Acquisition of an X-Ray Powder Diffractometer for Chemical, Materials and Environmental Research and Education

X-ray powder diffraction and X-ray fluorescence spectroscopy are essential tools for structural characterization, elemental analysis, and dynamic study of solid-state materials, liquids and solutions important to chemistry, engineering and the environment. As well as being important to academia, X-ray powder diffraction and X-ray fluorescence spectroscopy are widely used in industry for research, quality control and product development. Acquisition of this equipment will also foster greater interactions and collaboration between the Chemistry Department and the Departments of Chemical Engineering, Civil and Environmental Engineering, and Plant & Soil Sciences at OSU as well as helping to maintain an active collaboration between OSU and Xavier University of Louisiana. Additionally, interest in the equipment has been expressed by ASEC, a local division of Allied Signal. A proposed Internet-based course and promotional literature will be used to expand the user base to other nearby universities and industries.

Sponsor: National Science Foundation

PI: Allen Apblett

 

Development of Electrochemical Capacitor Technology for DOD Applications

This project will establish a viable research program that will provide new capabilities, which will broaden the university research base in support of national defense. The research will positively impact the development of supercapacitors that are vital to the production of electrical vehicles and low-maintenance power sources for military applications. The research will take advantage of novel ceramic precursors to elaborate novel synthetic methods for the preparation of electrode materials that are currently under investigation for use in electrochemical capacitors. The research will also target the identification of new, superior electrode materials based on a combinatorial approach using water-based precursors. At the same time, the research will provide for the training of at least two graduate students, two undergraduate students, and a postdoctoral fellow in areas relevant to national defense.

Sponsors: OSRHE, AFOSR

PI: Allen Apblett  

 

Expanding Efforts in the Ultrapure Water Group to Address Resin Chemistry Issues: Phase 2

Phase 2 covered two directions: 1) Defining the impact of the hyposthesized fouling mechanism on ion exchange resin performance; and 2) Fouling the resins by specific chemical/physical means.

Sponsor: Electric Power Research Institute

PI: Alan Apblett

 

Ion Exchangers with Completely-Reversible Binding Properties for Remediation of Energy-Related Waste Streams

The research will be directed towards the development and testing of new materials that are capable of absorbing and concentrating toxic metal ions from aqueous solution and the separation of these ions from environmentally-benign ones. The effectiveness of the exchange materials for removal of actinides and heavy metals from aqueous solution will be determined by investigating their uptake of uranium, thorium, cerium, europium, lead and cadmium from aqueous solution. The total ion-exchange capacity, the equilibrium binding constants, the selectivity of the ion exchangers to a specific contaminated environment, and the purification of leachate from uranium mine tailings using them, will be investigated. The results will be submitted for publication in “Environmental Science and Technology” and will be presented at national symposia such as the “Emerging Technology in Hazardous Waste Remediation” series.

Sponsor: Environmental Institute

PI: Allen Apblett

 

NanoNet Seed Grant

In this research, a new method called the sol-gello method, was used to synthesize nanoparticlate yttrium iron garnet, an important target for high density magnetic and magneto-eprical drives and for the investigation of magnetic phenomena on the nanometer scale.

Sponsor: EPSCoR

PI: Alan Apblett

 

New Mono and Bicyclic Saturated Azaheterocycles with Anesthetic and Antiarryhthmic Activity

This is a two-year project to develop the chemistry of judiciously selected heterocyclic systems that exhibit useful anti-arrhythmic and anesthetic properties. Our research team from OSU will work with a team at the National Academy of Sciences in Almaty, Kazakhstan.  The chemistry involves synthesis of members of the family of 3, 7-dihetera-bicyclo[3.31] nanones.

Sponsors: U.S. Civilian Research and Development Fund, Oklahoma State Regents for Higher Education

PI: K.D. Berlin

 

Pharmaceutical Materials

An agreement to provide materials of pharmaceutical testing and research.

