کد مقاله | کد نشریه | سال انتشار | مقاله انگلیسی | نسخه تمام متن |
---|---|---|---|---|
8090219 | 1521970 | 2016 | 8 صفحه PDF | دانلود رایگان |
عنوان انگلیسی مقاله ISI
Analysis of the CO2 absorption through a series of amines within the integration of a computational chemistry and process simulation scheme
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کلمات کلیدی
موضوعات مرتبط
مهندسی و علوم پایه
علوم زمین و سیارات
فرآیندهای سطح زمین
پیش نمایش صفحه اول مقاله
![عکس صفحه اول مقاله: Analysis of the CO2 absorption through a series of amines within the integration of a computational chemistry and process simulation scheme Analysis of the CO2 absorption through a series of amines within the integration of a computational chemistry and process simulation scheme](/preview/png/8090219.png)
چکیده انگلیسی
In this study, the absorption of CO2 through primary and secondary amines is assessed employing two complementary approaches. The first one is a computational chemistry study on the thermodynamics of the reaction where the gas phase and the solvation effect are considered, as well as changes in temperature at 298.15Â K and 313.15Â K. The second one is the simulation of the absorption process in a packed column employing the rate-based approach, and using the kinetic and thermodynamic information provided by the computational chemistry study. The same operating conditions were kept in all studied systems; both studies, computational chemistry and process simulation, were found to be a good combination for this particular CO2 absorption problem, especially when there is a lack of kinetic data.
ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: International Journal of Greenhouse Gas Control - Volume 50, July 2016, Pages 198-205
Journal: International Journal of Greenhouse Gas Control - Volume 50, July 2016, Pages 198-205
نویسندگان
ValentÃn Vassilev-Galindo, Myrna H. Matus, Miguel A. Morales-Cabrera,