کد مقاله | کد نشریه | سال انتشار | مقاله انگلیسی | نسخه تمام متن |
---|---|---|---|---|
217677 | 1426415 | 2008 | 7 صفحه PDF | دانلود رایگان |
عنوان انگلیسی مقاله ISI
Graph-theoretic and energetic exploration of catalytic pathways of the water-gas shift reaction
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کلمات کلیدی
موضوعات مرتبط
مهندسی و علوم پایه
مهندسی شیمی
مهندسی شیمی (عمومی)
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چکیده انگلیسی
The catalytic mechanisms or pathways of water-gas shift (WGS) reaction have been the focus of intense research interest because of its immense importance in hydrogen production. At the outset, 116 stoichiometrically feasible independent pathways (IPi's) have been exhaustively generated within 2 s on a PC through a novel graph-theoretic method based on P-graphs (process graphs) from a set of 17 plausible elementary reactions. This is followed by the determination of IP18 among these 116 stoichiometrically feasible IPi's as the plausibly dominant pathway via energetic analysis.
ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Journal of the Chinese Institute of Chemical Engineers - Volume 39, Issue 5, September 2008, Pages 467–473
Journal: Journal of the Chinese Institute of Chemical Engineers - Volume 39, Issue 5, September 2008, Pages 467–473
نویسندگان
L.T. Fan, Yu-Chuan Lin, Shahram Shafie, Keith L. Hohn, Botond Bertók, Ferenc Friedler,