and its electrochemical application to electrode materials for supercapacitors was investigated.

An experimental and theoretical study of the kinetics of the reaction between 3-hydroxy-3-methyl-2-butanone and OH radicals

RSC Advances ◽  
2015 ◽  
Vol 5 (34) ◽  
pp. 26559-26568 ◽  
Author(s):  
Angappan Mano Priya ◽  
Gisèle El Dib ◽  
Lakshmipathi Senthilkumar ◽  
Chantal Sleiman ◽  
Alexandre Tomas ◽  
...  
Keyword(s):  
Rate Constants ◽  
Theoretical Study ◽  
Oh Radicals ◽  
First Time ◽  
Kinetics Of

Absolute experimental and theoretical rate constants are determined for the first time for the reaction of 3-hydroxy-3-methyl-2-butanone with OH as a function of temperature. The atmospheric implications are discussed.

Facile fabrication of hollow tubular mixed oxides for selective catalytic reduction of NOx at low temperature: a combined experimental and theoretical study

2017 ◽  
Vol 53 (5) ◽  
pp. 967-970 ◽  
Author(s):  
Xiuyun Wang ◽  
Zhixin Lan ◽  
Yi Liu ◽  
Yongjin Luo ◽  
Jianjun Chen ◽  
...  
Keyword(s):  
Low Temperature ◽  
Transition Metal ◽  
Metal Oxides ◽  
Transition Metal Oxides ◽  
Theoretical Study ◽  
Mixed Oxides ◽  
Catalytic Reduction ◽  
Heating Rates ◽  
Facile Fabrication ◽  
Reduction Of Nox

The 1D nanowire or hollow tubular structure of various transition metal oxides can be tuned by controlling heating rates.

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