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Wyszukujesz frazę "Saleh, M." wg kryterium: Autor


Tytuł:
Using tracking software for writing instruction
Autorzy:
Yagi, Sane M.
Al-Salman, Saleh
Powiązania:
https://bibliotekanauki.pl/articles/780611.pdf
Data publikacji:
2011-08
Wydawca:
Uniwersytet im. Adama Mickiewicza w Poznaniu
Tematy:
tracking software
metacognition
writing
pedagogy
TEFL
CALL
Opis:
Writing is a complex skill that is hard to teach. Although the written product is what is often evaluated in the context of language teaching, the process of giving thought to linguistic form is fascinating. For almost forty years, language teachers have found it more effective to help learners in the writing process than in the written product; it is there that they could find sources of writing problems. Despite all controversy evoked by post-process approaches with respect to process writing, information technology has lately offered tools that can shed new light on how writing takes place. Software that can record keyboard, mouse, and screen activities is capable of unraveling mysteries of the writing process. Technology has given teachers and learners the option of examining the writing process as it unfolds, enabling them to diagnose strategy as well as wording problems, thus empowering teachers to guide learners individually in how to think about each of their trouble spots in the context of a specific product of writing. With these advances in information technology, metacognitive awareness and strategy training begin to acquire new dimensions of meaning. Technology lays open aspects of the writing process, offering unprecedented insight into creative text production as well. This paper attempts to explain how tracking software can influence writing instruction. It briefly examines the process and post-process approaches to assess their viability, explains the concept of tracking software, proposes methodology needed for the adoption of this technology, and then discusses the pedagogical implications of these issues.
Źródło:
Studies in Second Language Learning and Teaching; 2011, 1, 2; 209-225
2083-5205
2084-1965
Pojawia się w:
Studies in Second Language Learning and Teaching
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Design of low power analog front-end for 13.56MHz RFID transponder
Autorzy:
Saleh, S.
Osman, M.
Hamdy, G.
Zaki, A.
Elsemary, H.
Powiązania:
https://bibliotekanauki.pl/articles/397985.pdf
Data publikacji:
2017
Wydawca:
Politechnika Łódzka. Wydział Mikroelektroniki i Informatyki
Tematy:
analog front frond
RFID
charge pump
OOK
pompa zasilająca
Opis:
This paper presents the design of 13.56MHz RF Front-end circuit for low-power medical applications. It converts RF power into DC and then extracts the clock and the data. The design includes rectifier, voltage multiplier, voltage regulator, data demodulator, ring oscillator, RF voltage limiter and LC matching network. It provides an excellent trade-off between high performance, simplicity of architecture, and low power consumption. It is designed to be fully integrated on chip. Simulation is done using 0.35-μm CMOS technology and the results are compared with other reported RFID systems. The total power consumption is adjusted to be around 4 μW at the minimum input power.
Źródło:
International Journal of Microelectronics and Computer Science; 2017, 8, 4; 146-149
2080-8755
2353-9607
Pojawia się w:
International Journal of Microelectronics and Computer Science
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Reducing the salinity impact on soilless culture of tomatoes using supplemental Ca and foliar micronutrients
Autorzy:
Saleh, S.
Liu, G.
Liu, M.
Liu, W.
Gruda, N.
He, H.
Powiązania:
https://bibliotekanauki.pl/articles/12688394.pdf
Data publikacji:
2019
Wydawca:
Uniwersytet Przyrodniczy w Lublinie. Wydawnictwo Uniwersytetu Przyrodniczego w Lublinie
Tematy:
plant cultivation
tomato
Solanum lycopersicum
soilless culture
vegetative growth
fruit quality
yield
calcium supplementation
foliar application
foliar nutrition
micronutrient
salinity impact
salt stress
physiological parameter
Opis:
Salt stress is known as one of the most severe abiotic factors limiting the plant production all over the world. In this study, three additives: (i) supplemental Ca (5 mmol L–1) to nutrient solution, (ii) foliar application of micronutrients (Fe, Mn and Zn at 60, 160 and 110 mg L–1, respectively), and (iii) combination of both of them were evaluated aiming to reduce the negative impact of salt stress on tomato plants cultivated in a soilless culture and improve the internal quality of fruits. The obtained results show that salinity reduced vegetative growth and physiological parameters, fruit yield and its components, and even more lowered fruit market classification of tomatoes. Salinity treatment reduced most of essential macro- and micronutrients in tomato fruit, whilst Na content was increased. Tomato productivity and fruit quality were ameliorated under saline conditions by increasing Ca into nutrient solution and applying a foliar application of micronutrients. A combination of both additives ranked the first to alleviate the adverse effects of salinity on tomatoes, followed by solo supplemental Ca into saline nutrient solution. On the other hand, the internal fruit quality of antioxidant compounds, such as vitamin C, lycopene, α-carotene, β-carotene and lutein as well as acidity, total soluble solid and dry matter percent, were increased under saline conditions.
