New industrial and environmental application of chemical thermodynamics to the development of the chemical processes with multiphase and multicomponent systems

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New industrial and environmental application of chemical thermodynamics to the development of the chemical processes with multiphase and multicomponent systems (en)
Нови индустријски и еколошки аспекти примене хемијске термодинамике на унапређење хемијских процеса са вишефазним и вишекомпонентним системима (sr)
Novi industrijski i ekološki aspekti primene hemijske termodinamike na unapređenje hemijskih procesa sa višefaznim i višekomponentnim sistemima (sr_RS)
Authors

Publications

Experimental densities and derived thermodynamic properties of pure p-cymene, α-pinene, limonene and citral under high pressure conditions

Ilić-Pajić, Jovana; Ivaniš, Gorica; Radović, Ivona; Grujić, Aleksandar; Stajić-Trošić, Jasna; Stijepović, Mirko Z.; Kijevčanin, Mirjana

(Elsevier, 2020)

TY  - JOUR
AU  - Ilić-Pajić, Jovana
AU  - Ivaniš, Gorica
AU  - Radović, Ivona
AU  - Grujić, Aleksandar
AU  - Stajić-Trošić, Jasna
AU  - Stijepović, Mirko Z.
AU  - Kijevčanin, Mirjana
PY  - 2020
UR  - https://cer.ihtm.bg.ac.rs/handle/123456789/3784
AB  - In order to reduce negative influence of fossil fuels on environment, use of various renewable resources is highly promoted. Terpenes, naturally occurring in plants, can be added to petroleum fuel as its substitute up to a certain share. Thermodynamic properties of a fuel under high pressure and moderate temperature conditions are of significant importance for engine efficiency. This work reports density measurements of pure p-cymene, α-pinene, limonene and citral at temperatures (293.15–413.15) K and pressures (0.1–60) MPa, applying an Anton Paar DMA HP measuring cell. Density data were fitted by modified Tammann-Tait equation where the absolute average percentage deviation between measured and calculated densities was about 0.010%. The obtained parameters were used to estimate the isothermal compressibility, the isobaric thermal expansion coefficient, the internal pressure, and the difference between specific heat capacity at constant pressure and at constant volume. For examined compounds, all thermodynamic properties, except the internal pressure, decrease with pressure rise along an isotherm and increase as temperature increases at a constant pressure. The intersection point of isotherms for the isobaric thermal expansion coefficient for pure citral was registered at pressure 47 MPa, while for other analyzed terpenes the intersection point is above 60 MPa, outside the measurements pressure range.
PB  - Elsevier
T2  - The Journal of Chemical Thermodynamics
T1  - Experimental densities and derived thermodynamic properties of pure p-cymene, α-pinene, limonene and citral under high pressure conditions
VL  - 144
SP  - 106065
DO  - 10.1016/j.jct.2020.106065
ER  - 
@article{
author = "Ilić-Pajić, Jovana and Ivaniš, Gorica and Radović, Ivona and Grujić, Aleksandar and Stajić-Trošić, Jasna and Stijepović, Mirko Z. and Kijevčanin, Mirjana",
year = "2020",
abstract = "In order to reduce negative influence of fossil fuels on environment, use of various renewable resources is highly promoted. Terpenes, naturally occurring in plants, can be added to petroleum fuel as its substitute up to a certain share. Thermodynamic properties of a fuel under high pressure and moderate temperature conditions are of significant importance for engine efficiency. This work reports density measurements of pure p-cymene, α-pinene, limonene and citral at temperatures (293.15–413.15) K and pressures (0.1–60) MPa, applying an Anton Paar DMA HP measuring cell. Density data were fitted by modified Tammann-Tait equation where the absolute average percentage deviation between measured and calculated densities was about 0.010%. The obtained parameters were used to estimate the isothermal compressibility, the isobaric thermal expansion coefficient, the internal pressure, and the difference between specific heat capacity at constant pressure and at constant volume. For examined compounds, all thermodynamic properties, except the internal pressure, decrease with pressure rise along an isotherm and increase as temperature increases at a constant pressure. The intersection point of isotherms for the isobaric thermal expansion coefficient for pure citral was registered at pressure 47 MPa, while for other analyzed terpenes the intersection point is above 60 MPa, outside the measurements pressure range.",
publisher = "Elsevier",
journal = "The Journal of Chemical Thermodynamics",
title = "Experimental densities and derived thermodynamic properties of pure p-cymene, α-pinene, limonene and citral under high pressure conditions",
volume = "144",
pages = "106065",
doi = "10.1016/j.jct.2020.106065"
}
Ilić-Pajić, J., Ivaniš, G., Radović, I., Grujić, A., Stajić-Trošić, J., Stijepović, M. Z.,& Kijevčanin, M.. (2020). Experimental densities and derived thermodynamic properties of pure p-cymene, α-pinene, limonene and citral under high pressure conditions. in The Journal of Chemical Thermodynamics
Elsevier., 144, 106065.
https://doi.org/10.1016/j.jct.2020.106065
Ilić-Pajić J, Ivaniš G, Radović I, Grujić A, Stajić-Trošić J, Stijepović MZ, Kijevčanin M. Experimental densities and derived thermodynamic properties of pure p-cymene, α-pinene, limonene and citral under high pressure conditions. in The Journal of Chemical Thermodynamics. 2020;144:106065.
doi:10.1016/j.jct.2020.106065 .
Ilić-Pajić, Jovana, Ivaniš, Gorica, Radović, Ivona, Grujić, Aleksandar, Stajić-Trošić, Jasna, Stijepović, Mirko Z., Kijevčanin, Mirjana, "Experimental densities and derived thermodynamic properties of pure p-cymene, α-pinene, limonene and citral under high pressure conditions" in The Journal of Chemical Thermodynamics, 144 (2020):106065,
https://doi.org/10.1016/j.jct.2020.106065 . .
7
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Intermolecular interactions of cis-3-hexen-1-ol or 1-hexanol with n-hexane: Thermodynamic study, FT-IR analysis and quantum chemical calculations

Zarić, Milana; Radović, Ivona; Kijevčanin, Mirjana

(Elsevier, 2020)

TY  - JOUR
AU  - Zarić, Milana
AU  - Radović, Ivona
AU  - Kijevčanin, Mirjana
PY  - 2020
UR  - https://cer.ihtm.bg.ac.rs/handle/123456789/3435
AB  - Thermodynamic properties (density, viscosity, refractive index and speed of sound) of pure substances cis-3-hexen-1-ol, 1-hexanol and n-hexane and their binary systems cis-3-hexen-1-ol + n-hexane and 1-hexanol + n-hexane were measured. All measurements are reported in the range (288.15 to 318.15) K at seven temperatures and at atmospheric pressure. Excess molar volume (VE), viscosity deviation (Δη), refractive index deviation (ΔnD) and speed of sound deviation (Δu) were calculated based on the experimental data. Derivate properties were fitted using Redlich-Kister equation. Additionally, for analyzing the molecular interaction, the FT-IR spectroscopy and quantum chemical calculations were performed. The results show differences in viscosity deviation between cis-3-hexen-1-ol + n-hexane and 1-hexanol + n-hexane mixtures, indicating some specific role of double bonds in properties of the mixtures. The FT-IR spectra indicate change in double bond frequency between pure cis-3-hexen-1-ol and mixture of cis-3-hexen-1-ol + n-hexane, and quantum chemical calculations confirmed the possibility of double bond influence on the properties of the mixtures.
PB  - Elsevier
T2  - Journal of Molecular Liquids
T1  - Intermolecular interactions of cis-3-hexen-1-ol or 1-hexanol with n-hexane: Thermodynamic study, FT-IR analysis and quantum chemical calculations
VL  - 303
SP  - 112486
DO  - 10.1016/j.molliq.2020.112486
ER  - 
@article{
author = "Zarić, Milana and Radović, Ivona and Kijevčanin, Mirjana",
year = "2020",
abstract = "Thermodynamic properties (density, viscosity, refractive index and speed of sound) of pure substances cis-3-hexen-1-ol, 1-hexanol and n-hexane and their binary systems cis-3-hexen-1-ol + n-hexane and 1-hexanol + n-hexane were measured. All measurements are reported in the range (288.15 to 318.15) K at seven temperatures and at atmospheric pressure. Excess molar volume (VE), viscosity deviation (Δη), refractive index deviation (ΔnD) and speed of sound deviation (Δu) were calculated based on the experimental data. Derivate properties were fitted using Redlich-Kister equation. Additionally, for analyzing the molecular interaction, the FT-IR spectroscopy and quantum chemical calculations were performed. The results show differences in viscosity deviation between cis-3-hexen-1-ol + n-hexane and 1-hexanol + n-hexane mixtures, indicating some specific role of double bonds in properties of the mixtures. The FT-IR spectra indicate change in double bond frequency between pure cis-3-hexen-1-ol and mixture of cis-3-hexen-1-ol + n-hexane, and quantum chemical calculations confirmed the possibility of double bond influence on the properties of the mixtures.",
publisher = "Elsevier",
journal = "Journal of Molecular Liquids",
title = "Intermolecular interactions of cis-3-hexen-1-ol or 1-hexanol with n-hexane: Thermodynamic study, FT-IR analysis and quantum chemical calculations",
volume = "303",
pages = "112486",
doi = "10.1016/j.molliq.2020.112486"
}
Zarić, M., Radović, I.,& Kijevčanin, M.. (2020). Intermolecular interactions of cis-3-hexen-1-ol or 1-hexanol with n-hexane: Thermodynamic study, FT-IR analysis and quantum chemical calculations. in Journal of Molecular Liquids
Elsevier., 303, 112486.
https://doi.org/10.1016/j.molliq.2020.112486
Zarić M, Radović I, Kijevčanin M. Intermolecular interactions of cis-3-hexen-1-ol or 1-hexanol with n-hexane: Thermodynamic study, FT-IR analysis and quantum chemical calculations. in Journal of Molecular Liquids. 2020;303:112486.
doi:10.1016/j.molliq.2020.112486 .
Zarić, Milana, Radović, Ivona, Kijevčanin, Mirjana, "Intermolecular interactions of cis-3-hexen-1-ol or 1-hexanol with n-hexane: Thermodynamic study, FT-IR analysis and quantum chemical calculations" in Journal of Molecular Liquids, 303 (2020):112486,
https://doi.org/10.1016/j.molliq.2020.112486 . .
3
3
3

Experimental measurements and theoretical simulations of alcohol and hydrocarbon binary systems

Zarić, Milana; Imhof, Petra; Radović, Ivona; Kijevčanin, Mirjana

(Serbian Chemical Society, Belgrade / Srpsko hemijsko društvo, Beograd, 2019)

