DENSITY FUNCTIONAL THEORY STUDIES ON THE STRUCTURAL EVOLUTION AND CATALYTIC REACTIVITY OF MOLYBDENUM-BASED CATALYSTS FOR METHANE CONVERSION

DENSITY FUNCTIONAL THEORY STUDIES ON THE STRUCTURAL EVOLUTION AND CATALYTIC REACTIVITY OF MOLYBDENUM-BASED CATALYSTS FOR METHANE CONVERSION

Methane is an abundant resource existing in the form of natural and shale gas, and molybdenum-based catalysts, including molybdenum oxides and carbides, are the commonly used components in catalysts for converting methane to value-added chemicals. Therefore, understanding the catalytic mechanism und...

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Bibliographic Details
Main Author: Zhang, Tianyu
Format: Others
Published: OpenSIUC 2019
Subjects:
C-C coupling
Density functional theory
Methane
Molybdenum carbide
Online Access:https://opensiuc.lib.siu.edu/dissertations/1768
https://opensiuc.lib.siu.edu/cgi/viewcontent.cgi?article=2772&context=dissertations

Internet

https://opensiuc.lib.siu.edu/dissertations/1768
https://opensiuc.lib.siu.edu/cgi/viewcontent.cgi?article=2772&context=dissertations

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