Źródło:
Acta Scientiarum Polonorum. Hortorum Cultus; 2019, 18, 3; 187-200
1644-0692
Pojawia się w:
Acta Scientiarum Polonorum. Hortorum Cultus
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Potential of karamunting (Rhodomyrtus tomentosa) fraction against kidney damage in diabetic rats
Autorzy:
Saleh, M.I.
Hidayat, R.
Febriyanto, G.
Parisa, N.
Powiązania:
https://bibliotekanauki.pl/articles/2049334.pdf
Data publikacji:
2021
Wydawca:
Instytut Włókien Naturalnych i Roślin Zielarskich
Tematy:
Rhodomyrtus tomentosa
antioxidant compound
oxidative stress
kidney damage
diabetic rat
hemoglobina glikowana A
insulina
środki ochronne
stres oksydacyjny
Opis:
Introduction: Karamunting (Rhodomyrtus tomentosa) is Indonesian native plant that contains high antioxidant compounds with the potential to suppress oxidative stress activity in cells. This study is the first research to specifically explore the role of the karamunting fraction in protecting kidney damage due to the formation of AGEs in the renal glomerulus in diabetes mellitus. Objective: This study aims to assess the impact of karamunting on blood glucose profile, HbA1c, insulin profile and kidney condition (AGEs expression, TNF-α and kidney histology) in diabetic rats. Methods: The karamunting extraction process was carried out by maceration with ethanol. Induction of diabetes mellitus was carried out using streptozotocin. Thirty male rats (Rattus norvegicus), Wistar strain weighing between 200–250 grams were the subject in this study. HbA1c, insulin, TNF-α, AGEs levels were evaluated in the kidney tissue. Histological assessment of the kidney was carried out. Results: Karamunting can improve blood glucose levels in diabetic rats. This improvement in blood glucose levels causes an improvement in the level of HbA1c. Administration of karamunting fraction can prevent AGEs deposition in renal tissue, which in turn will inhibits the inflammation and prevents further damage of kidneys. Conclusion: Karamunting fraction can improve blood glucose regulation so that it can prevent further damage and complications of kidney organs in diabetic rats.
Źródło:
Herba Polonica; 2021, 67, 2; 9-16
0018-0599
Pojawia się w:
Herba Polonica
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Protection System Against Products Counterfeit Based on NFC and Barcode Technologies
Autorzy:
SALEH, HADI M.
UMARU, MOHAMMED U.
ALEXANDROV, DMITRY V.
Powiązania:
https://bibliotekanauki.pl/articles/457118.pdf
Data publikacji:
2017
Wydawca:
Uniwersytet Rzeszowski
Tematy:
Anti-Counterfeit Products
NFC Tags
Barcodes
QR
Mobile Application
Authenti-cation
Near Field Communication (NFC)
Opis:
Abstract The objective of this report is to provide a protective system architecture and analysis for NFC and Barcode technology that can be use to empower consumer in the fight against counter-feiting and IPR infringing products using mobile devices. This report focuses on the technology that can empower the consumer in the field in the presence of the goods itself by using technical tools and devices, which are easily available. The report identifies the main immediate empower-ring tool for consumers. This is represented by a modern smartphone (or similar device like a tablet) to be use as a tool to empower the consumer in the fight against counterfeiting. The modern smartphone is equipped with a high resolution camera, support for different standards for wireless connectivity, a powerful processor able to support the implementation of sophisticated algorithms and support for NFC and Barcode readers. In addition, the smartphone can be integrated and aug-mented with a wide range of plug-in devices and tools (e.g., an USB microscope). The concept of empowering the consumer can be an important element to support Due Diligence practices and Supply Chain Integrity because the different categories of consumer can authenticate the goods in different parts of the supply chain and report the presence of non-compliances (e.g., counterfeit products).