TY  - CONF
AU  - Zarić, Milana
AU  - Imhof, Petra
AU  - Radović, Ivona
AU  - Kijevčanin, Mirjana
PY  - 2019
UR  - https://www.shd.org.rs/index.php/proceedings-56
UR  - https://cer.ihtm.bg.ac.rs/handle/123456789/3291
AB  - Experimental and theoretical methods were used to study two mixtures, 1-hexanol with nhexane and cis-3-hexen-1-ol with n-hexane. The experimental technics were used to determine excess molar volume and viscosity deviations in the temperature range from 288.15K to 318.15K. The data of excess molar volume indicate similar behavior of the two alcohols, 1-hexanol and cis-3-hexen-1-ol in mixtures with n-hexane. The experimental data are in accordance with molecular dynamics simulation of these mixtures, showing similar number of hydrogen bonds in the two mixtures. The experimental data of viscosity deviations show difference of the two mixtures, where the deviation is significantly larger for cis-3- hexen-1-ol and n-hexane mixture, indicating stronger interactions within cis-3-hexen-1-ol and n-hexane binary mixture. These experimental data are in accordance with quantum chemical calculations on interactions energies. Namely, calculated interaction energies show that interaction between single and double bonds are stronger, than interactions between two single bonds.
AB  - Eksperimentalne i teorijske metode korišćene su za proučavanje dve smeše, 1-heksanola sa n-heksanom i cis-3-heksen-1-ola sa n-heksanom. Eksperimentalne tehnike su korišćene za određivanje dopunskih zapremina i promene viskoznosti za temperaturni opseg od 288.15K do 318.15K. Podaci o dopunskoj molarnoj zapremini ukazuje na slično ponašanje dva alkohola, 1-heksanola i cis-3-heksen-1-ola u smešama sa n-heksanom. Eksperimentalni podaci su u skladu sa simulacijom molekularne dinamike ovih smeša, pokazujući sličan broj vodoničnih veza u dve smeše. Eksperimentalni podaci o promeni viskoznosti pokazuju značajnu razliku između dve smeše, odstupanje je značajno veće za smešu cis-3-heksen-1- ol i n-heksan, što ukazuje na jaču interakciju u binarnoj smeši cis-3-heksen-1-ola i nheksana. Ovi eksperimentalni podaci su u skladu sa kvantno-hemijskim proračunima energija interakcija na molekulskom nivou. Naime, izračunate energije interakcije pokazuju da je interakcija između jednostrukih i dvostrukih veza jača, nego interakcija između dve jednostruke veze.
PB  - Serbian Chemical Society, Belgrade / Srpsko hemijsko društvo, Beograd
C3  - 56th Meeting of the Serbian chemical Society - Proceedings / 56. Savetovanje Srpskog hemijskog društva - Knjiga radova, Niš 7-8.9. 2019.
T1  - Experimental measurements and theoretical simulations of alcohol and hydrocarbon binary systems
T1  - Eksperimentalna merenja i teorijske simulacije binarnih sistema alkohola i ugljovodonika
SP  - 38
UR  - https://hdl.handle.net/21.15107/rcub_cer_3291
ER  - 
@conference{
author = "Zarić, Milana and Imhof, Petra and Radović, Ivona and Kijevčanin, Mirjana",
year = "2019",
abstract = "Experimental and theoretical methods were used to study two mixtures, 1-hexanol with nhexane and cis-3-hexen-1-ol with n-hexane. The experimental technics were used to determine excess molar volume and viscosity deviations in the temperature range from 288.15K to 318.15K. The data of excess molar volume indicate similar behavior of the two alcohols, 1-hexanol and cis-3-hexen-1-ol in mixtures with n-hexane. The experimental data are in accordance with molecular dynamics simulation of these mixtures, showing similar number of hydrogen bonds in the two mixtures. The experimental data of viscosity deviations show difference of the two mixtures, where the deviation is significantly larger for cis-3- hexen-1-ol and n-hexane mixture, indicating stronger interactions within cis-3-hexen-1-ol and n-hexane binary mixture. These experimental data are in accordance with quantum chemical calculations on interactions energies. Namely, calculated interaction energies show that interaction between single and double bonds are stronger, than interactions between two single bonds., Eksperimentalne i teorijske metode korišćene su za proučavanje dve smeše, 1-heksanola sa n-heksanom i cis-3-heksen-1-ola sa n-heksanom. Eksperimentalne tehnike su korišćene za određivanje dopunskih zapremina i promene viskoznosti za temperaturni opseg od 288.15K do 318.15K. Podaci o dopunskoj molarnoj zapremini ukazuje na slično ponašanje dva alkohola, 1-heksanola i cis-3-heksen-1-ola u smešama sa n-heksanom. Eksperimentalni podaci su u skladu sa simulacijom molekularne dinamike ovih smeša, pokazujući sličan broj vodoničnih veza u dve smeše. Eksperimentalni podaci o promeni viskoznosti pokazuju značajnu razliku između dve smeše, odstupanje je značajno veće za smešu cis-3-heksen-1- ol i n-heksan, što ukazuje na jaču interakciju u binarnoj smeši cis-3-heksen-1-ola i nheksana. Ovi eksperimentalni podaci su u skladu sa kvantno-hemijskim proračunima energija interakcija na molekulskom nivou. Naime, izračunate energije interakcije pokazuju da je interakcija između jednostrukih i dvostrukih veza jača, nego interakcija između dve jednostruke veze.",
publisher = "Serbian Chemical Society, Belgrade / Srpsko hemijsko društvo, Beograd",
journal = "56th Meeting of the Serbian chemical Society - Proceedings / 56. Savetovanje Srpskog hemijskog društva - Knjiga radova, Niš 7-8.9. 2019.",
title = "Experimental measurements and theoretical simulations of alcohol and hydrocarbon binary systems, Eksperimentalna merenja i teorijske simulacije binarnih sistema alkohola i ugljovodonika",
pages = "38",
url = "https://hdl.handle.net/21.15107/rcub_cer_3291"
}
Zarić, M., Imhof, P., Radović, I.,& Kijevčanin, M.. (2019). Experimental measurements and theoretical simulations of alcohol and hydrocarbon binary systems. in 56th Meeting of the Serbian chemical Society - Proceedings / 56. Savetovanje Srpskog hemijskog društva - Knjiga radova, Niš 7-8.9. 2019.
Serbian Chemical Society, Belgrade / Srpsko hemijsko društvo, Beograd., 38.
https://hdl.handle.net/21.15107/rcub_cer_3291
Zarić M, Imhof P, Radović I, Kijevčanin M. Experimental measurements and theoretical simulations of alcohol and hydrocarbon binary systems. in 56th Meeting of the Serbian chemical Society - Proceedings / 56. Savetovanje Srpskog hemijskog društva - Knjiga radova, Niš 7-8.9. 2019.. 2019;:38.
https://hdl.handle.net/21.15107/rcub_cer_3291 .
Zarić, Milana, Imhof, Petra, Radović, Ivona, Kijevčanin, Mirjana, "Experimental measurements and theoretical simulations of alcohol and hydrocarbon binary systems" in 56th Meeting of the Serbian chemical Society - Proceedings / 56. Savetovanje Srpskog hemijskog društva - Knjiga radova, Niš 7-8.9. 2019. (2019):38,
https://hdl.handle.net/21.15107/rcub_cer_3291 .

Modelling of pure components high pressures densities using CK-SAFT and PC-SAFT equations

Ilić-Pajić, Jovana; Stijepović, Mirko Z.; Ivaniš, Gorica; Radović, Ivona; Stajić-Trošić, Jasna; Kijevčanin, Mirjana

(Belgrade : Serbian Chemical Society, 2018)

TY  - JOUR
AU  - Ilić-Pajić, Jovana
AU  - Stijepović, Mirko Z.
AU  - Ivaniš, Gorica
AU  - Radović, Ivona
AU  - Stajić-Trošić, Jasna
AU  - Kijevčanin, Mirjana
PY  - 2018
UR  - https://cer.ihtm.bg.ac.rs/handle/123456789/2334
AB  - SAFT equations of state have been widely used for the determination of different thermo-physical and phase equilibria properties. In order to use these equations as predictive models it is necessary to calculate the model parameters. In this work CK-SAFT and PC-SAFT equations of state were applied for the correlation of pure compounds densities in the wide ranges of temperature and pressure (288.15-413.15 K and 0.1-60 MPa, respectively). The calculations of densities for n-hexane, n-heptane, n-octane, toluene, dichloromethane and ethanol, under high pressure conditions, were performed with the new sets of parameters determined in this paper by CK-SAFT and PC-SAFT. Very good agreement between experimental and calculated density values was achieved, having absolute average percentage deviations lower than 0.5 %.
AB  - SAFT једначине стања се веома често користе за одређивање различитих термофизичких својстава, као и у описивању различитих равнотежа фаза. Да би се ови модели могли користити у предвиђању термодинамичких величина неопходно је претходно одредити параметре модела. У овом раду су коришћене CK-SAFT и PC-SAFT једначине
стања за одређивање густина чистих компонената у широком опсегу температура и притисака (288,15–413,15 K, односно 0,1–60 MPa). Прорачун густина n-хексана, n-хептана,
n-октана, толуена, дихлорметана и етанола је извршен на високим притисцима са сетовима параметара одређених у овом раду помоћу наведених CK-SAFT и PC-SAFT модела. 
Коришћењем добијених параметара постигнути су веома добри резултати са апсолутним средњим процентуалним грешкама мањим од 0,5 %.
PB  - Belgrade : Serbian Chemical Society
T2  - Journal of the Serbian Chemical Society
T1  - Modelling of pure components high pressures densities using CK-SAFT and PC-SAFT equations
T1  - Моделовање густина чистих компонената на високим притисцима применом ck-saft и pc-saft једначина стања
VL  - 83
IS  - 3
SP  - 331
EP  - 343
DO  - 10.2298/JSC170613096P
ER  - 
@article{
author = "Ilić-Pajić, Jovana and Stijepović, Mirko Z. and Ivaniš, Gorica and Radović, Ivona and Stajić-Trošić, Jasna and Kijevčanin, Mirjana",
year = "2018",
abstract = "SAFT equations of state have been widely used for the determination of different thermo-physical and phase equilibria properties. In order to use these equations as predictive models it is necessary to calculate the model parameters. In this work CK-SAFT and PC-SAFT equations of state were applied for the correlation of pure compounds densities in the wide ranges of temperature and pressure (288.15-413.15 K and 0.1-60 MPa, respectively). The calculations of densities for n-hexane, n-heptane, n-octane, toluene, dichloromethane and ethanol, under high pressure conditions, were performed with the new sets of parameters determined in this paper by CK-SAFT and PC-SAFT. Very good agreement between experimental and calculated density values was achieved, having absolute average percentage deviations lower than 0.5 %., SAFT једначине стања се веома често користе за одређивање различитих термофизичких својстава, као и у описивању различитих равнотежа фаза. Да би се ови модели могли користити у предвиђању термодинамичких величина неопходно је претходно одредити параметре модела. У овом раду су коришћене CK-SAFT и PC-SAFT једначине
стања за одређивање густина чистих компонената у широком опсегу температура и притисака (288,15–413,15 K, односно 0,1–60 MPa). Прорачун густина n-хексана, n-хептана,
n-октана, толуена, дихлорметана и етанола је извршен на високим притисцима са сетовима параметара одређених у овом раду помоћу наведених CK-SAFT и PC-SAFT модела. 
Коришћењем добијених параметара постигнути су веома добри резултати са апсолутним средњим процентуалним грешкама мањим од 0,5 %.",
publisher = "Belgrade : Serbian Chemical Society",
journal = "Journal of the Serbian Chemical Society",
title = "Modelling of pure components high pressures densities using CK-SAFT and PC-SAFT equations, Моделовање густина чистих компонената на високим притисцима применом ck-saft и pc-saft једначина стања",
volume = "83",
number = "3",
pages = "331-343",
doi = "10.2298/JSC170613096P"
}
Ilić-Pajić, J., Stijepović, M. Z., Ivaniš, G., Radović, I., Stajić-Trošić, J.,& Kijevčanin, M.. (2018). Modelling of pure components high pressures densities using CK-SAFT and PC-SAFT equations. in Journal of the Serbian Chemical Society
Belgrade : Serbian Chemical Society., 83(3), 331-343.
https://doi.org/10.2298/JSC170613096P
Ilić-Pajić J, Stijepović MZ, Ivaniš G, Radović I, Stajić-Trošić J, Kijevčanin M. Modelling of pure components high pressures densities using CK-SAFT and PC-SAFT equations. in Journal of the Serbian Chemical Society. 2018;83(3):331-343.
doi:10.2298/JSC170613096P .
Ilić-Pajić, Jovana, Stijepović, Mirko Z., Ivaniš, Gorica, Radović, Ivona, Stajić-Trošić, Jasna, Kijevčanin, Mirjana, "Modelling of pure components high pressures densities using CK-SAFT and PC-SAFT equations" in Journal of the Serbian Chemical Society, 83, no. 3 (2018):331-343,
https://doi.org/10.2298/JSC170613096P . .
1
1

