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The Solubility of Carbonyl Sulfide in Aqueous Alkanolamine
, M.Sc. Thesis Sharif University of Technology ; Ghotbi, Syrus (Supervisor) ; Taghikhani, Vahid (Co-Advisor) ; Jalili, Amir Hossein (Co-Advisor)
Abstract
With considering the existence of carbonyl sulfide in natural gas and crude oil, we need to study the absorption of this gas in aqueous alkanolamine solutions. In this project the solubility of carbonyl sulfide in different pressures and two temperatures of 313.15 and 348.06 K have been measured.The absoption of carbonyl sulfide in aqueous alkanolamine solutions is a very slow process. In this study we used different methods for measuring the required data. Befor the experiments we calibrated the set up with reliable data. Finaly the results simulated with Deshmakh-Mather thermodynamic model, numerically. The simulation results show a good agreement with experimental data
Solubility of H2S in ionic liquids [hmim][PF6], [hmim][BF4], and [hmim][Tf2N]
, Article Journal of Chemical Thermodynamics ; Volume 41, Issue 9 , 2009 , Pages 1052-1055 ; 00219614 (ISSN) ; Ghotbi, C ; Hosseini Jenab, M ; Ahmadi, A. N ; Jalili, A. H ; Sharif University of Technology
2009
Abstract
The solubility of hydrogen sulphide in three ionic liquids, viz. 1-hexyl-3-methylilmidazolium hexafluorophosphate ([hmim][PF6]), 1-hexyl-3-methylimidazolium tetrafluoroborate ([hmim][BF4]), and 1-hexyl-3-methylimidazolium bis(trifluoromethanesulfonyl)imide ([hmim][Tf2N]), at temperatures ranging from 303.15 K to 343.15 K and pressures up to 1.1 MPa were determined. The solubility values were correlated using the Krichevsky-Kasarnovsky equation and Henry's constants were obtained at different temperatures. Partial molar thermodynamic functions of solvation such as standard Gibbs free energy, enthalpy, and entropy were calculated from the solubility results. Comparison of the values obtained...
Solubility of H2S in ionic liquids [bmim][PF6], [bmim][BF4], and [bmim][Tf2N]
, Article Journal of Chemical and Engineering Data ; Volume 54, Issue 6 , 2009 , Pages 1844-1849 ; 00219568 (ISSN) ; Rahmati Rostami, M ; Ghotbi, C ; Hosseini Jenab, M ; Ahmadi, A. N ; Sharif University of Technology
2009
Abstract
The solubility of hydrogen sulfide in three ionic liquids, 1-butyl-3-methylimidazolium hexafluorophosphate ([bmim][PF6]), 1-butyl-3-methylimidazolium tetrafluoroborate ([bmim][BF4]), and 1-butyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide ([bmim][Tf 2N]), at temperatures ranging from (303.15 to 343.15) K and pressures up to 1 MPa was determined. The solubility data were correlated using the Krichevsky-Kasarnovsky equation, and Henry's law constants at different temperatures were obtained. From the solubility data, the partial molar thermodynamic functions of solution such as Gibbs energy, enthalpy, and entropy were calculated. Comparison showed that the solubility of H2S in these...
Molecular Simulation of Methane Hydrate Formation Investigation of [Emim][BF4] Ionic Liquid effects on Growth and Dissociation of Methane Hydrate Crystal Using Molecular Dynamics Simulation
,
M.Sc. Thesis
Sharif University of Technology
;
Ghotbi , Cyrus
(Supervisor)
;
Taghikhani, Vahid
(Supervisor)
;
Jalili, Amir Hossein
(Supervisor)
Abstract
Formation of gas hydrates is a challenge in the oil and gas industry. Gas hydrate formation can be prevented by several methods. One of these methods is to utilize of inhibitor components. The gas hydrate inhibitors can affect hydrate formation from two aspects, i.e., thermodynamic or kinetic. In this work, thermodynamic and kinetic effects of [Emim][BF4] ionic liquid on growth and dissociation of methane hydrate crystal were investigated using molecular dynamics simulation. Molecular dynamics simulation is powerful tool to investigate the thermophysical, structural, and dynamic properties of methane hydrate and the formation, dissociation, and inhibition mechanisms at the molecular scale....