Sponsor: Dow AgroSciences

PI: Richard A. Bunce

 

Tandem Reaction Strategies for Drug Synthesis

This research is directed toward the study of tandem reaction for the efficient synthesis of new heterocyclic drug candidates. The reaction sequences being studied are initiated by reduction of an aromatic nitro group that is captured in subsequent reactions to generate novel structures for drug testing. The focus of this study is to develop and optimize each new process, elucidate its mechanism and scope, and search for ways to generate product compounds with higher stereoselectivity.

Sponsor: Oklahoma Center for the Advancement of Science and Technology (OCAST)

PI: Richard A. Bunce

 

Spectroscopic and Simulation Studies of Structures and Mobilities of Icy Surfaces and Adsorbates: Physics and Chemistry of Molecular Nanoparticles

The primary objective of this research is to further characterize the surface of crystalline ice (and related solids), in terms of both structure and kinetic response to a variety of adsorbates.

Sponsor: National Science Foundation

PI: J. Paul Devlin

 

Electrically Driven Microseparation Methods for Pesticides and Metabolites

The broad objective of this investigation entails an integrated approach to the development of high performance capillary electrophoresis (HPCE) and capillary electrochromatography (CEC) methods for the rapid, sensitive and efficient separation of neutral and charged pesticides and their metabolites. This broad objective will be approached by performing systematic studies on the mechanisms of the electrophoretic migration and electrochromatographic partitioning of pesticides and metabolites in HPCE and CEC. Also, detection methods for the sensitive determination of these pollutants by laser-induced fluorescence (LIF) are proposed as a plausible route to the broad objective.

Sponsor: U.S. Department of Agriculture

PI: Ziad El Rassi

 

Biophotonics: Collaborative Research: Photoactivated Coupling of Nanoparticle Multilayers and Nerve Cells

In this project, a multidisciplinary and multi-university research team is investigating the dynamics and mechanisms of the live/lifeless matter interaction in a model system consisting of a thin film composed of nanoparticles and cultured nerve cells. Specifically, the objectives of the project are the following: 1) Preparation and optimization of biocompatible nanoparticle multilayers that can be attached to nerve cells; and 2) Registration and characterization of the photoinduced nerve cell membrane currents and potentials following optical excitation of the interface as function of nanoparticle and biological structures.

Sponsor:  National Science Foundation

PIs: Warren Ford, Nicholas Kotov

Department of Physics: James Wicksted

 

EPSCoR Research Infrastructure Improvement Plan

Continuing its long-term strategy of building upon existing strengths, Oklahoma invests in the emerging fields of nanotechnology and functional genomics to bring them to a nationally competitive level. Both fields are federal as well as state priorities. Two multidisciplinary, multi-campus research groups were formed by investigators at Oklahoma State University, University of Oklahoma, OU Health Sciences Center, University of Tulsa, Oklahoma Medical Research Foundation and the private sector. The participating institutions provided start-up costs and sustained commitments to new faculty positions throughout the state. Targeting of reference standards, utilizing the Mesonet system, investment in improved microscopy equipment, statewide scientific symposia, promotion of linkages between university researchers and small business, extensive education, human resource and outreach programs were some of the goals charted for these groups. This will facilitate efforts to develop major research centers and enhance private sector research and development in the state and improve the statewide educational infrastructure to provide highly qualified students and graduates for the state’s emerging high technology businesses.

Sponsors: National Science Foundation, EPSCoR

PI: Warren Ford

 

Nanostructured Materials from Composites of Polymer Latexes and Dendrimers

Polymer colloids will be prepared <100nm diameter that are more nearly monodisperse than any made before and assembled into colloidal crystals. Composite polymer spheres will be created by nucleation of emulsion polymerization of styrene and with dendritic macromolecules. A third phase of metal or semiconductor nanoparticles about 2nm in diameter also may be created in the demdrimer phase. The new materials are expected to self-assemble into colloidal crystalline arrays in which all three components fit the same crystal lattice. The lattice dimensions will depend on the concentration of latex particles. The new materials may serve as calibration standards for electron microscopy, optical filters and switches that operate at US-visible wavelengths, templates for the synthesis of photonic bandgap materials and catalysts for reactions in aqueous media.