Źródło:
Edukacja-Technika-Informatyka; 2017, 8, 4; 368-374
2080-9069
Pojawia się w:
Edukacja-Technika-Informatyka
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
The Main Areas of Formation Telemedical Communication Systems of Republic Ecuador
Autorzy:
SALEH, HADI M.
VELOZ, LLANO JUAN GABRIEL
Powiązania:
https://bibliotekanauki.pl/articles/455376.pdf
Data publikacji:
2018
Wydawca:
Uniwersytet Rzeszowski
Tematy:
telemedicine systems
base station
Ecuador
radio wave propagation
Opis:
Health care market is one of the largest and fastest growing segments in developed countries. This article is devoted to the problem of creating a city segment of the infocommunication telemedicine system in the Republic of Ecuador, taking into account the importance of attenuation of radio waves due to territorial and climatic features in this territory.
Źródło:
Edukacja-Technika-Informatyka; 2018, 9, 4; 305-307
2080-9069
Pojawia się w:
Edukacja-Technika-Informatyka
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
A Zero-Index Metamaterial Single Layer Superstrate for Patch Antenna Gain Enhancement
Autorzy:
Saleh, C.
Bensafieddine, D.
Laamari, E.
Bouzouad, M.
Powiązania:
https://bibliotekanauki.pl/articles/1402358.pdf
Data publikacji:
2015-08
Wydawca:
Polska Akademia Nauk. Instytut Fizyki PAN
Tematy:
78.67.Pt
84.40.Ba
Opis:
The objective of this paper is to use a zero refractive index n metamaterial as single layer superstrate suspended above a microstrip patch antenna (MPA), operating at 43 GHz, for the gain enhancement. The single metamaterial layer superstrate is composed of a periodic arrangement of Jerusalem cross unit-cells, and behaves as an homogeneous medium characterized by a refractive index close to zero. This metamaterial low index property allows gathering radiated waves from the antenna and collimates them towards the superstrate normal direction. The proposed design improves the antenna gain by 5.1 dB.
Źródło:
Acta Physica Polonica A; 2015, 128, 2B; B-307-B-309
0587-4246
1898-794X
Pojawia się w:
Acta Physica Polonica A
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Study the local scour around different shapes of single submerged groyne
Autorzy:
Rashak, Budoor M.
Khassaf, Saleh I.
Powiązania:
https://bibliotekanauki.pl/articles/1844415.pdf
Data publikacji:
2020
Wydawca:
Instytut Technologiczno-Przyrodniczy
Tematy:
bed materials
bed topography pattern
local scour
single submerged groyne
Opis:
River training structures; such as submerged groynes are low profile linear structures that are generally located on the outside bank to form groynes fields and prevent the erosion of stream banks by keeping a flow away from it. In the present research, the maximum scour depth was measured based on laboratory experiments where different shapes of submerged groynes (I-shape, L-shape, T-shape) were used as sort of countermeasures to investigate about most shapes that reduce the scour around them. The result of submerged groynes showed a clear decrease in scour depth ratio due to increasing submerged ratio and increase the scour hole geometry with increasing of flow intensity, and also Froude number. The maximum scour hole in this research was observed at T-shape groyne and then followed by I-shape groyne and L-shape groyne. The maximum scour depth that cased by I-shape was more than L-shape by a percentage about 8.2%, and it was less than T-shape by a percentage about 16.4%.
Źródło:
Journal of Water and Land Development; 2020, 47; 1-9
1429-7426
2083-4535
Pojawia się w:
Journal of Water and Land Development
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
An experimental study of forced vibration on natural convection between closed ended concentric and eccentric annular of horizontal cylinder
Autorzy:
Khudhair, Baydaa K.
Saleh, Adel M.
Ekaid, Ali L.