Properties of functional brain networks correlate frequency of psychogenic non-epileptic seizures
, Article Frontiers in Human Neuroscience ; Issue DEC , 2012 ; 16625161 (ISSN) ; Joudaki, A ; Jalili, M ; Rossetti, A. O ; Frackowiak, R. S ; Knyazeva, M. G ; Sharif University of Technology
Frontiers Media S. A
2012
Abstract
Abnormalities in the topology of brain networks may be an important feature and etiological factor for psychogenic non-epileptic seizures (PNES). To explore this possibility, we applied a graph theoretical approach to functional networks based on resting state EEGs from 13 PNES patients and 13 age- and gender-matched controls. The networks were extracted from Laplacian-transformed time-series by a cross-correlation method. PNES patients showed close to normal local and global connectivity and small-world structure, estimated with clustering coefficient, modularity, global efficiency, and small-worldness metrics, respectively. Yet the number of PNES attacks per month correlated with a...
Attenuated asymmetry of functional connectivity in schizophrenia: A high-resolution EEG study
, Article Psychophysiology ; Volume 47, Issue 4 , Jul , 2010 , Pages 706-716 ; 00485772 (ISSN) ; Meuli, R ; Do, K. Q ; Hasler, M ; Crow, T. J ; Knyazeva, M. G ; Sharif University of Technology
2010
Abstract
The interhemispheric asymmetries that originate from connectivity-related structuring of the cortex are compromised in schizophrenia (SZ). Under the assumption that such abnormalities affect functional connectivity, we analyzed its correlate - EEG synchronization - in SZ patients and matched controls. We applied multivariate synchronization measures based on Laplacian EEG and tuned to various spatial scales. Compared to the controls who had rightward asymmetry at a local level (EEG power), rightward anterior and leftward posterior asymmetries at an intraregional level (1st and 2nd order S-estimator), and rightward global asymmetry (hemispheric S-estimator), SZ patients showed generally...
An Experimental Study of Cancer Treatment Using Combined Hyperthermia and Chemotherapy Methods
, Ph.D. Dissertation Sharif University of Technology ; Vosoghi, Manoucher (Supervisor) ; Hormozinezhad, Mohammad Reza (Supervisor) ; Dinarvand, Rasoul (Supervisor) ; Iraji Zad, Azam (Co-Advisor)
Abstract
Cancer treatment is one of the most challenging issues of recent years. Extensive researches have been conducted in various fields of medicine, pharmacy, and medical physics in this regard. Today, considering nanotechnology developments, researchers believe that full cancer treatment is possible through the use of nano-systems designed with scientific background to overcome the defects of previous methods. In this research, the main purpose is to design and synthesize multifunctional hybrid nanostructures with favorable optical and magnetic properties providing a way to combine chemotherapy and thermal treatment. Accordingly, two different structures were designed and experimentally...
Measurement of Thermophysical Properties of Aqueous Solutions of Alkanolamine
, M.Sc. Thesis Sharif University of Technology ; Ghotbi, Siroos (Supervisor) ; Taghikhani, Vahid (Supervisor) ; Jalili, Amir Hossin (Supervisor)
Abstract
In this study, density, viscosity and surface tension of aqueous solution of Sulfolane, ( TEA+TMS+H2O) and (DIPA+TMS+H2O) systems were measured . Density, viscosity and surface tension were measured using pycnometer, Cannon – Fenske viscometer and Capillary rise method, respectively. Surface tension measurements of (DIPA+TMS+water) were carried out by the ring method using a LAUDR TD3 tensiometer,. The experiments were carried out in low concentrations and atmospheric pressure in the temperature range (70 - 30) . The obtained Data was modeled using empirical and thermodynamic models. Density calculation was done using the Setchenov and Redlich – Kister models.and the results indicated that...