Modeling a Reaction Section of a Commercial Continuous Catalytic Reformer

Polovina, Saša; Vojtech, Merva; Dejanovic, Igor; Grujić, Aleksandar; Stijepović, Mirko Z.

(American Chemical Society (ACS), 2018)

TY  - JOUR
AU  - Polovina, Saša
AU  - Vojtech, Merva
AU  - Dejanovic, Igor
AU  - Grujić, Aleksandar
AU  - Stijepović, Mirko Z.
PY  - 2018
UR  - https://cer.ihtm.bg.ac.rs/handle/123456789/2302
AB  - Continuous catalytic reforming (CCR) is known to convert refinery naphtha to a high-octane liquid product, also known as the reformate. In this paper, a First Principle Reaction Section Model for a CCR process is presented. Even though CCR is a well-established technology, the application of advanced, real-time optimization techniques that are able to quickly respond to any imposed changes onto the process, are necessary in the refinery business. This becomes particularly important as a result of changes in profit margin, changes in operating cost, and the introduction of new environmental legislations. Hence, we present a kinetic model for the CCR process using the so-called "lumped" concept. The reactors have been modeled using a quasi-steady-state approach. The unknown model parameters have been estimated by bench marking the First Principle Reaction Section results with a commercial CCR process owned by the Hungarian Oil and Gas Public Limited Company (INA-MOL). The proposed model has been tested and compared to data obtained from an existing CCR plant. The predictions of the model were found to be in good agreement with the experimental data. The relative absolute errors between the measured and model estimated variables have been found to be lower than 2%. The relative absolute error associated with the required fired heater duties were less than 1.0%. Simulating the reaction section of the CCR process requires less than 0.1 s of CPU time, which clearly indicates that this model can be very suitable for performing optimization studies. Moreover, this study shows that, although there is fluctuation in the composition of feedstock, the lumped kinetic approach was capable to predict the behavior of the CCR process well.
PB  - American Chemical Society (ACS)
T2  - Energy & Fuels
T1  - Modeling a Reaction Section of a Commercial Continuous Catalytic Reformer
VL  - 32
IS  - 5
SP  - 6378
EP  - 6396
DO  - 10.1021/acs.energyfuels.7b03897
ER  - 
@article{
author = "Polovina, Saša and Vojtech, Merva and Dejanovic, Igor and Grujić, Aleksandar and Stijepović, Mirko Z.",
year = "2018",
abstract = "Continuous catalytic reforming (CCR) is known to convert refinery naphtha to a high-octane liquid product, also known as the reformate. In this paper, a First Principle Reaction Section Model for a CCR process is presented. Even though CCR is a well-established technology, the application of advanced, real-time optimization techniques that are able to quickly respond to any imposed changes onto the process, are necessary in the refinery business. This becomes particularly important as a result of changes in profit margin, changes in operating cost, and the introduction of new environmental legislations. Hence, we present a kinetic model for the CCR process using the so-called "lumped" concept. The reactors have been modeled using a quasi-steady-state approach. The unknown model parameters have been estimated by bench marking the First Principle Reaction Section results with a commercial CCR process owned by the Hungarian Oil and Gas Public Limited Company (INA-MOL). The proposed model has been tested and compared to data obtained from an existing CCR plant. The predictions of the model were found to be in good agreement with the experimental data. The relative absolute errors between the measured and model estimated variables have been found to be lower than 2%. The relative absolute error associated with the required fired heater duties were less than 1.0%. Simulating the reaction section of the CCR process requires less than 0.1 s of CPU time, which clearly indicates that this model can be very suitable for performing optimization studies. Moreover, this study shows that, although there is fluctuation in the composition of feedstock, the lumped kinetic approach was capable to predict the behavior of the CCR process well.",
publisher = "American Chemical Society (ACS)",
journal = "Energy & Fuels",
title = "Modeling a Reaction Section of a Commercial Continuous Catalytic Reformer",
volume = "32",
number = "5",
pages = "6378-6396",
doi = "10.1021/acs.energyfuels.7b03897"
}
Polovina, S., Vojtech, M., Dejanovic, I., Grujić, A.,& Stijepović, M. Z.. (2018). Modeling a Reaction Section of a Commercial Continuous Catalytic Reformer. in Energy & Fuels
American Chemical Society (ACS)., 32(5), 6378-6396.
https://doi.org/10.1021/acs.energyfuels.7b03897
Polovina S, Vojtech M, Dejanovic I, Grujić A, Stijepović MZ. Modeling a Reaction Section of a Commercial Continuous Catalytic Reformer. in Energy & Fuels. 2018;32(5):6378-6396.
doi:10.1021/acs.energyfuels.7b03897 .
Polovina, Saša, Vojtech, Merva, Dejanovic, Igor, Grujić, Aleksandar, Stijepović, Mirko Z., "Modeling a Reaction Section of a Commercial Continuous Catalytic Reformer" in Energy & Fuels, 32, no. 5 (2018):6378-6396,
https://doi.org/10.1021/acs.energyfuels.7b03897 . .
12
6
11

Modeling a Reaction Section of a Commercial Continuous Catalytic Reformer

Polovina, Saša; Vojtech, Merva; Dejanovic, Igor; Grujić, Aleksandar; Stijepović, Mirko Z.

(American Chemical Society (ACS), 2018)

TY  - JOUR
AU  - Polovina, Saša
AU  - Vojtech, Merva
AU  - Dejanovic, Igor
AU  - Grujić, Aleksandar
AU  - Stijepović, Mirko Z.
PY  - 2018
UR  - https://cer.ihtm.bg.ac.rs/handle/123456789/4287
AB  - Continuous catalytic reforming (CCR) is known to convert refinery naphtha to a high-octane liquid product, also known as the reformate. In this paper, a First Principle Reaction Section Model for a CCR process is presented. Even though CCR is a well-established technology, the application of advanced, real-time optimization techniques that are able to quickly respond to any imposed changes onto the process, are necessary in the refinery business. This becomes particularly important as a result of changes in profit margin, changes in operating cost, and the introduction of new environmental legislations. Hence, we present a kinetic model for the CCR process using the so-called "lumped" concept. The reactors have been modeled using a quasi-steady-state approach. The unknown model parameters have been estimated by bench marking the First Principle Reaction Section results with a commercial CCR process owned by the Hungarian Oil and Gas Public Limited Company (INA-MOL). The proposed model has been tested and compared to data obtained from an existing CCR plant. The predictions of the model were found to be in good agreement with the experimental data. The relative absolute errors between the measured and model estimated variables have been found to be lower than 2%. The relative absolute error associated with the required fired heater duties were less than 1.0%. Simulating the reaction section of the CCR process requires less than 0.1 s of CPU time, which clearly indicates that this model can be very suitable for performing optimization studies. Moreover, this study shows that, although there is fluctuation in the composition of feedstock, the lumped kinetic approach was capable to predict the behavior of the CCR process well.
PB  - American Chemical Society (ACS)
T2  - Energy & Fuels
T1  - Modeling a Reaction Section of a Commercial Continuous Catalytic Reformer
VL  - 32
IS  - 5
SP  - 6378
EP  - 6396
DO  - 10.1021/acs.energyfuels.7b03897
ER  - 
@article{
author = "Polovina, Saša and Vojtech, Merva and Dejanovic, Igor and Grujić, Aleksandar and Stijepović, Mirko Z.",
year = "2018",
abstract = "Continuous catalytic reforming (CCR) is known to convert refinery naphtha to a high-octane liquid product, also known as the reformate. In this paper, a First Principle Reaction Section Model for a CCR process is presented. Even though CCR is a well-established technology, the application of advanced, real-time optimization techniques that are able to quickly respond to any imposed changes onto the process, are necessary in the refinery business. This becomes particularly important as a result of changes in profit margin, changes in operating cost, and the introduction of new environmental legislations. Hence, we present a kinetic model for the CCR process using the so-called "lumped" concept. The reactors have been modeled using a quasi-steady-state approach. The unknown model parameters have been estimated by bench marking the First Principle Reaction Section results with a commercial CCR process owned by the Hungarian Oil and Gas Public Limited Company (INA-MOL). The proposed model has been tested and compared to data obtained from an existing CCR plant. The predictions of the model were found to be in good agreement with the experimental data. The relative absolute errors between the measured and model estimated variables have been found to be lower than 2%. The relative absolute error associated with the required fired heater duties were less than 1.0%. Simulating the reaction section of the CCR process requires less than 0.1 s of CPU time, which clearly indicates that this model can be very suitable for performing optimization studies. Moreover, this study shows that, although there is fluctuation in the composition of feedstock, the lumped kinetic approach was capable to predict the behavior of the CCR process well.",
publisher = "American Chemical Society (ACS)",
journal = "Energy & Fuels",
title = "Modeling a Reaction Section of a Commercial Continuous Catalytic Reformer",
volume = "32",
number = "5",
pages = "6378-6396",
doi = "10.1021/acs.energyfuels.7b03897"
}
Polovina, S., Vojtech, M., Dejanovic, I., Grujić, A.,& Stijepović, M. Z.. (2018). Modeling a Reaction Section of a Commercial Continuous Catalytic Reformer. in Energy & Fuels
American Chemical Society (ACS)., 32(5), 6378-6396.
https://doi.org/10.1021/acs.energyfuels.7b03897
Polovina S, Vojtech M, Dejanovic I, Grujić A, Stijepović MZ. Modeling a Reaction Section of a Commercial Continuous Catalytic Reformer. in Energy & Fuels. 2018;32(5):6378-6396.
doi:10.1021/acs.energyfuels.7b03897 .
Polovina, Saša, Vojtech, Merva, Dejanovic, Igor, Grujić, Aleksandar, Stijepović, Mirko Z., "Modeling a Reaction Section of a Commercial Continuous Catalytic Reformer" in Energy & Fuels, 32, no. 5 (2018):6378-6396,
https://doi.org/10.1021/acs.energyfuels.7b03897 . .
12
6
11