Sponsor: OSU Center of Energy Research

PI: Warren Ford

 

New Materials from Radical Chain Polymerizations

This research will create three new types of polymers and test their optical and mechanical properties for potential use in optical communication devices and in improved plastics. The new materials will be: 1) Composites of silica in clear acrylic polymer matrices; 2) Polymers that incorporate C60 (the most common Buckminsterfullerene); and 3) Nanoparticles one millionth of an inch in diameter that are single polymer chains.

Sponsor: National Science Foundation

PI: Warren Ford

 

Radical Routes to New Copolymeric Materials

Two new types of polymers will be synthesized and characterized. Copolymers formed by emulsion polymerization, which has been used for the manufacture of synthetic rubber latex and coatings for more than fifty years, may provide a low cost alternative to the block copolymers that are used now to stabilize polymer blends. Model polyampholytes will be synthesized to enable testing of current theory of their structures and properties in aqueous solutions.

Sponsor: National Science Foundation

PI: Warren Ford

 

Molecular Laboratory Experiments in Chemistry

This project addresses four perceived problems in instruction at the introductory level in chemistry: 1) Curriculum materials that will support an inquiry oriented instructional strategy; 2) The difficulty students have linking macroscopic, microscopic and symbolic levels of understanding; 3) Computer based instructional materials that are simple, dynamic and interactive; and 4) Identification and addressing of student’s misconceptions. Instructional materials implemented follow a macroscopic (sensory)/microscopic/symbolic inquiry-oriented laboratory based model. Specifically the development of eight Molecular Level Experiment (MoLE) simulations: Gas Laws, Gas Phase Equilibrium, Kinetics, Atomic Structure and Periodcity, Acid-Base Chemistry, Calorimetry, Electrochemistry and Molecular and Solid State Structure. Each MoLE includes a powerful, interactive, dynamic computer simulation and is accompanied by a guided and open-inquiry activity.

Sponsor: National Science Foundation

PI: John Gelder

 

Advanced Nanostructured Hybrid Coatings for the Protection of Aircraft Aluminum Alloys

This project seeks to average DEPSCoR funding aimed at the preparation and evaluation of advanced hybrid coatings that are: 1) Environmentally-compliant; 2) Serve as an effective barrier layer and are readily incorporated into a multi-layer paint system; and 3) Contain a reservoir of nanoengineered structures targeted to provide electrochemically-active corrosion inhibitors “on demand” in the case of a barrier layer breach. The research also supports the complementary materials and surface modification research programs in a multidisciplinary approach aimed at the development of advanced corrosion-mitigating nanotechnology hybrid coatings systems containing a “release on demand” reservoir of the electrochemically-active corrosion inhibitors and employ a series of chemical investigations that specifically seek to elucidate the mechanism of enhanced corrosion resistance properties that have been observed in such film systems to date.

Sponsors: DEPSCoR, Air Force Office of Scientific Research

PI: Nicholas Kotov

 

All Fiber Faraday Rotator from Nanostructured Hybrid Films

In order to combine the benefits offered by iron garnet materials and those of all-fiber devices, a new approach to the design of the MO Faraday rotator will be studied. The new type of Faraday rotator will take advantage of interaction of the evanescent filed on the surface of specially prepared fiber with a thin hybrid film of YIG nanoparticles. The objectives of the project will permit addressing the development of the evanescent field MO devices, as well as expanding the range of applications of nanostructured materials to fiber optics.

Sponsors: Oklahoma Center for the Advancement of Science and Technology, Williams Telecommunications

PI: Nicholas Kotov

 

Corrosion Preventative Coatings

Coating systems comprising an inhibitor-doped layer-by-layer (LBL) assembly basecoat and a dense organically-modified silicate (Ormosil) topcoat were investigated as corrosion resistant coatings for 2024-T3 aluminum alloy. A combination of the two coating methods was found to produce a synergistic enhancement of corrosion resistance characteristics, as determined using electrochemical techniques. Incorporation of an active corrosion inhibitor into the LBL layer was found to significantly improve corrosion resistance properties.

