THE INFLUENCE OF MOLYBDENUM AND TUNGSTEN ON THE CRM-OXIDE CATALYST REACTIVITY IN PROPANE ACTIVATION: A QUANTUM MECHANICS CALCULATION
A quantum chemical calculation for the activation of propane across CrM-oxide (M = Cr, Mo, and W) catalysts in the dehydrogenation of propane into propylene was studied. The calculation was carried out via the use of the PM3 semi-empirical approach. In this study, the reactivity of the catalyst was...
| Main Authors: | , , , |
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| Format: | Article |
| Language: | English |
| Published: |
Politehnium Publishing House
2020-12-01
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| Series: | European Journal of Materials Science and Engineering |
| Subjects: | |
| Online Access: | https://ejmse.ro/articles/05_04_01_EJMSE-20-119.pdf |