Targeting heat recovery and reuse in industrial zone

Zarić, Milana; Stijepović, Mirko Z.; Linke, Patrick; Stajić-Trošić, Jasna; Bugarski, Branko; Kijevčanin, Mirjana

(Association of the Chemical Engineers of Serbia, 2017)

TY  - JOUR
AU  - Zarić, Milana
AU  - Stijepović, Mirko Z.
AU  - Linke, Patrick
AU  - Stajić-Trošić, Jasna
AU  - Bugarski, Branko
AU  - Kijevčanin, Mirjana
PY  - 2017
UR  - https://cer.ihtm.bg.ac.rs/handle/123456789/2235
AB  - In order to reduce the usage of fossil fuels in industrial sectors by meeting the requirements of production processes, new heat integration and heat recovery approaches are developed. The goal of this study is to develop an approach to increase energy efficiency of an industrial zone by recovering and reusing waste heat via indirect heat integration. Industrial zones usually consist of multiple independent plants, where each plant is supplied by an independent utility system, as a decentralized system. In this study, a new approach is developed to target minimum energy requirements where an industrial zone would be supplied by a centralized utility system instead of decentralized utility system. The approach assumes that all process plants in an industrial zone are linked through the central utility system. This method is formulated as a linear programming problem (LP). Moreover, the proposed method may be used for decision making related to energy integration strategy of an industrial zone. In addition, the proposed method was applied on a case study. The results revealed that saving of fossil fuel could be achieved.
PB  - Association of the Chemical Engineers of Serbia
T2  - Chemical Industry and Chemical Engineering Quarterly / CICEQ
T1  - Targeting heat recovery and reuse in industrial zone
VL  - 23
IS  - 1
SP  - 73
EP  - 82
DO  - 10.2298/CICEQ150622009Z
ER  - 
@article{
author = "Zarić, Milana and Stijepović, Mirko Z. and Linke, Patrick and Stajić-Trošić, Jasna and Bugarski, Branko and Kijevčanin, Mirjana",
year = "2017",
abstract = "In order to reduce the usage of fossil fuels in industrial sectors by meeting the requirements of production processes, new heat integration and heat recovery approaches are developed. The goal of this study is to develop an approach to increase energy efficiency of an industrial zone by recovering and reusing waste heat via indirect heat integration. Industrial zones usually consist of multiple independent plants, where each plant is supplied by an independent utility system, as a decentralized system. In this study, a new approach is developed to target minimum energy requirements where an industrial zone would be supplied by a centralized utility system instead of decentralized utility system. The approach assumes that all process plants in an industrial zone are linked through the central utility system. This method is formulated as a linear programming problem (LP). Moreover, the proposed method may be used for decision making related to energy integration strategy of an industrial zone. In addition, the proposed method was applied on a case study. The results revealed that saving of fossil fuel could be achieved.",
publisher = "Association of the Chemical Engineers of Serbia",
journal = "Chemical Industry and Chemical Engineering Quarterly / CICEQ",
title = "Targeting heat recovery and reuse in industrial zone",
volume = "23",
number = "1",
pages = "73-82",
doi = "10.2298/CICEQ150622009Z"
}
Zarić, M., Stijepović, M. Z., Linke, P., Stajić-Trošić, J., Bugarski, B.,& Kijevčanin, M.. (2017). Targeting heat recovery and reuse in industrial zone. in Chemical Industry and Chemical Engineering Quarterly / CICEQ
Association of the Chemical Engineers of Serbia., 23(1), 73-82.
https://doi.org/10.2298/CICEQ150622009Z
Zarić M, Stijepović MZ, Linke P, Stajić-Trošić J, Bugarski B, Kijevčanin M. Targeting heat recovery and reuse in industrial zone. in Chemical Industry and Chemical Engineering Quarterly / CICEQ. 2017;23(1):73-82.
doi:10.2298/CICEQ150622009Z .
Zarić, Milana, Stijepović, Mirko Z., Linke, Patrick, Stajić-Trošić, Jasna, Bugarski, Branko, Kijevčanin, Mirjana, "Targeting heat recovery and reuse in industrial zone" in Chemical Industry and Chemical Engineering Quarterly / CICEQ, 23, no. 1 (2017):73-82,
https://doi.org/10.2298/CICEQ150622009Z . .
4
2
3

Best methods for calculating interaction energies in 2-butene and butane systems

Zarić, Milana; Bugarski, Branko; Kijevčanin, Mirjana

(Elsevier, 2017)

TY  - JOUR
AU  - Zarić, Milana
AU  - Bugarski, Branko
AU  - Kijevčanin, Mirjana
PY  - 2017
UR  - https://cer.ihtm.bg.ac.rs/handle/123456789/2155
AB  - Benchmarking study on eighteen methods, including MP2, B2PLYP-D3, B2PLYP-D3BJ, coB97xD, M05-D3, M06-D3, M052X-D3, M061-1F-D3, PBEO-D3, PBEO-D3BJ, B3LYP-D3, B3LYP-D3DJ, TPSS-D3, TPSS-D3BJ, BP86-D3, BP86-D3BJ, BLYP-D3, BLYP-D3BJ and ten basis sets: cc-pVDZ, cc-pVTZ, aug-cc-pVDZ, cc-pVQZ, def2-SVP, def2-TZVP, def2-TZVPP, def2-QZVP, 6-311++G" and 6-31G", for each method, have been performed, calculating interaction energies in (1) unsaturated/unsaturated systems (2-butene dimers), (2) unsaturated/saturated system (between butane and 2-butene) and (3) saturated/saturated (butane dimers). The calculated interaction energies are compared with accurate CCSD(T)/CBS energies. The data show that most levels of theory have the highest errors for systems with butane dimers, and calculated interaction energies in these systems are overestimated. The best levels, overall for all systems, are BLYP-D3BJ/clef2-QZVP and BLYP-D3BJ/cc-pVQZ with similar root mean square deviation (RMSD) values of 0.056 kcal mo1-1 and 0.060 kcalmorl compared to CCSD(T) values. The best level for (1) 2-butene dimers is B3LYP-D3BJ/aug-cc-pVDZ; for (2) interactions between 2-butene and butane is BLYP-D3BJ/def2-SVP; while for (3) butane dimers is BLYP-D3BJ/def2-QZVP. The differences in calculated energies among several methods are not high, however, it is important that most of the DFT methods overestimate interactions in butane dimers.
PB  - Elsevier
T2  - Computational and Theoretical Chemistry
T1  - Best methods for calculating interaction energies in 2-butene and butane systems
VL  - 1117
SP  - 150
EP  - 161
DO  - 10.1016/j.comptc.2017.08.001
ER  - 
@article{
author = "Zarić, Milana and Bugarski, Branko and Kijevčanin, Mirjana",
year = "2017",
abstract = "Benchmarking study on eighteen methods, including MP2, B2PLYP-D3, B2PLYP-D3BJ, coB97xD, M05-D3, M06-D3, M052X-D3, M061-1F-D3, PBEO-D3, PBEO-D3BJ, B3LYP-D3, B3LYP-D3DJ, TPSS-D3, TPSS-D3BJ, BP86-D3, BP86-D3BJ, BLYP-D3, BLYP-D3BJ and ten basis sets: cc-pVDZ, cc-pVTZ, aug-cc-pVDZ, cc-pVQZ, def2-SVP, def2-TZVP, def2-TZVPP, def2-QZVP, 6-311++G" and 6-31G", for each method, have been performed, calculating interaction energies in (1) unsaturated/unsaturated systems (2-butene dimers), (2) unsaturated/saturated system (between butane and 2-butene) and (3) saturated/saturated (butane dimers). The calculated interaction energies are compared with accurate CCSD(T)/CBS energies. The data show that most levels of theory have the highest errors for systems with butane dimers, and calculated interaction energies in these systems are overestimated. The best levels, overall for all systems, are BLYP-D3BJ/clef2-QZVP and BLYP-D3BJ/cc-pVQZ with similar root mean square deviation (RMSD) values of 0.056 kcal mo1-1 and 0.060 kcalmorl compared to CCSD(T) values. The best level for (1) 2-butene dimers is B3LYP-D3BJ/aug-cc-pVDZ; for (2) interactions between 2-butene and butane is BLYP-D3BJ/def2-SVP; while for (3) butane dimers is BLYP-D3BJ/def2-QZVP. The differences in calculated energies among several methods are not high, however, it is important that most of the DFT methods overestimate interactions in butane dimers.",
publisher = "Elsevier",
journal = "Computational and Theoretical Chemistry",
title = "Best methods for calculating interaction energies in 2-butene and butane systems",
volume = "1117",
pages = "150-161",
doi = "10.1016/j.comptc.2017.08.001"
}
Zarić, M., Bugarski, B.,& Kijevčanin, M.. (2017). Best methods for calculating interaction energies in 2-butene and butane systems. in Computational and Theoretical Chemistry
Elsevier., 1117, 150-161.
https://doi.org/10.1016/j.comptc.2017.08.001
Zarić M, Bugarski B, Kijevčanin M. Best methods for calculating interaction energies in 2-butene and butane systems. in Computational and Theoretical Chemistry. 2017;1117:150-161.
doi:10.1016/j.comptc.2017.08.001 .
Zarić, Milana, Bugarski, Branko, Kijevčanin, Mirjana, "Best methods for calculating interaction energies in 2-butene and butane systems" in Computational and Theoretical Chemistry, 1117 (2017):150-161,
https://doi.org/10.1016/j.comptc.2017.08.001 . .
3
1
3

Best methods for calculating interaction energies in 2-butene and butane systems

Zarić, Milana; Bugarski, Branko; Kijevčanin, Mirjana

(Elsevier, 2017)

