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Author:

Grove , David Earl

Title:

ARC DISCHARGE SYNTHESIS AND MORPHOLOGY CONTROL OF EARLY TRANSITION METAL CARBIDE NANOPATICLES

Graduate Program:

Chemistry

Keywords:

Early Transition Metal Carbides
Arc Discharge
Nano Paricle Morphology Control

File:

Download Master1d.pdf

Committee Members:

Will Castleman, Dissertation Advisor/Co-Advisor
Albert Welford Castleman Jr., Committee Chair/Co-Chair
James Bernhard Anderson, Committee Member
John V Badding, Committee Member
James Hansell Adair, Committee Member

Author:

Chakravorty, Dhruva Kumar

Title:

HYBRID QUANTUM/CLASSICAL MOLECULAR DYNAMICS SIMULATIONS OF HYDROGEN TRANSFER REACTIONS IN ENZYMES

Graduate Program:

Chemistry

Keywords:

DLPROTEIN
EVB
DHFR
ketosteroid isomerase
KSI
WHAM
Umbrella Integration
hydrogen transfer

File:

Download thesis15-1.pdf

Committee Members:

Prof Sharon Hammes Schiffer, Dissertation Advisor/Co-Advisor
Prof Sharon Hammes Schiffer, Committee Chair/Co-Chair
James Bernhard Anderson, Committee Member
Philip C. Bevilacqua, Committee Member
James David Kubicki, Committee Member

Author:

Goken, Erin Gabrielle

Title:

The role of small organic molecules in atmospheric chemistry and particle formation

Graduate Program:

Chemistry

Keywords:

water
clusters
atmospheric chemistry
formic acid

File:

Download The_role_of_small_organic_molecules_in_atmospheric_chemistry_and_particle_formation.pdf

Committee Members:

Albert Welford Castleman Jr., Dissertation Advisor/Co-Advisor
Albert Welford Castleman Jr., Committee Chair/Co-Chair
James Bernhard Anderson, Committee Member
John V Badding, Committee Member
James Hansell Adair, Committee Member

Author:

Stagliano, Michael C.

Title:

Strategies for Lipid Identification, Profiling, and Quantification using Mass Spectrometry

Graduate Program:

Chemistry

Keywords:

Lipid Fragmentation
Mass Spectrometry
Lipid Discovery

File:

Download Dissertation_final_MCS.pdf

Committee Members:

Mark Maroncelli, Dissertation Advisor/Co-Advisor
Mark Maroncelli, Committee Chair/Co-Chair
Alan James Benesi, Committee Member
James Bernhard Anderson, Committee Member
Douglas D Archibald, Committee Member
A Daniel Jones, Committee Member

Author:

Ludlow, Michelle Kathryn

Title:

PROTON–COUPLED ELECTRON TRANSFER REACTIONS: THEORETICAL INSIGHT INTO EXPERIMENTAL RESULTS

Graduate Program:

Chemistry

Keywords:

PCET
vibronic coupling
KIE
quinol oxidation
phenoxyl/phenol
Tafel plot

File:

Download Ludlow_Thesis.pdf

Committee Members:

Sharon Hammes Schiffer, Dissertation Advisor/Co-Advisor
Sharon Hammes Schiffer, Committee Chair/Co-Chair
James Bernhard Anderson, Committee Member
Carsten Krebs, Committee Member
Vincent Henry Crespi, Committee Member

Author:

Sayres, Scott Grayson

Title:

The strong-field ionization mechanisms of molecules and clusters

Graduate Program:

Chemistry

Keywords:

high charge states
mass spectrometry
Coulomb explosion
strong-field ionization
multiphoton ionization

File:

Download Scott_Sayres_Final_Thesis.pdf

Committee Members:

Albert Welford Castleman Jr., Dissertation Advisor/Co-Advisor
Albert Welford Castleman Jr., Committee Chair/Co-Chair
James Bernhard Anderson, Committee Member
Nicholas Winograd, Committee Member
Jorge Osvaldo Sofo, Committee Member

Author:

Edwards, Sarah J

Title:

Impact of mutation on the proton-coupled electron transfer reaction catalyzed by soybean lipoxygenase

Graduate Program:

Chemistry

Keywords:

soybean lipoxygenase
proton-coupled electron transfer
kinetic isotope effects
driving foce dependence
rate constant expressions
mutant enzymes

File:

Download Thesis-2010.07.29.00.pdf

Committee Members:

Sharon Hammes Schiffer, Dissertation Advisor/Co-Advisor
Sharon Hammes Schiffer, Committee Chair/Co-Chair
James Bernhard Anderson, Committee Member
Albert Welford Castleman Jr., Committee Member
John H Golbeck, Committee Member