Sponsor: Sciperio

PI: Nicholas Kotov

 

New Materials for Photonics

This project will study an integrated approach to the study and design of new optical and optoelectronic materials in the university environment.  The primary goals for this research is the development of structural characterization and diversification of nanparticles modified by metal complexes and to study their photochemical and photophysical properties.

Sponsor: National Sciences Foundation

PI: Nicholas Kotov

 

Phase II: Layer-By-Layer Assembled Films for Light Emitting Diodes from Semiconductor Nanoparticles

Light emitting diodes, LEDs, from poly (phenylene vinylene) and CdSe/CdS nanoparticles will be made using layer-by-layer assembly technique, LBL. This thin film deposition method afford preparation of pinhole free molecularly organized layers with superior structural, optical and electrical characteristics. The primary research effort of this project will be focused on the improvement of the electron transport layer. Optimization of the multiplayer architecture of the electron layer is expected to improve the longevity of the device by the acceleration of heat dissipation in the thin film. Application of the LBL to the deposition of electron transfer layer can improve performance of LED as an element of flat panel displays, simplify R&D-to-production transition and reduce the cost of the product.

Sponsors: Nomadics, Air Force Office of Scientific Research

PI: Nicholas Kotov

 

Widegap Semiconductor III — Nitride Research

This research is aimed at the development of UV-blue range photonic and electronic materials and devices. The focus is III-nitride structures for applications in UV photodetectors, UV-blue laser diodes and high temperature electronics. AlGaN- and InGaN-based materials with large alloy concentration will be grown as well as nitride microstructure arrays. The final goal is to fabricate the prototype photonic devices. Time-resolved lasing and femtosecond pump-probe experiments are carried out for this goal and a theoretical model developed.

Sponsor: Air Force Office of Scientific Research

PI: Nicholas Kotov

 

Science and Engineering Research Center (SERC) for Durable Miniaturized Systems

The goal of this project is to establish an infrastructure for a distributed Center of Excellence for “Durable Miniaturized Systems” in the mid-west. Durability is defined as the synergistic reliable response of sub-systems as a function of operating time of the system, and it will be addressed through: 1) Establishing design and diagnostic tools at nano- and micro- dimensions; 2) Developing a knowledge base of the effects of substrate processing, integration and manufacturing parameters on durability; 3) Understanding the role of surfaces and interfaces within multi-domain/ multi-signal subsystems and systems; and 4) Investigating techniques for system prototyping.

Sponsors: University of Arkansas, National Science Foundation

PI: Nicholas Materer

 

Surface Photochemical Energy Transfer Mechanisms

This project will examine the surface photochemical decomposition of titanium and tantalum halides on silicon surface. There are three basic reaction steps that will be probed: 1) Absorption of the precursor; 2) Decomposition of the halide; and 3) Desorption of the unwanted halide. In addition to the fundamental science, two significant technological issues will be addressed.  These issues are the incorporation of interfacial segregation of precursors in the film at different stages of growth and the pre-nucleation phenomenon where chemical vapor deposition proceeds at an enhanced rate in locations previously exposed to optical radiation.

Sponsor: Environmental Institute

PI: Nicholas Materer

 

Development of a Novel Chemical Methodology for Discovery of Angiogenesis Drugs as a Sensor to Uncover the Mechanism of Angiogenesis

The major goal of this project is development of a new chemical methodology for discovery of antiangiogenesis drugs as a sensor to uncover the mechanism of angiogenesis.

Sponsor: Center for Sensors and Sensor Technologies

PI: Satomi Niwayama

 

A Novel Molecular Template for the Discovery of New Anticancer Drugs

A new methodology for synthesis of anticancer drugs will be developed in the research. Large libraries of chiral, small organic molecules with a drug-related structure, will be prepared based on a template molecule that was generated by a novel rearrangement.  This rearrangement is initiated by enzymatic hydrolysis, and renders large-scale production of the rearranged product in quite simple and mild conditions starting from inexpensive sources. Therefore, this method will not only increase the efficiency of the production of a diverse set of derivatives, but also lower the cost compared to the existing methods in drug discovery. The derivatives synthesized in this method will be screened for inhibitors of human papillomaviruses, and p210bcrabl kinase, in order to observe the preliminary results on the inhibitory effects.