The Solubility of Methyl Mercaptan in Aqueous Alkanolamine
, M.Sc. Thesis Sharif University of Technology ; Ghotbi, Cyrus (Supervisor) ; Taghikhani, Vahid (Supervisor) ; Jalili, Amir Hossein (Supervisor)
Abstract
Removal of some hazardous and toxic components of natural gas is of a great importance in industries. Thus solubility measurement of these components in appropriate solvents is a necessary task. Methylmercaptan due to its high toxicity as one of these components is separated by means of Alkanolamines. In this project a physical solubility experimental setup for absorption Methylmercaptan (CH3SH) in 48wt%, 35wt% and 25wt% MDEA aqueous solutions at 50°C and in pressures between (0.7 to 3)bar was designed and developed. The suggested setup can be used for measurement of solubility of gases (physical and chemical) in different solutions. The performance basis of the system is on precise...
Experimental Study and Thermodynamic Modelling of the Solubilities of Acid Gases in Ionic Liquids
, Ph.D. Dissertation Sharif University of Technology ; Ghotbi, Cyrus (Supervisor) ; Jalili, Amir Hossein (Co-Advisor) ; Taghikhani, Vahid (Co-Advisor)
Abstract
New experimental results are presented for the solubility of carbon dioxide and hydrogen sulfide sulfide in six imidazolium-based ionic liquids included 1-octyl-3-methylimidazolium tetrafluoroborat ([C8mim][BF4]), 1-octyl-3-methylimidazolium hexafluorophosphate ([C8mim][PF6]), 1-octyl-3-methylimidazolium bis(trifluoromethylsulfonyl)-imide ([C8mim][Tf2N]), 1-octyl-3-methylimidazolium trifluoromethanesulfonate ([C8mim][TfO]), 1-hexyl-3-methylimidazolium trifluoromethanesulfonate ([C6mim][TfO]), 1-butyl-3-methylimidazolium trifluoromethanesulfonate ([C4mim][TfO]) at temperatures range from 303.15 to 353.15 K and pressures up to about 2.5 MPa. The solubilities of the mixture of CO2/H2S in...
Precise assembly of metallic nanoclusters as building blocks of nanostructures: A molecular dynamics study
, Article Proceedings of the ASME Design Engineering Technical Conference, 15 August 2010 through 18 August 2010 ; Volume 4 , 2010 , Pages 819-826 ; 9780791844120 (ISBN) ; Meghdari, A ; Jalili, N ; Amiri, F ; Design Engineering Division and Computers in Engineering Division ; Sharif University of Technology
2010
Abstract
Molecular dynamics simulations are used to study the assembly of metallic nanoclusters using manipulation process. These particles are assumed as potential building blocks for bottom-up manufacturing of nanoscale structures. One of the key factors in the assembly of nanoclusters is their precise positioning by a manipulation system. Prediction of the corresponding behavior under the influence of working conditions is of crucial importance for planning of controlled positioning and assembly of nanoclusters. The focus of the present research is on ultra-fine metallic nanoclusters. The effects of material type and manipulation strategy on the success of the process are investigated by molecular...
Epoxy nanocomposite coating based on calcium zinc phosphate with dual active/barrier corrosion mitigation properties
, Article Progress in Organic Coatings ; Volume 163 , 2022 ; 03009440 (ISSN) ; Haddadi, S. A ; Motlagh, A. L ; Ghaderi, M ; Ramezanzadeh, B ; Mahdavian, M ; Arjmand, M ; Jalili, M ; Sharif University of Technology
Elsevier B.V
2022
Abstract
In this paper, a high-performance epoxy nanocomposite with dual active/barrier protection ability based on calcium zinc phosphate (CZP) nanopigment was fabricated. Then chemistry, morphology, and anti-corrosion ability of the commercial zinc phosphate (ZP) and CZP pigments were studied. By electrochemical techniques, the inhibition potency of the CZP nanopigment was examined in a NaCl solution on mild steel (MS) substance and compared with that of ZP. Results revealed a higher corrosion inhibition degree of the CZP compared to the ZP. The growth of a protective layer on the metal coupons exposed to the CZP extract was illustrated by X-ray photoelectron spectroscopy (XPS), field emission...
