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1. Ab initio study of surface chemistry for fuel processing: adsorptive desulfurization and carbon resistant steam reforming

open_access
Open Access
Author:
Guo, Jiahua
Title:
Ab initio study of surface chemistry for fuel processing: adsorptive desulfurization and carbon resistant steam reforming
Graduate Program:
Energy and Geo-Environmental Engineering
Keywords:
Adsorptive desulfurization
steam reforming
DFT
TiO2
CeO2
fuel processing
File:
Download Guo_JH_PhD_dissertation.pdf
Committee Members:
Chunshan Song, Dissertation Advisor/Co-Advisor
Chunshan Song, Committee Chair/Co-Chair
Michael John Janik, Committee Chair/Co-Chair
Harold Harris Schobert, Committee Member
Xiaoliang Ma, Committee Member
Mark Maroncelli, Committee Member

2. PHOTOINDUCED ACTIVATION OF CO2 ON TiO2 SURFACES: QUANTUM CHEMICAL MODELING OF GROUND AND EXCITED STATES, AND IN SITU EPR STUDIES

open_access
Open Access
Author:
Indrakanti, Venkata Pradeep
Title:
PHOTOINDUCED ACTIVATION OF CO2 ON TiO2 SURFACES: QUANTUM CHEMICAL MODELING OF GROUND AND EXCITED STATES, AND IN SITU EPR STUDIES
Graduate Program:
Energy and Geo-Environmental Engineering
Keywords:
quantum calculations
DFT
CO2 activation
photocatalytic reduction of CO2
anatase
TiO2
CO2 utilization
File:
Download Pradeep_Thesis_Vita.pdf
Committee Members:
Harold Harris Schobert, Dissertation Advisor/Co-Advisor
Harold Harris Schobert, Committee Chair/Co-Chair
James David Kubicki, Committee Chair/Co-Chair
Chunshan Song, Committee Member
Kwadwo Osseo Asare, Committee Member
Adrianus C Van Duin, Committee Member

3. Sulfur tolerance enhancement of steam reforming by binary metal catalysts

open_access
Open Access
Author:
Lee, Kyungtae
Title:
Sulfur tolerance enhancement of steam reforming by binary metal catalysts
Graduate Program:
Chemical Engineering
Keywords:
steam reforming
bimetallic catalysts
DFT
sulfur poisoning
Rh-Ni binary metals
BEP relationships
File:
Download Thesis_Kyungtae.pdf
Committee Members:
Michael John Janik, Dissertation Advisor/Co-Advisor
Michael John Janik, Committee Chair/Co-Chair
Robert Martin Rioux Jr., Committee Member
Enrique Daniel Gomez, Committee Member
Chunshan Song, Committee Member

4. Novel Ti based mixed metal oxide systems for adsorptive desulfurization: A combined ab initio and experimental study

open_access
Open Access
Author:
Sitamraju, Siddarth
Title:
Novel Ti based mixed metal oxide systems for adsorptive desulfurization: A combined ab initio and experimental study
Graduate Program:
Energy and Mineral Engineering
Keywords:
DFT
Titania
Anatase
Adsorptive desulfurization
Air promoted desulfurization
File:
Download Dissertation_Sitamraju.pdf
Committee Members:
Chunshan Song, Dissertation Advisor/Co-Advisor
Chunshan Song, Committee Chair/Co-Chair
Michael John Janik, Committee Member
Xiaoxing Wang, Committee Member
Jonathan P Mathews, Special Member