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  Partner: UNT Libraries
 Degree Discipline: Chemistry
 Collection: UNT Theses and Dissertations
Optical Properties of Christiansen Filter Systems

Optical Properties of Christiansen Filter Systems

Date: August 1960
Creator: Hinckley, Conrad C.
Description: This thesis examines the optical properties of Christiansen filter systems.
Contributing Partner: UNT Libraries
Oxovanadium(IV) Complexes of Substituted N-(2-Thiophenyl)Salicylideneimine

Oxovanadium(IV) Complexes of Substituted N-(2-Thiophenyl)Salicylideneimine

Date: June 1970
Creator: Lee, Cheng Chang
Description: In an effort to study the spectral, magnetic, and stereochemical properties of vanadyl complexes, both a new series of vanadyl complexes derived from type (VII) ligands with subnormal magnetic moment and from type (VIII) ligands with normal magnetic moment are synthesized and characterized.
Contributing Partner: UNT Libraries
Part I: Solid State Studies of Larger Calixarenes : Part II: Synthesis and Characterization of Metallocalixarenes

Part I: Solid State Studies of Larger Calixarenes : Part II: Synthesis and Characterization of Metallocalixarenes

Date: May 1998
Creator: Smith, Janna Marie
Description: Calixarenes are a class of macrocyclic compounds that have garnered interest in large part because of their ability to form host-guest complexes with various types of molecules. For all of the studies of complex formation by calixarenes, most of the work to date has concentrated upon the smaller calixarenes, and little is understood about the relationship between the complexes formed when in solution and that observed in the solid state. The first part of the study, presented in Chapter 3, is of the solid-state properties of two of the larger calixarenes, and in comparison to other reported structures reveals patterns to the observed conformations both in the solid state and in solution. The formation of metal complexes has also been investigated and has focused extensively upon the metals as guests. Thus, the ability of the calixarenes to act as ligands in inorganic complexes has been virtually untapped, despite the polyoxo binding site they can easily provide, and very few metallocalixarenes have been reported. The second part of this study goes beyond the simple solid-state properties of such compounds, and involves the synthesis of several metallocalixarenes as part of a project directed at the functionalization of calixarenes with the components of ...
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The performance of density functional theory with the correlation consistent basis sets.

The performance of density functional theory with the correlation consistent basis sets.

Date: August 2005
Creator: Wang, Xuelin
Description: Density functional theory has been used in combination with the correlation consistent and polarization consistent basis sets to investigate the structures and energetics for a series of first-row closed shell and several second-row molecules of potential importance in atmospheric chemistry. The impact of basis set choice upon molecular description has been examined, and irregular convergence of molecular properties with respect to increasing basis set size for several functionals and molecules has been observed. The possible reasons and solutions for this unexpected behavior including the effect of contraction and uncontraction, of the basis set diffuse sp basis functions, basis set superposition error (BSSE) and core-valence sets also have been examined.
Contributing Partner: UNT Libraries
The performance of silicon based sensor and its application in silver toxicity studies

The performance of silicon based sensor and its application in silver toxicity studies

Date: August 2000
Creator: Peng, Haiqing
Description: The silicon based sensor is able to detect part per trillion ionic silver in 0.0098% hydrofluoric acid based on the open circuit potential (OCP) measurement. The OCP jump of 100 ppt ionic silver solution is up to 120 mV. The complex agent can effectively suppress the ionic silver concentration and suppress the OCP signal. The ability of complex agent to suppress the OCP signal depends on the formation constant of the complex with silver. The complex adsorbed on the sensor surface induces a second OCP jump, the height of the second jump depends on the formation constant of the complex. The MINEQL chemical equilibrium modeling program is used to calculate the ionic silver concentration when complex agent presents, a discrepancy is found between the MINEQL simulation result and the OCP signal of the silicon based sensor. The toxicity of ionic silver to C. dubia is studied parallel to the OCP signal of silicon based sensor. Less toxicity is found when the complex agent is present similar to the OCP signal. Another discrepancy is found between the MINEQL simulation and the toxicity test when MINEQL simulation is used to predict and control the ionic silver concentration. The data from both biosensor ...
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Phosphorescent Emissions of Coinage Metal-Phosphine Complexes: Theory and Photophysics

Phosphorescent Emissions of Coinage Metal-Phosphine Complexes: Theory and Photophysics

Date: December 2009
Creator: Sinha, Pankaj
Description: The major topics discussed are all relevant to the bright phosphorescent emissions of coinage metal complexes (Cu(I), Ag(I) and Au(I)) with an explanation of the theoretical background, computational results and ongoing work on the application in materials and optoelectronic devices. Density functional computations have been performed on the majority of the discussed complexes and determined that the most significant distortion that occurs in Au(I)-phosphine complexes is a near and beyond a T-shape within the P-Au-P angle when the complexes are photoexcited to the lowest phosphorescent excited state. The large distortion is experimentally qualified with the large Stokes' shift that occurs between the excitation and emission spectra and can be as large as 18 000 cm-1 for the neutral Au(I) complexes. The excited state distortion has been thoroughly investigated and it is determined that not only is it pertinent to the efficient luminescence but also for the tunability in the emission. The factors that affect tunability have been determined to be electronics, sterics, rigidity of solution and temperature. The luminescent shifts determined from varying these parameters have been described systematically and have revealed emission colors that span the entire visible spectrum. These astounding features that have been discovered within studies of ...
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The Photo-Alkylation of C4 Hydocarbons

The Photo-Alkylation of C4 Hydocarbons

Date: 1942
Creator: Oliver, Bob M.
Description: A study of the photo-alkylation of C4 hydrocarbons.
Contributing Partner: UNT Libraries
The Photo-Chemical Reactions of Isopentane

The Photo-Chemical Reactions of Isopentane

Date: 1945
Creator: Walker, Russell C.
Description: This thesis describes an experiment in the ultraviolet absorption of hydrocarbons.
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The Photochemical Reactions of 2,7-dimethyloctane

The Photochemical Reactions of 2,7-dimethyloctane

Date: June 1953
Creator: Trammell, Margaret Ruth
Description: This thesis is a study of the photochemical reactions of 2,7-dimethyloctane.
Contributing Partner: UNT Libraries
Photochemistry of Isopropyl Alcohol

Photochemistry of Isopropyl Alcohol

Date: 1956
Creator: Perry, Reeves Baldwin
Description: This study discusses the effects of the photochemistry of isopropyl alcohol.
Contributing Partner: UNT Libraries