Study the Effect of Ionic Liquids on the Formation and Growth of Methane Clathrate Hydrates Using Molecular Dynamics Simulation
, M.Sc. Thesis Sharif University of Technology ; hikhani, Vahid (Supervisor) ; Ghotbi, Siroos (Supervisor) ; Jalili, Amir Hossein (Supervisor)
Abstract
The formation of gas hydrates in oil and gas industries has been the subject of long-standing problems. For example, the hydrate formation may occur and block gas pipelines which can lead to safety hazards. All of these will result in catastrophic economic losses and ecological risks. Therefore, various methods were developed to mitigate the formation of gas hydrate. In many cases, the hydrate inhibition by adding kinetic and thermodynamic inhibitors to the system is the only viable option. But recently using ionic liquids as novel hydrate inhibitors and the discovery of dual function thermo-kinetic inhibitors have been studied. In this project the performance of six imidazolium-based ionic...
Discussion: Triangular labyrinth side weirs with one and two cycles
, Article Proceedings of the Institution of Civil Engineers: Water Management ; Volume 169, Issue 3 , 2016 , Pages 111-114 ; 17417589 (ISSN) ; Nekooie, M. A ; Sadeghian, H ; Jalili Ghazizade, M. R ; Parvaneh, A ; Yang, J ; Javaheri, A ; Kabiri Samani, A ; Sharif University of Technology
Thomas Telford Services Ltd
2016
Experimental Determination & Thermodynamic Modeling of Solubility of Gases in Ionic Liquids
,
M.Sc. Thesis
Sharif University of Technology
;
Ghotbi, Cyrus
(Supervisor)
;
Behzadi, Bahman
(Supervisor)
;
Jalili, Amir Hossein
(Supervisor)
;
Ahmadi, Amir Naser
(Co-Advisor)
Abstract
Ionic liquids (IL's) are found to be potentially suitable solvents for the chemical process industry, especially due to their negligible vapor pressure which can result in a major decrease of solvent loss and the environmental harm. One of the foreseeable industrial applications in the field of natural gas processing is the replacement of traditional organic solvents (usually alkanol amines) presently used for the absorption of H2S from sour gases, by suitable IL's. Ionic liquids have been proposed for the separation of gas mixtures. In particular, ionic liquids have been suggested for the removal of the acid gases, hydrogen sulfide, and carbon dioxide, from natural gases and refinery gases....
A semantic-based access control mechanism using semantic technologies
, Article SIN'09 - Proceedings of the 2nd International Conference on Security of Information and Networks, 6 October 2009 through 10 October 2009, Famagusta ; 2009 , Pages 258-267 ; 9781605584126 (ISBN) ; Amini, M ; Jalili, R ; Taganrog Inst. Technol. South. Fed. Univ.; Russian Foundation for Basic Research; Int. Counc. Electron. Commer. Consult. (EC-Counc.); Kordon Ltd.; World Scientific Publishing (UK) Ltd ; Sharif University of Technology
2009
Abstract
In order to overcome the shortcomings of the recent frameworks and mechanisms for semantic-based access control, this paper presents a semantic-based, context-aware, and multi-domain enabled framework implementing a semantic-based access control mechanism for Semantic Web. The access control framework is based on the MA(DL)2 model, which takes the semantic relationships among different entities into account. The framework handles the Semantic Web context by classifying and representing it through an ontology. Considering the MA(DL)2 model, the framework assumes SemanticWeb having some overlapped domains, which each contains an authority and a security agent. As a domain authority...