Sponsor: Elsa U. Pardee Foundation

PI: Satomi Niwayama

 

Ocular Proteomics of Rodent Retina

The goal of this project is to define all the proteins expressed in rodent retinas in order to provide vision researchers with information regarding the proteins actually expressed in retinal cells.

Sponsors: National Institute for Health, University of Oklahoma Health Sciences Center

PI: Satomi Niwayama

 

Synthesis of Amino Acids Derivatives

This research is aimed at synthesizing an amino acid derivative as a precursor of an anti-HIV drug. Several seed experiments such as enzymatic reactions and resolution of a raccmic derivative for synthesis of the amino acid derivative were conducted.

Sponsor: Ono Pharmaceuticals

PI: Satomi Niwayama

 

Synthetic and Mechanistic Expansion of a New Energy-Conserving Reaction

The major goals of this project are synthetic and mechanistic expansion of the scope of a new two-phase monohydolysis reaction. Remarkable solvent effects, structural effects and the origin of the high selectivity, combining both synthetic organic chemistry and theoretical chemistry will be investigated.  Expanding the possibility of asymmetrical momhydrolysis using chiral phase-transfer reagents will also be explored.

Sponsor: Center for Energy Research

PI: Satomi Niwayama

 

Analytical Measurements Using Optical Dichroism

Optical dichroism is a very selective analytical method that focuses only on those compounds that simultaneously absorb electromagnetic radiation and are optically active. Because many compounds fail to satisfy both of these requirements, the number of possible analytes that can be detected is greatly reduced to the point that very frequently an assay can be done without separation of the compound from the mixture it happens to be in. A great many natural products do meet these requirements and are target analytes for detection using this method. The current emphasis is in the direction of biotechnology pharmaceutical products that are produced in the forms of pure enantiomers. The motivations for the productions of these products are their specificity of action, the potential toxicity of the other stereoisomer, and the provision of a longer patent life by the FDA for those manufacturers who choose to make chiral products. Our immediate interests are in oligopeptides and peptides as large as insulin.

Sponsor: State of Oklahoma

PI: Neil Purdie

 

Assays for Unsaturated Lipids: A Diagnostic Tool for Early Detection of Serum Lipid Disorders

Serum lipid disorders are accountable in the processes that initiate several debilitating diseases such as heart disease, cancer, diabetes, and mental disorders. The availability of a lipids specific diagnostic assay, routinely performed during regularly scheduled physical examinations, would be an indispensable aid as an early detection marker that would allow for earlier intervention thereby saving lives and reducing health care costs. With this goal in mind a routine clinical analysis procedure is being perfected in which the following serum lipids, free cholesterol, unsaturated cholesterol esters, triglycerides, polyunsaturated fatty acids (PUFA’s), and phospholipids are simultaneously determined in a straightforward, single step, non-enzymatic assay in which unsaturated chemical colored products are produced. Detection is done using a combination of absorbance and emission spectroscopies. Full range spectral data for serum samples that are representative of the various lipid disorders and disease states are subjected to successive Principal Component Analysis and Clustering Analysis algorithms. The diagnostic capability of the combined statistical analysis procedures is presented in the form of 2-D and 3-D cluster diagrams where relative spatial locations have been shown to correlate with specific lipid disorders.

Sponsor: State of Oklahoma

PI: Neil Purdie

 

Modeling of the Metal Cutting Process

Work on molecular dynamics (MD) simulations of the machining process. Objectives of the project are to advance the understanding of the machining process in general and, in particular, nanometeric cutting; and to model the submicron diamond turning process of both non-ferrous and semiconducting materials at the atomistic level

Sponsor: National Science Foundation

PIs: Lionel Raff

College of Architecture, Engineering and Technology: Ranga Komanduri

 