TY  - JOUR
AU  - Zarić, Milana
AU  - Bugarski, Branko
AU  - Kijevčanin, Mirjana
PY  - 2017
UR  - https://cer.ihtm.bg.ac.rs/handle/123456789/3034
AB  - Benchmarking study on eighteen methods, including MP2, B2PLYP-D3, B2PLYP-D3BJ, coB97xD, M05-D3, M06-D3, M052X-D3, M061-1F-D3, PBEO-D3, PBEO-D3BJ, B3LYP-D3, B3LYP-D3DJ, TPSS-D3, TPSS-D3BJ, BP86-D3, BP86-D3BJ, BLYP-D3, BLYP-D3BJ and ten basis sets: cc-pVDZ, cc-pVTZ, aug-cc-pVDZ, cc-pVQZ, def2-SVP, def2-TZVP, def2-TZVPP, def2-QZVP, 6-311++G" and 6-31G", for each method, have been performed, calculating interaction energies in (1) unsaturated/unsaturated systems (2-butene dimers), (2) unsaturated/saturated system (between butane and 2-butene) and (3) saturated/saturated (butane dimers). The calculated interaction energies are compared with accurate CCSD(T)/CBS energies. The data show that most levels of theory have the highest errors for systems with butane dimers, and calculated interaction energies in these systems are overestimated. The best levels, overall for all systems, are BLYP-D3BJ/clef2-QZVP and BLYP-D3BJ/cc-pVQZ with similar root mean square deviation (RMSD) values of 0.056 kcal mo1-1 and 0.060 kcalmorl compared to CCSD(T) values. The best level for (1) 2-butene dimers is B3LYP-D3BJ/aug-cc-pVDZ; for (2) interactions between 2-butene and butane is BLYP-D3BJ/def2-SVP; while for (3) butane dimers is BLYP-D3BJ/def2-QZVP. The differences in calculated energies among several methods are not high, however, it is important that most of the DFT methods overestimate interactions in butane dimers.
PB  - Elsevier
T2  - Computational and Theoretical Chemistry
T1  - Best methods for calculating interaction energies in 2-butene and butane systems
VL  - 1117
SP  - 150
EP  - 161
DO  - 10.1016/j.comptc.2017.08.001
ER  - 
@article{
author = "Zarić, Milana and Bugarski, Branko and Kijevčanin, Mirjana",
year = "2017",
abstract = "Benchmarking study on eighteen methods, including MP2, B2PLYP-D3, B2PLYP-D3BJ, coB97xD, M05-D3, M06-D3, M052X-D3, M061-1F-D3, PBEO-D3, PBEO-D3BJ, B3LYP-D3, B3LYP-D3DJ, TPSS-D3, TPSS-D3BJ, BP86-D3, BP86-D3BJ, BLYP-D3, BLYP-D3BJ and ten basis sets: cc-pVDZ, cc-pVTZ, aug-cc-pVDZ, cc-pVQZ, def2-SVP, def2-TZVP, def2-TZVPP, def2-QZVP, 6-311++G" and 6-31G", for each method, have been performed, calculating interaction energies in (1) unsaturated/unsaturated systems (2-butene dimers), (2) unsaturated/saturated system (between butane and 2-butene) and (3) saturated/saturated (butane dimers). The calculated interaction energies are compared with accurate CCSD(T)/CBS energies. The data show that most levels of theory have the highest errors for systems with butane dimers, and calculated interaction energies in these systems are overestimated. The best levels, overall for all systems, are BLYP-D3BJ/clef2-QZVP and BLYP-D3BJ/cc-pVQZ with similar root mean square deviation (RMSD) values of 0.056 kcal mo1-1 and 0.060 kcalmorl compared to CCSD(T) values. The best level for (1) 2-butene dimers is B3LYP-D3BJ/aug-cc-pVDZ; for (2) interactions between 2-butene and butane is BLYP-D3BJ/def2-SVP; while for (3) butane dimers is BLYP-D3BJ/def2-QZVP. The differences in calculated energies among several methods are not high, however, it is important that most of the DFT methods overestimate interactions in butane dimers.",
publisher = "Elsevier",
journal = "Computational and Theoretical Chemistry",
title = "Best methods for calculating interaction energies in 2-butene and butane systems",
volume = "1117",
pages = "150-161",
doi = "10.1016/j.comptc.2017.08.001"
}
Zarić, M., Bugarski, B.,& Kijevčanin, M.. (2017). Best methods for calculating interaction energies in 2-butene and butane systems. in Computational and Theoretical Chemistry
Elsevier., 1117, 150-161.
https://doi.org/10.1016/j.comptc.2017.08.001
Zarić M, Bugarski B, Kijevčanin M. Best methods for calculating interaction energies in 2-butene and butane systems. in Computational and Theoretical Chemistry. 2017;1117:150-161.
doi:10.1016/j.comptc.2017.08.001 .
Zarić, Milana, Bugarski, Branko, Kijevčanin, Mirjana, "Best methods for calculating interaction energies in 2-butene and butane systems" in Computational and Theoretical Chemistry, 1117 (2017):150-161,
https://doi.org/10.1016/j.comptc.2017.08.001 . .
3
1
3

Experimental investigation and modeling of thermophysical and extraction properties of choline chloride plus DL-malic acid based deep eutectic solvent

Vuksanovic, Jelena M.; Todorović, Nina; Kijevčanin, Mirjana; Serbanovic, Slobodan P.; Radović, Ivona

(Serbian Chemical Society, 2017)

TY  - JOUR
AU  - Vuksanovic, Jelena M.
AU  - Todorović, Nina
AU  - Kijevčanin, Mirjana
AU  - Serbanovic, Slobodan P.
AU  - Radović, Ivona
PY  - 2017
UR  - https://cer.ihtm.bg.ac.rs/handle/123456789/2114
AB  - The ability of non-toxic and biodegradable deep eutectic solvent (DES) choline chloride + DL-malic acid in mole ratio 1: 1, for the breaking of the azeotropes heptane + methanol and toluene + methanol by means of liquid-liquid extraction was evaluated. Ternary liquid-liquid equilibrium experiments were performed at 298.15 K and at atmospheric pressure. Densities, viscosities and refractive indices of DES + methanol and water + DES systems were experimentally determined over a wide temperature range and at atmospheric pressure. Additionally, the viscosities of DES + glycerol mixture were determined at temperatures up to 363.15 K to check how much the addition of glycerol decreases high viscosities of DES. The results indicate that the addition of small amounts of water or glycerol as a third component significantly decreases the viscosity of the investigated deep eutectic solvent. Based on the selectivity and distribution ratio values, the extraction ability of the investigated deep eutectic solvent, in comparison with the conventionally used solvents, yields promising results. Non-random two-liquid (NRTL) and universal quasichemical (UNIQUAC) models were satisfactorily applied for correlation of experimental phase equilibrium data for two ternary mixtures.
PB  - Serbian Chemical Society
T2  - Journal of the Serbian Chemical Society
T1  - Experimental investigation and modeling of thermophysical and extraction properties of choline chloride plus DL-malic acid based deep eutectic solvent
VL  - 82
IS  - 11
SP  - 1287
EP  - 1302
DO  - 10.2298/JSC170316054V
ER  - 
@article{
author = "Vuksanovic, Jelena M. and Todorović, Nina and Kijevčanin, Mirjana and Serbanovic, Slobodan P. and Radović, Ivona",
year = "2017",
abstract = "The ability of non-toxic and biodegradable deep eutectic solvent (DES) choline chloride + DL-malic acid in mole ratio 1: 1, for the breaking of the azeotropes heptane + methanol and toluene + methanol by means of liquid-liquid extraction was evaluated. Ternary liquid-liquid equilibrium experiments were performed at 298.15 K and at atmospheric pressure. Densities, viscosities and refractive indices of DES + methanol and water + DES systems were experimentally determined over a wide temperature range and at atmospheric pressure. Additionally, the viscosities of DES + glycerol mixture were determined at temperatures up to 363.15 K to check how much the addition of glycerol decreases high viscosities of DES. The results indicate that the addition of small amounts of water or glycerol as a third component significantly decreases the viscosity of the investigated deep eutectic solvent. Based on the selectivity and distribution ratio values, the extraction ability of the investigated deep eutectic solvent, in comparison with the conventionally used solvents, yields promising results. Non-random two-liquid (NRTL) and universal quasichemical (UNIQUAC) models were satisfactorily applied for correlation of experimental phase equilibrium data for two ternary mixtures.",
publisher = "Serbian Chemical Society",
journal = "Journal of the Serbian Chemical Society",
title = "Experimental investigation and modeling of thermophysical and extraction properties of choline chloride plus DL-malic acid based deep eutectic solvent",
volume = "82",
number = "11",
pages = "1287-1302",
doi = "10.2298/JSC170316054V"
}
Vuksanovic, J. M., Todorović, N., Kijevčanin, M., Serbanovic, S. P.,& Radović, I.. (2017). Experimental investigation and modeling of thermophysical and extraction properties of choline chloride plus DL-malic acid based deep eutectic solvent. in Journal of the Serbian Chemical Society
Serbian Chemical Society., 82(11), 1287-1302.
https://doi.org/10.2298/JSC170316054V
Vuksanovic JM, Todorović N, Kijevčanin M, Serbanovic SP, Radović I. Experimental investigation and modeling of thermophysical and extraction properties of choline chloride plus DL-malic acid based deep eutectic solvent. in Journal of the Serbian Chemical Society. 2017;82(11):1287-1302.
doi:10.2298/JSC170316054V .
Vuksanovic, Jelena M., Todorović, Nina, Kijevčanin, Mirjana, Serbanovic, Slobodan P., Radović, Ivona, "Experimental investigation and modeling of thermophysical and extraction properties of choline chloride plus DL-malic acid based deep eutectic solvent" in Journal of the Serbian Chemical Society, 82, no. 11 (2017):1287-1302,
https://doi.org/10.2298/JSC170316054V . .
7
4
8

Targeting and Design of Organic Rankine Cycle Systems for Multiple Heat Sources with Simultaneous Working Fluid Selection

Stijcpovic, Mirko Z.; Papadopoulos, Athanasios I.; Linke, Patrick; Stijepović, Vladimir; Grujić, Aleksandar; Kijevčanin, Mirjana; Seferlis, Panos

(Elsevier, 2017)

TY  - CONF
AU  - Stijcpovic, Mirko Z.
AU  - Papadopoulos, Athanasios I.
AU  - Linke, Patrick
AU  - Stijepović, Vladimir
AU  - Grujić, Aleksandar
AU  - Kijevčanin, Mirjana
AU  - Seferlis, Panos
PY  - 2017
UR  - https://cer.ihtm.bg.ac.rs/handle/123456789/2119
AB  - We propose a systematic model for the optimum design of Organic Rankine Cycles (ORC) used for power generation from multiple heat sources available at different temperatures. The model enables the automated generation of inclusive and flexible ORC cascades and is optimized using a global optimization algorithm. Design parameters include the number of ORC cascades, the shared structure of the heat exchanger network, the operating conditions and the working fluid used in each cascade in order to identify an overall ORC structure that maximizes the power output. Results indicate significant operating improvements from using a double ORC cascade with different working fluids.
PB  - Elsevier
C3  - 27th European Symposium on Computer Aided Process Engineering, Pt A
T1  - Targeting and Design of Organic Rankine Cycle Systems for Multiple Heat Sources with Simultaneous Working Fluid Selection
SP  - 769
EP  - 774
DO  - 10.1016/B978-0-444-63965-3.50130-6
ER  - 
@conference{
author = "Stijcpovic, Mirko Z. and Papadopoulos, Athanasios I. and Linke, Patrick and Stijepović, Vladimir and Grujić, Aleksandar and Kijevčanin, Mirjana and Seferlis, Panos",
year = "2017",
abstract = "We propose a systematic model for the optimum design of Organic Rankine Cycles (ORC) used for power generation from multiple heat sources available at different temperatures. The model enables the automated generation of inclusive and flexible ORC cascades and is optimized using a global optimization algorithm. Design parameters include the number of ORC cascades, the shared structure of the heat exchanger network, the operating conditions and the working fluid used in each cascade in order to identify an overall ORC structure that maximizes the power output. Results indicate significant operating improvements from using a double ORC cascade with different working fluids.",
publisher = "Elsevier",
journal = "27th European Symposium on Computer Aided Process Engineering, Pt A",
title = "Targeting and Design of Organic Rankine Cycle Systems for Multiple Heat Sources with Simultaneous Working Fluid Selection",
pages = "769-774",
doi = "10.1016/B978-0-444-63965-3.50130-6"
}
Stijcpovic, M. Z., Papadopoulos, A. I., Linke, P., Stijepović, V., Grujić, A., Kijevčanin, M.,& Seferlis, P.. (2017). Targeting and Design of Organic Rankine Cycle Systems for Multiple Heat Sources with Simultaneous Working Fluid Selection. in 27th European Symposium on Computer Aided Process Engineering, Pt A
Elsevier., 769-774.
https://doi.org/10.1016/B978-0-444-63965-3.50130-6
Stijcpovic MZ, Papadopoulos AI, Linke P, Stijepović V, Grujić A, Kijevčanin M, Seferlis P. Targeting and Design of Organic Rankine Cycle Systems for Multiple Heat Sources with Simultaneous Working Fluid Selection. in 27th European Symposium on Computer Aided Process Engineering, Pt A. 2017;:769-774.
doi:10.1016/B978-0-444-63965-3.50130-6 .
Stijcpovic, Mirko Z., Papadopoulos, Athanasios I., Linke, Patrick, Stijepović, Vladimir, Grujić, Aleksandar, Kijevčanin, Mirjana, Seferlis, Panos, "Targeting and Design of Organic Rankine Cycle Systems for Multiple Heat Sources with Simultaneous Working Fluid Selection" in 27th European Symposium on Computer Aided Process Engineering, Pt A (2017):769-774,
https://doi.org/10.1016/B978-0-444-63965-3.50130-6 . .
1
1
1