Inferring causal molecular networks: Empirical assessment through a community-based effort
, Article Nature Methods ; Volume 13, Issue 4 , 2016 , Pages 310-322 ; 15487091 (ISSN) ; Heiser, L.M ; Cokelaer, T ; Linger, M ; Nesser, N. K ; Carlin, D. E ; Zhang, Y ; Sokolov, A ; Paull, E. O ; Wong, C. K ; Graim, K ; Bivol, A ; Wang, H ; Zhu, F ; Afsari, B ; Danilova, L. V ; Favorov, A. V ; Lee, W. S ; Taylor, D ; Hu, C. W ; Long, B. L ; Noren, D. P ; Bisberg, A. J ; Mills, G. B ; Gray, J. W ; Kellen, M ; Norman, T ; Friend, S ; Qutub, A. A ; Fertig, E. J ; Guan, Y ; Song, M ; Stuart, J. M ; Spellman, P. T ; Koeppl, H ; Stolovitzky, G ; Saez Rodriguez, J ; Mukherjee, S ; Afsari, B ; Al-Ouran, R ; Anton, B ; Arodz, T ; Askari Sichani, O ; Bagheri, N ; Berlow, N ; Bisberg, A. J ; Bivol, A ; Bohler, A ; Bonet, J ; Bonneau, R ; Budak, G ; Bunescu, R ; Caglar, M ; Cai, B ; Cai, C ; Carlin, D. E ; Carlon, A ; Chen, L ; Ciaccio, M. F ; Cokelaer, T ; Cooper, G ; Coort, S ; Creighton, C. J ; Daneshmand, S. M. H ; De La Fuente, A ; Di Camillo, B ; Danilova, L. V ; Dutta-Moscato, J ; Emmett, K ; Evelo, C ; Fassia, M. K. H ; Favorov, A. V ; Fertig, E. J ; Finkle, J. D ; Finotello, F ; Friend, S ; Gao, X ; Gao, J ; Garcia Garcia, J ; Ghosh, S ; Giaretta, A ; Graim, K ; Gray, J. W ; Großeholz, R ; Guan, Y ; Guinney, J ; Hafemeister, C ; Hahn, O ; Haider, S ; Hase, T ; Heiser, L. M ; Hill, S. M ; Hodgson, J ; Hoff, B ; Hsu, C. H ; Hu, C. W ; Hu, Y ; Huang, X ; Jalili, M ; Jiang, X ; Kacprowski, T ; Kaderali, L ; Kang, M ; Kannan, V ; Kellen, M ; Kikuchi, K ; Kim, D. C ; Kitano, H ; Knapp, B ; Komatsoulis, G ; Koeppl, H ; Krämer, A ; Kursa, M. B ; Kutmon, M ; Lee, W. S ; Li, Y ; Liang, X ; Liu, Z ; Liu, Y ; Long, B. L ; Lu, S ; Lu, X ; Manfrini, M ; Matos, M. R. A ; Meerzaman, D ; Mills, G. B ; Min, W ; Mukherjee, S ; Müller, C. L ; Neapolitan, R. E ; Nesser, N. K ; Noren, D. P ; Norman, T ; Oliva, B ; Opiyo, S. O ; Pal, R ; Palinkas, A ; Paull, E. O ; Planas Iglesias, J ; Poglayen, D ; Qutub, A. A ; Saez Rodriguez, J ; Sambo, F ; Sanavia, T ; Sharifi-Zarchi, A ; Slawek, J ; Sokolov, A ; Song, M ; Spellman, P. T ; Streck, A ; Stolovitzky, G ; Strunz, S ; Stuart, J. M ; Taylor, D ; Tegnér, J ; Thobe, K ; Toffolo, G. M ; Trifoglio, E ; Unger, M ; Wan, Q ; Wang, H ; Welch, L ; Wong, C. K ; Wu, J. J ; Xue, A. Y ; Yamanaka, R ; Yan, C ; Zairis, S ; Zengerling, M ; Zenil, H ; Zhang, S ; Zhang, Y ; Zhu, F ; Zi, Z ; Sharif University of Technology
Nature Publishing Group
2016
Abstract
It remains unclear whether causal, rather than merely correlational, relationships in molecular networks can be inferred in complex biological settings. Here we describe the HPN-DREAM network inference challenge, which focused on learning causal influences in signaling networks. We used phosphoprotein data from cancer cell lines as well as in silico data from a nonlinear dynamical model. using the phosphoprotein data, we scored more than 2,000 networks submitted by challenge participants. The networks spanned 32 biological contexts and were scored in terms of causal validity with respect to unseen interventional data. A number of approaches were effective, and incorporating known biology was...