Powiązania:
https://bibliotekanauki.pl/articles/2203644.pdf
Data publikacji:
2023
Wydawca:
Polska Akademia Nauk. Polskie Towarzystwo Diagnostyki Technicznej PAN
Tematy:
cylindrical annulus
concentric
vertically eccentric
vibration inner cylinder
drgania wymuszone
cylinder
drgania
Opis:
An experimental study has been done into the effects of vertical mechanical vibrating, vertical eccentricity, and the Rayleigh number on natural convection heat transferring out of a horizontally enclosed, ending cylindrical annulus with a radius rate of 2.6 and an aspect ratio of (2:1). The annulus produced between two concentric and vertically eccentric circular cylinders is positioned horizontally, and its internal wall is uniformly heated while isothermally cooling the external wall. The range of present conditions for Rayleigh number is 5×10^4 ≤ Ra≤ 6.48×10^6, and Pr = 0.703, the frequency of vibration is 0 ≤ f ≤ 20Hz; and the amplitude is b mm), with possible exclusion of the highest positive and negative eccentricities. Plots of the average Nusselt number variation against the Rayleigh number showed a significant increase in negative vertical eccentricity. It was found that the average Nusselt decreased as the internal cylinder changed its location vertically from negative to positive through the center, which is normally a desirable effect, but has no advantage over the concentric on the positive side. The Rayleigh number was found to be relatively sensitive to eccentricity. However, an increase of Rayleigh number leads to a nearly proportional increase in the average Nusselt number and a smaller yet still substantial increase in positive eccentricity. This study concluded that the vibration under the current experimental setup significantly affects the concentric position of the internal cylinder, whether the effect is positive or negative. The vibrational average Nusselt number increased in varying proportions, depending on the location of the heated inner cylinder.
Źródło:
Diagnostyka; 2023, 24, 2; art. no. 20230212
1641-6414
2449-5220
Pojawia się w:
Diagnostyka
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Satellite Image Fusion Using a Hybrid Traditional and Deep Learning Method
Autorzy:
Hammad, Mahmoud M.
Mahmoud, Tarek A.
Amein, Ahmed Saleh
Ghoniemy, Tarek S.
Powiązania:
https://bibliotekanauki.pl/articles/27314300.pdf
Data publikacji:
2023
Wydawca:
Akademia Górniczo-Hutnicza im. Stanisława Staszica w Krakowie. Wydawnictwo AGH
Tematy:
deep learning image fusion
remote sensing image fusion
remote sensing optical image
pan-sharpening
remote sensing image
Opis:
Due to growing demand for ground-truth in deep learning-based remote sensing satellite image fusion, numerous approaches have been presented. Of these approaches, Wald’s protocol is the most commonly used. In this paper, a new workflow is proposed consisting of two main parts. The first part targets obtaining the ground-truth images using the results of a pre-designed and well-tested hybrid traditional fusion method. This method combines the Gram–Schmidt and curvelet transform techniques to generate accurate and reliable fusion results. The second part focuses on the training of a proposed deep learning model using rich and informative data provided by the first stage to improve the fusion performance. The demonstrated deep learning model relies on a series of residual dense blocks to enhance network depth and facilitate the effective feature learning process. These blocks are designed to capture both low-level and high-level information, enabling the model to extract intricate details and meaningful features from the input data. The performance evaluation of the proposed model is carried out using seven metrics such as peak-signal-to-noise-ratio and quality without reference. The experimental results demonstrate that the proposed approach outperforms state-of-the-art methods in terms of image quality. It also exhibits the robustness and powerful nature of the proposed approach which has the potential to be applied to many remote sensing applications in agriculture, environmental monitoring, and change detection.
Źródło:
Geomatics and Environmental Engineering; 2023, 17, 5; 145--162
1898-1135
Pojawia się w:
Geomatics and Environmental Engineering
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
A combined hydrocyclone - electrocoagulation treatment for different types of industrial wastewater
Autorzy:
Farghaly, Mohamed G.
Attia, H.
Saleh, H. A.
Ramadan, A. M.
Abdel Khalek, M.A.
