TY - CHAP
T1 - Graph-theoretic approach to the catalytic-pathway identification of methanol decomposition
AU - Lin, Yu-Chuan
AU - Fan, L. T.
AU - Shafie, Shahram
AU - Bertók, Botond
AU - Friedler, Ferec
PY - 2009/6/30
Y1 - 2009/6/30
N2 - Catalytic partial oxidation of methanol (MD) plays a key role in hydrogen production, which is the desirable fuel for both proton exchange membrane and direct methanol fuel cell systems. Thus, the catalytic mechanisms, or pathways, of MD have lately been the focus of intense research interest. Recently, the feasible independent pathways (IPi's) have been reported on the basis of a set of highly plausible elementary reactions. Nevertheless, no feasible acyclic combined pathways (APi's) comprising IPi's have been reported. Such APi's can not be ignored in identifying dominant pathways.
AB - Catalytic partial oxidation of methanol (MD) plays a key role in hydrogen production, which is the desirable fuel for both proton exchange membrane and direct methanol fuel cell systems. Thus, the catalytic mechanisms, or pathways, of MD have lately been the focus of intense research interest. Recently, the feasible independent pathways (IPi's) have been reported on the basis of a set of highly plausible elementary reactions. Nevertheless, no feasible acyclic combined pathways (APi's) comprising IPi's have been reported. Such APi's can not be ignored in identifying dominant pathways.
UR - http://www.scopus.com/inward/record.url?scp=67649264898&partnerID=8YFLogxK
UR - http://www.scopus.com/inward/citedby.url?scp=67649264898&partnerID=8YFLogxK
U2 - 10.1016/S1570-7946(09)70215-9
DO - 10.1016/S1570-7946(09)70215-9
M3 - Chapter
AN - SCOPUS:67649264898
SN - 9780444534330
T3 - Computer Aided Chemical Engineering
SP - 1293
EP - 1298
BT - 19th European Symposium on Computer Aided Process Engineering
A2 - Jezowski, Jacek
A2 - Thullie, Jan
ER -