Cytochrome B5: A Case Study in Molecular Recognition

A project to develop the methodology for the bacterial expression of 13C-heme enriched b5 by combining the now elucidated biosynthetic pathway of heme and the special properties built in our expression system of the mitochondrial cytochrome b5. Expression of the cytochrome b5 gene turns on the synthesis of heme, which is then incorporated, in the over-expressed polypeptide, thus avoiding toxic concentrations of free macrocycle in the bacterial cell. Isotopically enriched heme will be used to develop new NMR spectroscopic studies of important heme proteins such as hemoglobin, myoglobin, and cytochromes b. Other types of spectroscopy such as infrared, resonance Raman, EPR and Möbauer will also benefit from the availability of isotopically enriched heme. Furthermore, radioiostopically enriched heme can be used to study the metabolism of heme, the influence of heme metabolism in diseases such as jaundice and prophyria, and the influence of heavy metals such as Pb and Cd in the metabolism of heme.

Sponsors: National Institute of Health, Oklahoma Center of the Advancement of Science and Technology (OCAST)

PI: Mario Rivera

 

Biochemical and Biophysical Characterization of Cytochrome b5 from Outer Mitochondrial Membrane

Membrane-anchored, mammalian cytochromes b5 are located in the endoplasmic reticulum and the outer membranes of mitochondria. Although MC cytochromes b5 have been identified from a number of mammalian sources the only OM cyt b5 that have been positively identified to date originates from rat liver. A systematic study will be conducted in which residues in the OM protein are replaced with the corresponding residues in the bovine Mc isoform. These studies will be preformed with the expectation of decreasing the stability and kinetic barriers for hemin release of rat OM cyt b5. It is also important to establish whether the biophysical properties of rat OM cyt b5 are restricted to this protein or rather are common to mitochondrial cytochromes b5. If the latter is true it would be an indication that nature has tailored these proteins for specific activity in the outer mitochondrial membrane. This would set the stage for future investigations regarding the specific function of these intriguing, yet poorly understood proteins.

Sponsor: National Science Foundation

PI: Mario Rivers

 

Star Schools: The New Millennium Oklahoma State University

This is a multi-departmental education project directed toward improving, via distance education, the science and mathematics preparation of in-service middle school science and mathematics teachers.

Sponsor: Department of Education

PIs: Smith Holt

Department of Physics: Bruce Ackerson

Arts & Sciences Extension: Robert Brown

Microbiology & Molecular Genetics: James Blankemeyer

Department of Mathematics: James Choike

Department of Chemistry: Mark Rockley

 

Theoretical Studies of Nitramine Crystals

The basic goal of this research is to develop accurate models that describe the crystalline states of nitramine and nitro compounds. The models are formulated such that the proper account for the fundamental thermodynamics, spectroscopic and kinetic properties of the solid, liquid and gaseous phases of these materials.

Sponsor: Army Research Office

PI: Donald L. Thompson

 

Theoretical Studies of the Sensitivity of Energetic Materials

The goal of this research is to develop accurate potential energy surfaces that describe the initial physical and chemical changes in ionic solids and H-bonded molecular crystals when subjected to heating or shocking.

Sponsor: Air Force Office of Scientific Research

PI: Donald L. Thompson

 

Theoretical Chemical Dynamics Studies of the Decomposition of Cyclic Nitramines

The focus of this research is on the development of theoretical methods for studying rates processes in large polyatimic molecules, particularly cyclic nitramines. The goal is to develop a better understanding of the fundamental chemical dynamics of decomposition reactions.

Sponsor: Army Research Office

PI: Donald L. Thompson

 

Theoretical Studies of the Behavior of Nanoenergetic Materials

The goal of this research is to develop models and methods for studying the chemical reactions occurring on and in nanoparticles composed of metals and energetic molecules, with and without polymer coatings.

Sponsor: Army Research Office

PI: Donald L. Thompson

 

Theoretical Chemical Dynamics Studies of Elementary Combustion Reactions

The goal of this research is to develop methods and perform studies of the reactions of polyatomic radicals involved in hydrocarbon combustion.

Sponsor: Department of Energy

PI: Donald L. Thompson

 

Theoretical Studies of Chemisorption of Small Molecules on Metal Surfaces

The goal of this research is to perform ab initio and dynamics studies of small molecules on metal surfaces.

Sponsor: Army Research Laboratory

PI: Donald L. Thompson