Powiązania:
https://bibliotekanauki.pl/articles/1448028.pdf
Data publikacji:
2021
Wydawca:
Politechnika Wrocławska. Oficyna Wydawnicza Politechniki Wrocławskiej
Tematy:
hydrocyclone
electrocoagulation
paper industry
iron industry
marble industry
granite industry
Opis:
Every year, a large amount of mineral processing wastewater is discharged from various industries into the environment which is considered a challenging task not only because of its large volume, but more importantly, its hazardous components, while its reuse as feedwater without proper treatments causes great harm to the final product of these industries. Cost-effective methods are required to treat a wide range of industrial wastewater in a diverse range of conditions. In this study, a combined hydrocyclone-electrocoagulation system is tried to treat the wastewater for industries with high water consumption and high pollutants such as paper industry, iron and metal forming industry, and marble industry. The effects of the hydrocyclone operational parameters, such as feed inlet pressure and diameter, vortex finder diameter, apex diameter, and feed solids content, were investigated. In the case, wastewater of paper industry, the following optimum conditions $(P = 4.5$ bar, $D_o = 15.8 mm, D_u = 6 mm, D_i = 4 mm and c_s = 2.3%)$ were achieved. An overflow of about 90.58% water recovery and 21.45% solid at 75.92% separation efficiency was obtained. The results showed that the hydrocycloneelectrocoagulation treatment has efficiently treated the three different types of industrial wastewater. The chemical oxygen demand (COD), biochemical oxygen demand (BOD), total solid (TS), total suspended solids (TSS), colour and turbidity, were reduced sharply and met the effluent discharge or reuse standards. Also, compared with the hydrocyclone-treated wastewater, the hydrocyloneelectrocoagulation-treated wastewater was found to be more enhanced.
Źródło:
Physicochemical Problems of Mineral Processing; 2021, 57, 2; 143-155
1643-1049
2084-4735
Pojawia się w:
Physicochemical Problems of Mineral Processing
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Carcass composition, physico-chemical and sensory properties of meat of cockerels and broiler breeder hens after reproductive cycle
Skład tuszy, właściwości fizykochemiczne i sensoryczne mięsa kur kur i brojlerów po cyklu rozrodczym
Autorzy:
Biegniewska, M.
Kokoszynski, D.
Bernacki, Z.
Saleh, M.
Powiązania:
https://bibliotekanauki.pl/articles/45004.pdf
Data publikacji:
2017
Wydawca:
Zachodniopomorski Uniwersytet Technologiczny w Szczecinie. Wydawnictwo Uczelniane ZUT w Szczecinie
Źródło:
Acta Scientiarum Polonorum. Zootechnica; 2017, 16, 1
1644-0714
Pojawia się w:
Acta Scientiarum Polonorum. Zootechnica
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
From waste to treat waste : exploitation of marble dust as a harmful pollutant to a green adsorbent for dyes and heavy metals from industrial wastewater
Autorzy:
Attia, H.A.
Farghaly, Mohamed G.
Saleh, A.M.
Abdel Khalek, M.A.
Powiązania:
https://bibliotekanauki.pl/articles/2175448.pdf
Data publikacji:
2022
Wydawca:
Politechnika Wrocławska. Oficyna Wydawnicza Politechniki Wrocławskiej
Tematy:
marble dust
pollutant
adsorbent
dye
heavy metals
textile wastewater
Opis:
The marble dust as a harmful industrial waste of marble fabrication was evaluated as aneconomical and efficient green adsorbent for Acid Red-1 dye and lead ions. The XRD, XRF, particle size, surface area and zeta-potential measurements were used to characterize the marble dust. The removal efficiency was optimized by studying several parameters such as pH, temperature, contact time, adsorbent dose and initial concentration. The optimum removal was achieved at pH 6, 20°C after 60 min in the presence of 2.5g/L marble dust. The rates of adsorption were found to follow the pseudo-second-order model. The results showed better fitting to Freundlich isotherm. The thermodynamic studies revealed that the adsorption process is spontaneous, exothermic and favorable at low temperature. The free energy (∆G°), enthalpy (∆H°), and entropy (∆S°) changes were calculated to predict the nature of adsorption.The removal efficiency was improved by calcination of the marble at 700°C. Application for textilewastewater showed high removal efficiency up to 99.9%of inorganic and organic pollutants. The product of treatment was used in the concrete and bricks manufactured, so there is nogeneration of second-order pollutants.
Źródło:
Physicochemical Problems of Mineral Processing; 2022, 58, 6; art. no. 154007
1643-1049
2084-4735
Pojawia się w:
Physicochemical Problems of Mineral Processing
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
A study on microbial self-healing concrete using expanded perlite
Autorzy:
Amjad, Usama Bin
Siddique, Muhammad Shahid
Shahid, Taha
Ahmed, Iftikhar
Alogla, Saleh M.
