Reference number : GC-2017-Q1-00565, amendment number : , agreement type : G, recipient legal name : DiLabio, Gino (The University of British Columbia), recipient country : CA, recipient province : nan, recipient city : British Columbia|Colombie-Britannique, recipient postal code : nan, program name english : Engage Plus Grants for Universities, program name french : Subvention d'engagement partenarial Plus pour les universités, program purpose english : The research challenge to be addressed through the project is two-fold and will continue to contribute to the_x000D_
benchmark feasibility study for a longer term collaborative project. The primary focus will be on the_x000D_
computational study mechanisms related to coke accumulation at a surface and its subsequent gasification._x000D_
The mechanism and kinetics associated with non-oxide based gasification of carbon species is not known and_x000D_
must be understood in order to develop more effective catalyst coatings. Simulations will be performed in order_x000D_
to develop an understanding of how the surface of a metal carbide could facilitate this surface chemistry. Such_x000D_
studies have never been performed. A secondary outcome of this project will be to provide an atomistic view_x000D_
of Cr-losses from the steel (forming a Cr-denuded zone). The stretch and future goals will be implementing the_x000D_
study on CAMOLTM G1/G2 product line which will provide more direct information to aid in the_x000D_
development of the new SGX product and optimization of an associated base alloy._x000D_
The optimization of non-oxide based catalyst system for high carbon gasification is a challenge that must be_x000D_
addressed in the development of anti-fouling coatings for high severity olefins manufacturing. The use of_x000D_
computational techniques to better understand the available catalytic pathways and optimize the system for the_x000D_
base catalyst as well as any doping elements can significantly increase the efficiency with which candidate_x000D_
materials are identified and optimized., program purpose french : The research challenge to be addressed through the project is two-fold and will continue to contribute to the_x000D_
benchmark feasibility study for a longer term collaborative project. The primary focus will be on the_x000D_
computational study mechanisms related to coke accumulation at a surface and its subsequent gasification._x000D_
The mechanism and kinetics associated with non-oxide based gasification of carbon species is not known and_x000D_
must be understood in order to develop more effective catalyst coatings. Simulations will be performed in order_x000D_
to develop an understanding of how the surface of a metal carbide could facilitate this surface chemistry. Such_x000D_
studies have never been performed. A secondary outcome of this project will be to provide an atomistic view_x000D_
of Cr-losses from the steel (forming a Cr-denuded zone). The stretch and future goals will be implementing the_x000D_
study on CAMOLTM G1/G2 product line which will provide more direct information to aid in the_x000D_
development of the new SGX product and optimization of an associated base alloy._x000D_
The optimization of non-oxide based catalyst system for high carbon gasification is a challenge that must be_x000D_
addressed in the development of anti-fouling coatings for high severity olefins manufacturing. The use of_x000D_
computational techniques to better understand the available catalytic pathways and optimize the system for the_x000D_
base catalyst as well as any doping elements can significantly increase the efficiency with which candidate_x000D_
materials are identified and optimized., agreement title english : Computational approaches towards the advancement of high temperature coatings, agreement title french : Computational approaches towards the advancement of high temperature coatings, agreement number : EGP2, agreement value : 12500.0, agreement start date : 2017-06-14, agreement end date : nan, description english : nan, description french : nan, expected results english : nan, expected results french : nan, additional information english : Grant or Award spanning more than one fiscal year. (2017-2018 to 2018-2019), additional information french : Subvention ou bourse octroyée s'appliquant à plus d'un exercice financier. (2017-2018 à 2018-2019), owner organization : nserc-crsng, owner organization title : Natural Sciences and Engineering Research Council of Canada | Conseil de recherches en sciences naturelles et en génie du Canada