Organic Rankine Cycle system performance targeting and design for multiple heat sources with simultaneous working fluid selection

Stijepović, Mirko Z.; Papadopoulos, Athanasios I.; Linke, Patrick; Stijepović, Vladimir; Grujić, Aleksandar; Kijevčanin, Mirjana; Seferlis, Panos

(Elsevier Sci Ltd, Oxford, 2017)

TY  - JOUR
AU  - Stijepović, Mirko Z.
AU  - Papadopoulos, Athanasios I.
AU  - Linke, Patrick
AU  - Stijepović, Vladimir
AU  - Grujić, Aleksandar
AU  - Kijevčanin, Mirjana
AU  - Seferlis, Panos
PY  - 2017
UR  - https://cer.ihtm.bg.ac.rs/handle/123456789/2229
AB  - This work presents a systematic approach toward the design of Organic Rankine Cycles (ORC) for the generation of power from multiple heat sources available at different temperature levels. The design problem is approached in a mixed-integer non-linear programming (MINLP) formulation where an inclusive and flexible ORC model is automatically evolved by a deterministic algorithm for global optimization. The basic building block of the model is the ORC cascade which consists of a heat extraction, a power generation, a condensation and a liquid pressurization section. The aim of the optimization is to determine the optimum number of ORC cascades, the structure of the heat exchanger network shared among different cascades, the operating conditions and the working fluid used in each cascade in order to identify an overall ORC structure that maximizes the power output. The approach is illustrated through a case study which indicates that a system of two waste heat sources is best exploited through two interconnected ORC utilizing different working fluids.
PB  - Elsevier Sci Ltd, Oxford
T2  - Journal of Cleaner Production
T1  - Organic Rankine Cycle system performance targeting and design for multiple heat sources with simultaneous working fluid selection
VL  - 142
SP  - 1950
EP  - 1970
DO  - 10.1016/j.jclepro.2016.11.088
ER  - 
@article{
author = "Stijepović, Mirko Z. and Papadopoulos, Athanasios I. and Linke, Patrick and Stijepović, Vladimir and Grujić, Aleksandar and Kijevčanin, Mirjana and Seferlis, Panos",
year = "2017",
abstract = "This work presents a systematic approach toward the design of Organic Rankine Cycles (ORC) for the generation of power from multiple heat sources available at different temperature levels. The design problem is approached in a mixed-integer non-linear programming (MINLP) formulation where an inclusive and flexible ORC model is automatically evolved by a deterministic algorithm for global optimization. The basic building block of the model is the ORC cascade which consists of a heat extraction, a power generation, a condensation and a liquid pressurization section. The aim of the optimization is to determine the optimum number of ORC cascades, the structure of the heat exchanger network shared among different cascades, the operating conditions and the working fluid used in each cascade in order to identify an overall ORC structure that maximizes the power output. The approach is illustrated through a case study which indicates that a system of two waste heat sources is best exploited through two interconnected ORC utilizing different working fluids.",
publisher = "Elsevier Sci Ltd, Oxford",
journal = "Journal of Cleaner Production",
title = "Organic Rankine Cycle system performance targeting and design for multiple heat sources with simultaneous working fluid selection",
volume = "142",
pages = "1950-1970",
doi = "10.1016/j.jclepro.2016.11.088"
}
Stijepović, M. Z., Papadopoulos, A. I., Linke, P., Stijepović, V., Grujić, A., Kijevčanin, M.,& Seferlis, P.. (2017). Organic Rankine Cycle system performance targeting and design for multiple heat sources with simultaneous working fluid selection. in Journal of Cleaner Production
Elsevier Sci Ltd, Oxford., 142, 1950-1970.
https://doi.org/10.1016/j.jclepro.2016.11.088
Stijepović MZ, Papadopoulos AI, Linke P, Stijepović V, Grujić A, Kijevčanin M, Seferlis P. Organic Rankine Cycle system performance targeting and design for multiple heat sources with simultaneous working fluid selection. in Journal of Cleaner Production. 2017;142:1950-1970.
doi:10.1016/j.jclepro.2016.11.088 .
Stijepović, Mirko Z., Papadopoulos, Athanasios I., Linke, Patrick, Stijepović, Vladimir, Grujić, Aleksandar, Kijevčanin, Mirjana, Seferlis, Panos, "Organic Rankine Cycle system performance targeting and design for multiple heat sources with simultaneous working fluid selection" in Journal of Cleaner Production, 142 (2017):1950-1970,
https://doi.org/10.1016/j.jclepro.2016.11.088 . .
38
22
35

Organic Rankine Cycle system performance targeting and design for multiple heat sources with simultaneous working fluid selection

Stijepović, Mirko Z.; Papadopoulos, Athanasios I.; Linke, Patrick; Stijepović, Vladimir; Grujić, Aleksandar; Kijevčanin, Mirjana; Seferlis, Panos

(Elsevier Sci Ltd, Oxford, 2017)

TY  - JOUR
AU  - Stijepović, Mirko Z.
AU  - Papadopoulos, Athanasios I.
AU  - Linke, Patrick
AU  - Stijepović, Vladimir
AU  - Grujić, Aleksandar
AU  - Kijevčanin, Mirjana
AU  - Seferlis, Panos
PY  - 2017
UR  - https://cer.ihtm.bg.ac.rs/handle/123456789/3032
AB  - This work presents a systematic approach toward the design of Organic Rankine Cycles (ORC) for the generation of power from multiple heat sources available at different temperature levels. The design problem is approached in a mixed-integer non-linear programming (MINLP) formulation where an inclusive and flexible ORC model is automatically evolved by a deterministic algorithm for global optimization. The basic building block of the model is the ORC cascade which consists of a heat extraction, a power generation, a condensation and a liquid pressurization section. The aim of the optimization is to determine the optimum number of ORC cascades, the structure of the heat exchanger network shared among different cascades, the operating conditions and the working fluid used in each cascade in order to identify an overall ORC structure that maximizes the power output. The approach is illustrated through a case study which indicates that a system of two waste heat sources is best exploited through two interconnected ORC utilizing different working fluids.
PB  - Elsevier Sci Ltd, Oxford
T2  - Journal of Cleaner Production
T1  - Organic Rankine Cycle system performance targeting and design for multiple heat sources with simultaneous working fluid selection
VL  - 142
SP  - 1950
EP  - 1970
DO  - 10.1016/j.jclepro.2016.11.088
ER  - 
@article{
author = "Stijepović, Mirko Z. and Papadopoulos, Athanasios I. and Linke, Patrick and Stijepović, Vladimir and Grujić, Aleksandar and Kijevčanin, Mirjana and Seferlis, Panos",
year = "2017",
abstract = "This work presents a systematic approach toward the design of Organic Rankine Cycles (ORC) for the generation of power from multiple heat sources available at different temperature levels. The design problem is approached in a mixed-integer non-linear programming (MINLP) formulation where an inclusive and flexible ORC model is automatically evolved by a deterministic algorithm for global optimization. The basic building block of the model is the ORC cascade which consists of a heat extraction, a power generation, a condensation and a liquid pressurization section. The aim of the optimization is to determine the optimum number of ORC cascades, the structure of the heat exchanger network shared among different cascades, the operating conditions and the working fluid used in each cascade in order to identify an overall ORC structure that maximizes the power output. The approach is illustrated through a case study which indicates that a system of two waste heat sources is best exploited through two interconnected ORC utilizing different working fluids.",
publisher = "Elsevier Sci Ltd, Oxford",
journal = "Journal of Cleaner Production",
title = "Organic Rankine Cycle system performance targeting and design for multiple heat sources with simultaneous working fluid selection",
volume = "142",
pages = "1950-1970",
doi = "10.1016/j.jclepro.2016.11.088"
}
Stijepović, M. Z., Papadopoulos, A. I., Linke, P., Stijepović, V., Grujić, A., Kijevčanin, M.,& Seferlis, P.. (2017). Organic Rankine Cycle system performance targeting and design for multiple heat sources with simultaneous working fluid selection. in Journal of Cleaner Production
Elsevier Sci Ltd, Oxford., 142, 1950-1970.
https://doi.org/10.1016/j.jclepro.2016.11.088
Stijepović MZ, Papadopoulos AI, Linke P, Stijepović V, Grujić A, Kijevčanin M, Seferlis P. Organic Rankine Cycle system performance targeting and design for multiple heat sources with simultaneous working fluid selection. in Journal of Cleaner Production. 2017;142:1950-1970.
doi:10.1016/j.jclepro.2016.11.088 .
Stijepović, Mirko Z., Papadopoulos, Athanasios I., Linke, Patrick, Stijepović, Vladimir, Grujić, Aleksandar, Kijevčanin, Mirjana, Seferlis, Panos, "Organic Rankine Cycle system performance targeting and design for multiple heat sources with simultaneous working fluid selection" in Journal of Cleaner Production, 142 (2017):1950-1970,
https://doi.org/10.1016/j.jclepro.2016.11.088 . .
38
22
36

Benchmark study for 2-butene parallel interactions

Zarić, Milana; Bugarski, Branko; Pavelkić, Vesna; Pantović Pavlović, Marijana; Stevanović, Jasmina; Pavlović, Miroslav; Kijevčanin, Mirjana

(Belgrade, Serbia : Society of Physical Chemists of Serbia, 2016)

