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DOE OSTI · 1342571

The metallic thread in a patchwork thesis

Hull, Emily A.
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Abstract

This thesis contains research that is being prepared for publication. Chapter 2 presents research on water and THF solvated macrocyclic Rh and Co compounds and the effects of different axial ligands (NO 2 , NO, Cl, CH 3 ) on their optical activity. Chapter 3 involves the study of gas-phase Nb mono and dications with CO and CO 2 . Chapter 4 is a study of reactions of CO and CO 2 with Ta mono and dications. Chapter 5 is a study on virtual orbitals, their usefulness, the use of basis sets in modeling them, and the inclusion of transition metals into the QUasi Atomic Minimal Basis (QUAMBO) method.68-72 Chapter 6 presents the conclusions drawn from the work presented in this dissertation.

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Hull, Emily A.. 2014-01-01. The metallic thread in a patchwork thesis. https://doi.org/10.2172/1342571

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