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Full-Text Articles in Chemistry
Crystallographic Exploration Of Fundamental Technetium Species At Nonambient Conditions, Daniel S. Mast
Crystallographic Exploration Of Fundamental Technetium Species At Nonambient Conditions, Daniel S. Mast
UNLV Theses, Dissertations, Professional Papers, and Capstones
The study of mater under extreme conditions has yielded fascinating insight into the physical and chemical nature of materials that under more modest conditions are considered mundane but have quite unusual properties when under pressure. Examples of this are the lightest of elements found in the first two rows and in the heaviest elements of the lanthanide and actinide series. Pure elements, though the simplest possible chemical systems, have proven to be among the most complex and interesting. Technetium metal is a simple HCP transition metal that, due to its half-filled d-shell, has a rich chemistry and an important place …
Understanding Three-Body Interactions In Hexagonal Close Packed Solid He-4, Ashleigh Locke Barnes
Understanding Three-Body Interactions In Hexagonal Close Packed Solid He-4, Ashleigh Locke Barnes
Doctoral Dissertations
The ground state properties of hexagonal close packed (hcp) solid 4He [He-4] are dominated by large atomic zero point motions which make the primary contribution to the solid’s low-temperature Debye-Waller (DW) factors. Preliminary investigations have also suggested that three-body interactions can play an important role in this system, particularly at higher densities. However, due to their computational cost, these interactions are not generally incorporated into theoretical models of solid 4He [He-4]. In order to accurately treat both zero point motion and three-body interactions, we have developed a perturbative treatment in which the three-body energy is added as a …
Forcing Cesium Into Higher Oxidation States Via Useful Hard X-Ray Induced Chemistry At Extreme Conditions, Daniel Thomas Sneed
Forcing Cesium Into Higher Oxidation States Via Useful Hard X-Ray Induced Chemistry At Extreme Conditions, Daniel Thomas Sneed
UNLV Theses, Dissertations, Professional Papers, and Capstones
Recent theoretical work published in Nature Chemistry postulates the existence of cesium in high oxidation states when bonding with fluorine. It is thus predicted to behave as a p-block element (such as xenon) at pressures above 5 GPa. At these pressures, fluorine atoms may bond with the inner p-shell electrons forming CsFn, where n may vary from 2 up to 6; thus the oxidation state of Cs may change up to 6+. My research focused on physically synthesizing these compounds and to verify that, given the right conditions, bonding doesn't only occur with valence electrons, but with the inner p-shell …