TY  - CONF
AU  - Zarić, Milana
AU  - Bugarski, Branko
AU  - Pavelkić, Vesna
AU  - Pantović Pavlović, Marijana
AU  - Stevanović, Jasmina
AU  - Pavlović, Miroslav
AU  - Kijevčanin, Mirjana
PY  - 2016
UR  - https://cer.ihtm.bg.ac.rs/handle/123456789/6600
AB  - The interactions in model systems of unsaturated molecules with cis- and trans-double bonds were studied usingquantum chemical calculations. We present benchmark study of cis- and trans-2- butene dimer model systems with various methods and different basis sets. Root Mean Square Deviation (RMSD) values are represented and results showed that the best agreement with CCSD(T)/CBS values has B3LYP-D3 method with cc-pVTZ basis set, with the lowest RMSD value of 0.032.
PB  - Belgrade, Serbia : Society of Physical Chemists of Serbia
C3  - Proceedings - Physical Chemistry 2016 - 13th International Conference on Fundamental and Applied Aspects of Physical Chemistry, September 26-30, Belgrade
T1  - Benchmark study for 2-butene parallel interactions
VL  - 1
SP  - 75
EP  - 78
UR  - https://hdl.handle.net/21.15107/rcub_cer_6600
ER  - 
@conference{
author = "Zarić, Milana and Bugarski, Branko and Pavelkić, Vesna and Pantović Pavlović, Marijana and Stevanović, Jasmina and Pavlović, Miroslav and Kijevčanin, Mirjana",
year = "2016",
abstract = "The interactions in model systems of unsaturated molecules with cis- and trans-double bonds were studied usingquantum chemical calculations. We present benchmark study of cis- and trans-2- butene dimer model systems with various methods and different basis sets. Root Mean Square Deviation (RMSD) values are represented and results showed that the best agreement with CCSD(T)/CBS values has B3LYP-D3 method with cc-pVTZ basis set, with the lowest RMSD value of 0.032.",
publisher = "Belgrade, Serbia : Society of Physical Chemists of Serbia",
journal = "Proceedings - Physical Chemistry 2016 - 13th International Conference on Fundamental and Applied Aspects of Physical Chemistry, September 26-30, Belgrade",
title = "Benchmark study for 2-butene parallel interactions",
volume = "1",
pages = "75-78",
url = "https://hdl.handle.net/21.15107/rcub_cer_6600"
}
Zarić, M., Bugarski, B., Pavelkić, V., Pantović Pavlović, M., Stevanović, J., Pavlović, M.,& Kijevčanin, M.. (2016). Benchmark study for 2-butene parallel interactions. in Proceedings - Physical Chemistry 2016 - 13th International Conference on Fundamental and Applied Aspects of Physical Chemistry, September 26-30, Belgrade
Belgrade, Serbia : Society of Physical Chemists of Serbia., 1, 75-78.
https://hdl.handle.net/21.15107/rcub_cer_6600
Zarić M, Bugarski B, Pavelkić V, Pantović Pavlović M, Stevanović J, Pavlović M, Kijevčanin M. Benchmark study for 2-butene parallel interactions. in Proceedings - Physical Chemistry 2016 - 13th International Conference on Fundamental and Applied Aspects of Physical Chemistry, September 26-30, Belgrade. 2016;1:75-78.
https://hdl.handle.net/21.15107/rcub_cer_6600 .
Zarić, Milana, Bugarski, Branko, Pavelkić, Vesna, Pantović Pavlović, Marijana, Stevanović, Jasmina, Pavlović, Miroslav, Kijevčanin, Mirjana, "Benchmark study for 2-butene parallel interactions" in Proceedings - Physical Chemistry 2016 - 13th International Conference on Fundamental and Applied Aspects of Physical Chemistry, September 26-30, Belgrade, 1 (2016):75-78,
https://hdl.handle.net/21.15107/rcub_cer_6600 .

Interactions of Molecules with cis and trans Double Bonds: A Theoretical Study of cis- and trans-2-Butene

Zarić, Milana; Bugarski, Branko; Kijevčanin, Mirjana

(Wiley-V C H Verlag Gmbh, Weinheim, 2016)

TY  - JOUR
AU  - Zarić, Milana
AU  - Bugarski, Branko
AU  - Kijevčanin, Mirjana
PY  - 2016
UR  - https://cer.ihtm.bg.ac.rs/handle/123456789/1971
AB  - Noncovalent interactions of cis- and trans-2-butene, as the smallest model systems of molecules with cis and trans double bonds, were studied to find potential differences in interactions of these molecules. The study was performed using quantum chemical methods including very accurate CCSD(T)/CBS method. We studied parallel and displaced parallel interactions in 2-butene dimers, in butane dimers, and between 2-butene and saturated butane. The results show the trend that interactions of 2-butene with butane are the strongest, followed by interactions in butane dimers, whereas the interaction in 2-butene dimers are the weakest. The strongest calculated interaction energy is between trans-2-butene and butane, with a CCSD(T)/CBS energy of -2.80kcalmol(-1). Interactions in cis-2-butene dimers are stronger than interactions in trans-2-butene dimers. Interestingly, some of the interactions involving 2-butene are as strong as interactions in a benzene dimer. These insights into interactions of cis- and trans-2-butene can improve understanding of the properties and processes that involve molecules with cis and trans double bonds, such as fatty acids and polymers.
PB  - Wiley-V C H Verlag Gmbh, Weinheim
T2  - Chemphyschem
T1  - Interactions of Molecules with cis and trans Double Bonds: A Theoretical Study of cis- and trans-2-Butene
VL  - 17
IS  - 2
SP  - 317
EP  - 324
DO  - 10.1002/cphc.201500592
ER  - 
@article{
author = "Zarić, Milana and Bugarski, Branko and Kijevčanin, Mirjana",
year = "2016",
abstract = "Noncovalent interactions of cis- and trans-2-butene, as the smallest model systems of molecules with cis and trans double bonds, were studied to find potential differences in interactions of these molecules. The study was performed using quantum chemical methods including very accurate CCSD(T)/CBS method. We studied parallel and displaced parallel interactions in 2-butene dimers, in butane dimers, and between 2-butene and saturated butane. The results show the trend that interactions of 2-butene with butane are the strongest, followed by interactions in butane dimers, whereas the interaction in 2-butene dimers are the weakest. The strongest calculated interaction energy is between trans-2-butene and butane, with a CCSD(T)/CBS energy of -2.80kcalmol(-1). Interactions in cis-2-butene dimers are stronger than interactions in trans-2-butene dimers. Interestingly, some of the interactions involving 2-butene are as strong as interactions in a benzene dimer. These insights into interactions of cis- and trans-2-butene can improve understanding of the properties and processes that involve molecules with cis and trans double bonds, such as fatty acids and polymers.",
publisher = "Wiley-V C H Verlag Gmbh, Weinheim",
journal = "Chemphyschem",
title = "Interactions of Molecules with cis and trans Double Bonds: A Theoretical Study of cis- and trans-2-Butene",
volume = "17",
number = "2",
pages = "317-324",
doi = "10.1002/cphc.201500592"
}
Zarić, M., Bugarski, B.,& Kijevčanin, M.. (2016). Interactions of Molecules with cis and trans Double Bonds: A Theoretical Study of cis- and trans-2-Butene. in Chemphyschem
Wiley-V C H Verlag Gmbh, Weinheim., 17(2), 317-324.
https://doi.org/10.1002/cphc.201500592
Zarić M, Bugarski B, Kijevčanin M. Interactions of Molecules with cis and trans Double Bonds: A Theoretical Study of cis- and trans-2-Butene. in Chemphyschem. 2016;17(2):317-324.
doi:10.1002/cphc.201500592 .
Zarić, Milana, Bugarski, Branko, Kijevčanin, Mirjana, "Interactions of Molecules with cis and trans Double Bonds: A Theoretical Study of cis- and trans-2-Butene" in Chemphyschem, 17, no. 2 (2016):317-324,
https://doi.org/10.1002/cphc.201500592 . .
1
3
2
3

A method for determination of separation properties of membranes

Grujić, Aleksandar; Stijepović, Mirko; Stajić-Trošić, Jasna; Ilić, J.; Nedeljković, Dragutin

(Bosnia and Herzegovina : University of East Sarajevo, Faculty of Technology, 2015)

TY  - JOUR
AU  - Grujić, Aleksandar
AU  - Stijepović, Mirko
AU  - Stajić-Trošić, Jasna
AU  - Ilić, J.
AU  - Nedeljković, Dragutin
PY  - 2015
UR  - https://cer.ihtm.bg.ac.rs/handle/123456789/3961
AB  - In this study, design of lab scale device for determination of separation properties of membranes is presented and analyzed. Device operates with different gas pressure between chambers, whereby gas streams perpendicular to the membrane. Using appropriate acquisition system and applying mathematical formulas, mechanism for gas transfer through the membrane is determinate. Polymer membranes based on zeolite are synthesized and tested by lab scale device. The membranes with various content of zeolite are tested with CO2 gas until optimal composition of membrane components is established. Beside good mechanical and structural properties of applied membrane, suitable values of permeability with good agreement with the literature data are obtained.
AB  - U ovom radu je prikazano i analizirano konstrukcijsko rešenje laboratorijskog uređaja za određivanje separacionih svojstava membrana. Rad uređaja je baziran na razlici pritisaka između komora, pri čemu gas struji normalno na poprečni presek membrana. Odgovarajućim sistemom za akviziciju podataka i primenom odgovarajućih matematičkih formula određen je mehanizam prenosa kroz membranu. Polimerne membrane na bazi zeolita su sintetizovane i testirane na uređaju. Membrane sa različitim udelim zeolita su testirane na CO2 gas, dok nije ustanovljen optimalan sastav komponenti za sintezu membrana.Pored dobrih mehaničkih i strukturnih svojstava testirane membrane, dobijene su zadovoljavajuće vrednosti permeabilnosti koje su u saglasnosti sa drugim autorima.
PB  - Bosnia and Herzegovina : University of East Sarajevo, Faculty of Technology
T2  - Journal of Engineering & Processing Management
T1  - A method for determination of separation properties of membranes
T1  - Metod za određivanje separacionih svojstava membrana
VL  - 7
IS  - 1
SP  - 45
EP  - 54
DO  - 10.7251/JEPMEN1507045G
ER  - 
@article{
author = "Grujić, Aleksandar and Stijepović, Mirko and Stajić-Trošić, Jasna and Ilić, J. and Nedeljković, Dragutin",
year = "2015",
abstract = "In this study, design of lab scale device for determination of separation properties of membranes is presented and analyzed. Device operates with different gas pressure between chambers, whereby gas streams perpendicular to the membrane. Using appropriate acquisition system and applying mathematical formulas, mechanism for gas transfer through the membrane is determinate. Polymer membranes based on zeolite are synthesized and tested by lab scale device. The membranes with various content of zeolite are tested with CO2 gas until optimal composition of membrane components is established. Beside good mechanical and structural properties of applied membrane, suitable values of permeability with good agreement with the literature data are obtained., U ovom radu je prikazano i analizirano konstrukcijsko rešenje laboratorijskog uređaja za određivanje separacionih svojstava membrana. Rad uređaja je baziran na razlici pritisaka između komora, pri čemu gas struji normalno na poprečni presek membrana. Odgovarajućim sistemom za akviziciju podataka i primenom odgovarajućih matematičkih formula određen je mehanizam prenosa kroz membranu. Polimerne membrane na bazi zeolita su sintetizovane i testirane na uređaju. Membrane sa različitim udelim zeolita su testirane na CO2 gas, dok nije ustanovljen optimalan sastav komponenti za sintezu membrana.Pored dobrih mehaničkih i strukturnih svojstava testirane membrane, dobijene su zadovoljavajuće vrednosti permeabilnosti koje su u saglasnosti sa drugim autorima.",
publisher = "Bosnia and Herzegovina : University of East Sarajevo, Faculty of Technology",
journal = "Journal of Engineering & Processing Management",
title = "A method for determination of separation properties of membranes, Metod za određivanje separacionih svojstava membrana",
volume = "7",
number = "1",
pages = "45-54",
doi = "10.7251/JEPMEN1507045G"
}
Grujić, A., Stijepović, M., Stajić-Trošić, J., Ilić, J.,& Nedeljković, D.. (2015). A method for determination of separation properties of membranes. in Journal of Engineering & Processing Management
Bosnia and Herzegovina : University of East Sarajevo, Faculty of Technology., 7(1), 45-54.
https://doi.org/10.7251/JEPMEN1507045G
Grujić A, Stijepović M, Stajić-Trošić J, Ilić J, Nedeljković D. A method for determination of separation properties of membranes. in Journal of Engineering & Processing Management. 2015;7(1):45-54.
doi:10.7251/JEPMEN1507045G .
Grujić, Aleksandar, Stijepović, Mirko, Stajić-Trošić, Jasna, Ilić, J., Nedeljković, Dragutin, "A method for determination of separation properties of membranes" in Journal of Engineering & Processing Management, 7, no. 1 (2015):45-54,
https://doi.org/10.7251/JEPMEN1507045G . .

