Journal
AICHE JOURNAL
Volume 68, Issue 5, Pages -Publisher
WILEY
DOI: 10.1002/aic.17582
Keywords
ammonium perchlorate; combustion; indicators; quantification; alpha-Fe2O3
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Funding
- National Natural Science Foundation of China [21606010]
- High Performance Computing Platform of BUCT
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This study proposes a new method to quantitatively evaluate the catalytic capability of metal oxides in ammonium perchlorate (AP) catalytic thermal decomposition. By introducing two indicators, the activity and number of catalyst sites can be decoupled, and the feasibility of this method is demonstrated through experiments using hematite nanostructures as model catalysts.
Ammonium perchlorate (AP) catalytic thermal decomposition by metal oxides is complex and there is still no suitable quantitative evaluation method to characterize intrinsic catalytic activity. Here, a new method to quantitatively evaluate the catalytic capability of metal oxides for AP decomposition has been proposed. We introduce two indicators, intrinsic peak temperature (T*(HTD)) and catalytic density (pr) in high-temperature decomposition process, to uncouple activity and number of catalyst sites. Hematite (alpha-Fe2O3) nanostructures with different shapes have been used as model catalysts to verify the feasibility of this method. Rod-like alpha-Fe2O3 shows the best catalytic performance in AP decomposition with the lowest T*(HTD) of 345.1 degrees C and highest P-T* of 0.544, which indicate the largest number and highest activity of catalytic sites. Moreover, these new indicators are theoretically proven to be reasonable by density functional theory calculations.
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