Ahmad, Jawad
Powiązania:
https://bibliotekanauki.pl/articles/27311428.pdf
Data publikacji:
2023
Wydawca:
Polska Akademia Nauk. Czasopisma i Monografie PAN
Tematy:
concrete
self-healing
bacteria
expanded perlite
crack detection
beton
bakteria
wykrywanie pęknięć
samonaprawialność
perlit ekspandowany
Opis:
The increasing concern for the safety and sustainability of structures is calling for the development of smart self-healing materials and preventive repair methods. This research is carried out to investigate the extent of self-healing in normal-strength concrete by using Sporosarcina aquimarina – NCCP-2716 immobilized in expanded perlite (EP) as the carrier. The efficacy of crack-healing was also tested using two alternative self-healing techniques, i.e. expanded perlite (EP) concrete and direct introduction of bacteria in concrete. A bacterial solution was embedded in EP and calcium lactate pentahydrate was added as the nutrient. Experiments revealed that specimens containing EP-immobilized bacteria had the most effective crack-healing. After 28 days of healing, the values of completely healed crack widths were up to 0.78 mm, which is higher than the 0.5 mm value for specimens with the direct addition of bacteria. The specimen showed a significant self-healing phenomenon caused by substantial calcite precipitation by bacteria. The induced cracks were observed to be repaired autonomously by the calcite produced by the bacteria without any adverse effect on strength. The results of this research could provide a scientific foundation for the use of expanded perlite as a novel microbe carrier and Sporosarcina aquimarina as a potential microbe in bacteria-based self-healing concrete.
Źródło:
Bulletin of the Polish Academy of Sciences. Technical Sciences; 2023, 71, 5; art. no. e146475
0239-7528
Pojawia się w:
Bulletin of the Polish Academy of Sciences. Technical Sciences
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
A Computational Study of the Ozonolysis of Phenanthrene
Autorzy:
Almatarneh, M.
Al-Shamaileh, E.
Ahmad, Z.
Abu-Saleh, A.A.
Elayan, I.
Powiązania:
https://bibliotekanauki.pl/articles/1031212.pdf
Data publikacji:
2017-09
Wydawca:
Polska Akademia Nauk. Instytut Fizyki PAN
Tematy:
Ozonolysis of Phenanthrene
Primary Ozonide
Criegee Intermediate
Opis:
A computational study of the ozonolysis of phenanthrene has been carried out using DFT methods (B3LYP and M06-2X). The reaction mechanism for the ozonolysis was studied in both gas phase and in solution, using the polarizable continuum solvation model. The structures for all proposed reaction mechanisms were optimized using M06-2X and B3LYP methods with 6-31G(d), 6-31+G(d), and 6-31G(2df,p) basis sets. In solution, all structures were optimized using B3LYP/6-31+G(d,p) and polarizable continuum solvation model. Six different mechanistic pathways were explored for the ozonolysis of phenanthrene that forms aldehyde compounds. The activation energy of the formation of the primary ozonide intermediate in pathway A is 13 kJ mol¯¹ in the polarizable continuum model with the B3LYP/6-31+G(d,p) method. This reaction is followed by a dissociation into a zwitterionic Criegee intermediate with an activation energy of 76 kJ mol¯¹ in polarizable continuum model with B3LYP/6-31+G(d,p). Furthermore, the nucleophilic addition reactions of methanol to the Criegee intermediate have been studied along two pathways, B1 and B2. The water-mediated mechanism for pathways B2 and C2, where the water molecule acts as a mediator through a 1,5-proton shift, dropped the activation barriers by 18 and 26 kJ mol¯¹, respectively, based on B3LYP/6-31G(2df,p) method. The solvation model (polarizable continuum) reduces the energy barriers for all pathways except for the reaction of methanol with the Criegee intermediate. This study provides an insight into understanding the mechanism of transformation of this pollutant into non-toxic compounds.
Źródło:
Acta Physica Polonica A; 2017, 132, 3; 1149-1156
0587-4246
1898-794X
Pojawia się w:
Acta Physica Polonica A
Dostawca treści:
Biblioteka Nauki
Artykuł

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