Magnetic behaviour of hybrid magnetic composite materials

Stajić-Trošić, Jasna; Grujić, Aleksandar; Stijepović, Mirko Z.; Nedeljković, Dragutin; Stajčić, Aleksandar; Žak, Tomas

(Belgrade, Serbia : Engineering Society for Corrosion, 2014)

TY  - JOUR
AU  - Stajić-Trošić, Jasna
AU  - Grujić, Aleksandar
AU  - Stijepović, Mirko Z.
AU  - Nedeljković, Dragutin
AU  - Stajčić, Aleksandar
AU  - Žak, Tomas
PY  - 2014
UR  - https://cer.ihtm.bg.ac.rs/handle/123456789/1476
AB  - Polymer bonded magnets are contemporary materials with a very large range of applications. The objective of this study is to assess how different content of Nd-Fe-B and/or barium ferrite particles affect on magnetic and morphological properties of bonded composite materials. Interactions between employed magnetic powders and interactions between magnetic powders and polymer binder are considered. For examination of the magnetic behavior Vibrating Sample Magnetometer (VSM) is used. Different shape and size of obtained hysteresis loops are used for comparison and prediction of polymer bonded materials properties.
AB  - Polimerom vezani magneti predstavljaju savremene materijale sa veoma širokim spektrom primene. Cilj ovog rada je da se analizira i prikaže kako različiti udeli čestica Nd-Fe-B i/ili barijum ferita utiču na magnetna i morfološka svojstva bonded kompozitnih materijala. Razmatrane su interakcije između primenjenih magnetnih prahova različitog tipa i interakcije između magnetnih prahova i polimerne matrice. Za merenje magnetnih svojstava kompozita korišćen je vibracioni magnetometar (VSM). Različiti oblici i veličine dobijenih histerezisnih petlji su poređeni i analizirani u cilju predviđanja magnetnog ponašanja kompozita.
PB  - Belgrade, Serbia : Engineering Society for Corrosion
T2  - Zaštita materijala
T1  - Magnetic behaviour of hybrid magnetic composite materials
T1  - Magnetno ponašanje hibridnih magnetnih kompozitnih materijala
VL  - 55
IS  - 2
SP  - 170
EP  - 172
DO  - 10.5937/ZasMat1402170S
ER  - 
@article{
author = "Stajić-Trošić, Jasna and Grujić, Aleksandar and Stijepović, Mirko Z. and Nedeljković, Dragutin and Stajčić, Aleksandar and Žak, Tomas",
year = "2014",
abstract = "Polymer bonded magnets are contemporary materials with a very large range of applications. The objective of this study is to assess how different content of Nd-Fe-B and/or barium ferrite particles affect on magnetic and morphological properties of bonded composite materials. Interactions between employed magnetic powders and interactions between magnetic powders and polymer binder are considered. For examination of the magnetic behavior Vibrating Sample Magnetometer (VSM) is used. Different shape and size of obtained hysteresis loops are used for comparison and prediction of polymer bonded materials properties., Polimerom vezani magneti predstavljaju savremene materijale sa veoma širokim spektrom primene. Cilj ovog rada je da se analizira i prikaže kako različiti udeli čestica Nd-Fe-B i/ili barijum ferita utiču na magnetna i morfološka svojstva bonded kompozitnih materijala. Razmatrane su interakcije između primenjenih magnetnih prahova različitog tipa i interakcije između magnetnih prahova i polimerne matrice. Za merenje magnetnih svojstava kompozita korišćen je vibracioni magnetometar (VSM). Različiti oblici i veličine dobijenih histerezisnih petlji su poređeni i analizirani u cilju predviđanja magnetnog ponašanja kompozita.",
publisher = "Belgrade, Serbia : Engineering Society for Corrosion",
journal = "Zaštita materijala",
title = "Magnetic behaviour of hybrid magnetic composite materials, Magnetno ponašanje hibridnih magnetnih kompozitnih materijala",
volume = "55",
number = "2",
pages = "170-172",
doi = "10.5937/ZasMat1402170S"
}
Stajić-Trošić, J., Grujić, A., Stijepović, M. Z., Nedeljković, D., Stajčić, A.,& Žak, T.. (2014). Magnetic behaviour of hybrid magnetic composite materials. in Zaštita materijala
Belgrade, Serbia : Engineering Society for Corrosion., 55(2), 170-172.
https://doi.org/10.5937/ZasMat1402170S
Stajić-Trošić J, Grujić A, Stijepović MZ, Nedeljković D, Stajčić A, Žak T. Magnetic behaviour of hybrid magnetic composite materials. in Zaštita materijala. 2014;55(2):170-172.
doi:10.5937/ZasMat1402170S .
Stajić-Trošić, Jasna, Grujić, Aleksandar, Stijepović, Mirko Z., Nedeljković, Dragutin, Stajčić, Aleksandar, Žak, Tomas, "Magnetic behaviour of hybrid magnetic composite materials" in Zaštita materijala, 55, no. 2 (2014):170-172,
https://doi.org/10.5937/ZasMat1402170S . .
5

Toward enhanced hydrogen production in a catalytic naphtha reforming process

Stijepović, Vladimir; Linke, Patrick; Alnouri, Sabla; Kijevčanin, Mirjana; Grujić, Aleksandar; Stijepović, Mirko Z.

(Oxford : Pergamon-Elsevier Science Ltd, 2012)

TY  - JOUR
AU  - Stijepović, Vladimir
AU  - Linke, Patrick
AU  - Alnouri, Sabla
AU  - Kijevčanin, Mirjana
AU  - Grujić, Aleksandar
AU  - Stijepović, Mirko Z.
PY  - 2012
UR  - https://cer.ihtm.bg.ac.rs/handle/123456789/960
AB  - Environmental regulations imposed on transport fuels, especially specifications on sulfur and nitrogen content, generally boost hydrogen requirements in refining industries. The catalytic naphtha reformer (CNR) process is one of the major sources of hydrogen in naphtha refinery, thus improving its hydrogen production would be of great importance for refining industries. Close examination of the reaction kinetics of CNR processes has identified temperature, hydrogen concentration and catalyst activity as key variables affecting the process's performance. In this paper, a new reactor concept is developed that better exploits these process variables. The proposed membrane moving-bed reactor promises to significantly outperform the conventional continuous catalyst regenerative (CCR) design. A case study identifies improvements of 23.6 mol% in hydrogen production, 18.8 mol% in aromatics production. Moreover, the reformate yield was found to increase by 10.6 wt%, while the production of light gases decreases to a value of 18.6 wt%. Copyright
PB  - Oxford : Pergamon-Elsevier Science Ltd
T2  - International Journal of Hydrogen Energy
T1  - Toward enhanced hydrogen production in a catalytic naphtha reforming process
VL  - 37
IS  - 16
SP  - 11772
EP  - 11784
DO  - 10.1016/j.ijhydene.2012.05.103
ER  - 
@article{
author = "Stijepović, Vladimir and Linke, Patrick and Alnouri, Sabla and Kijevčanin, Mirjana and Grujić, Aleksandar and Stijepović, Mirko Z.",
year = "2012",
abstract = "Environmental regulations imposed on transport fuels, especially specifications on sulfur and nitrogen content, generally boost hydrogen requirements in refining industries. The catalytic naphtha reformer (CNR) process is one of the major sources of hydrogen in naphtha refinery, thus improving its hydrogen production would be of great importance for refining industries. Close examination of the reaction kinetics of CNR processes has identified temperature, hydrogen concentration and catalyst activity as key variables affecting the process's performance. In this paper, a new reactor concept is developed that better exploits these process variables. The proposed membrane moving-bed reactor promises to significantly outperform the conventional continuous catalyst regenerative (CCR) design. A case study identifies improvements of 23.6 mol% in hydrogen production, 18.8 mol% in aromatics production. Moreover, the reformate yield was found to increase by 10.6 wt%, while the production of light gases decreases to a value of 18.6 wt%. Copyright",
publisher = "Oxford : Pergamon-Elsevier Science Ltd",
journal = "International Journal of Hydrogen Energy",
title = "Toward enhanced hydrogen production in a catalytic naphtha reforming process",
volume = "37",
number = "16",
pages = "11772-11784",
doi = "10.1016/j.ijhydene.2012.05.103"
}
Stijepović, V., Linke, P., Alnouri, S., Kijevčanin, M., Grujić, A.,& Stijepović, M. Z.. (2012). Toward enhanced hydrogen production in a catalytic naphtha reforming process. in International Journal of Hydrogen Energy
Oxford : Pergamon-Elsevier Science Ltd., 37(16), 11772-11784.
https://doi.org/10.1016/j.ijhydene.2012.05.103
Stijepović V, Linke P, Alnouri S, Kijevčanin M, Grujić A, Stijepović MZ. Toward enhanced hydrogen production in a catalytic naphtha reforming process. in International Journal of Hydrogen Energy. 2012;37(16):11772-11784.
doi:10.1016/j.ijhydene.2012.05.103 .
Stijepović, Vladimir, Linke, Patrick, Alnouri, Sabla, Kijevčanin, Mirjana, Grujić, Aleksandar, Stijepović, Mirko Z., "Toward enhanced hydrogen production in a catalytic naphtha reforming process" in International Journal of Hydrogen Energy, 37, no. 16 (2012):11772-11784,
https://doi.org/10.1016/j.ijhydene.2012.05.103 . .
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