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Advanced NMR approaches in the characterization of coal. Final technical report, September 1, 1990--August 31, 1993 (open access)

Advanced NMR approaches in the characterization of coal. Final technical report, September 1, 1990--August 31, 1993

This project addressed two main goals and one much smaller one. The main goals were (1) to improve the significance, reliability and information content in high-resolution NMR (nuclear magnetic resonance) characterization of coal samples and (2) to develop chemically informative NMR imaging techniques for coal. The minor goal was to explore advanced features of dynamic nuclear polarization (DNP) as a technique for coal characterization; this included the development of two DNP probes and the examination of DNP characteristics of various carbonaceous samples, including coals. {sup 13}C NMR advances for coal depended on large-sample MAS devices, employing either cross-polarization (CP) or direct polarization (DP) approaches. CP and DP spin dynamics and their relationships to quantitation and spin counting were elucidated. {sup 1}H NMR studies, based on CRAMPS, dipolar dephasing and saturation with perdeuteropyridine, led to a {sup 1}H NMR-based elucidation of chemical functionality in coal. {sup 1}H and {sup 13}C NMR imaging techniques, based on magic-angle spinning and rotating magnetic field gradients, were developed for introducing chemical shift information (hence, chemical detail) into the spatial imaging of coal. The TREV multiple-pulse sequence was found to be useful in the {sup 1}H CRAMPS imaging of samples like coal.
Date: September 30, 1993
Creator: Maciel, G. E.
System: The UNT Digital Library
Analyses of Coals in the United States with Descriptions of Mine and Field Samples Collected between July 1, 1904 and June 30, 1910: Part 1. -- Analyses (open access)

Analyses of Coals in the United States with Descriptions of Mine and Field Samples Collected between July 1, 1904 and June 30, 1910: Part 1. -- Analyses

From Significance and value of Analyses of Coal: "The analyses published in this report cover samples of coal collected in many different parts of the country with unusual care by experiences men, in such manner as to make them representative of extensive beds of coal."
Date: 1913
Creator: Lord, N. W.
System: The UNT Digital Library
Capillary discharge extreme ultraviolet lasers. [Colorado State Univ. , Ft. Collins] (open access)

Capillary discharge extreme ultraviolet lasers. [Colorado State Univ. , Ft. Collins]

The project objective is to explore the generation of soft X-ray laser radiation in a plasma column created by a fast capillary discharge. The proposed capillary lasing scheme offers the potential for compact, simple and efficient soft X-ray laser sources. For this purpose a compact, fast pulse generator which produces 100 kA current pulses with a risetime of 11 ns was constructed. Initial experiments were conducted in evacuated capillaries, in which the plasma is produced by ablation of the capillary walls. The soft X-ray emission from discharges in polyethylene capillary channels was studied to investigate the possibility of amplification in the 3-2 transition of C VI, at {lambda} = 18.2 nm. Time-resolved spectra in which this transition appears anomalously intense with respect to the 4--2 transition of the same ion were obtained. To date, however, this phenomenoa could not be confirmed as gain, as the intensity of the 18.2 nm line has not been observed to increase exponentially as a function of the capillary length. Encouraging results were obtained by fast pulse discharge excitation of capillaries filled with preionized gas. High temperature (Te > 150 eV), small diameter ({approximately}200 {mu}m) plasma columns were efficiently generated. Fast current pulse excitation of …
Date: August 1, 1992
Creator: Rocca, J. J.
System: The UNT Digital Library
Capillary discharge extreme ultraviolet lasers. Progress report, December 15, 1991--December 14, 1992 (open access)

Capillary discharge extreme ultraviolet lasers. Progress report, December 15, 1991--December 14, 1992

The project objective is to explore the generation of soft X-ray laser radiation in a plasma column created by a fast capillary discharge. The proposed capillary lasing scheme offers the potential for compact, simple and efficient soft X-ray laser sources. For this purpose a compact, fast pulse generator which produces 100 kA current pulses with a risetime of 11 ns was constructed. Initial experiments were conducted in evacuated capillaries, in which the plasma is produced by ablation of the capillary walls. The soft X-ray emission from discharges in polyethylene capillary channels was studied to investigate the possibility of amplification in the 3-2 transition of C VI, at {lambda} = 18.2 nm. Time-resolved spectra in which this transition appears anomalously intense with respect to the 4--2 transition of the same ion were obtained. To date, however, this phenomenoa could not be confirmed as gain, as the intensity of the 18.2 nm line has not been observed to increase exponentially as a function of the capillary length. Encouraging results were obtained by fast pulse discharge excitation of capillaries filled with preionized gas. High temperature (Te > 150 eV), small diameter ({approximately}200 {mu}m) plasma columns were efficiently generated. Fast current pulse excitation of …
Date: August 1, 1992
Creator: Rocca, J. J.
System: The UNT Digital Library
Catalytic applications of mono- and dinuclear complexes containing metal-carbon sigma bonds. Final report, November 1, 1993--October 31, 1996 (open access)

Catalytic applications of mono- and dinuclear complexes containing metal-carbon sigma bonds. Final report, November 1, 1993--October 31, 1996

This report discusses results from several studies involved in the project. Investigations include: vibrational models for surface olefins and alkylidenes; mechanism of the formation and fragmentation of diosmacyclobutanes; reaction of dienes and allenes with diosmacyclobutanes; determination by nematic phase NMR of the structure of mononuclear and dinuclear ethylene complexes of osmium; and generation of ``coordinatively unsaturated`` complexes by protonation of methyl osmium complexes.
Date: December 31, 1996
Creator: Norton, J.R.
System: The UNT Digital Library
Chemically modified electrodes and related solution studies (open access)

Chemically modified electrodes and related solution studies

This report is divided into 5 sections: Ru[sub 4]/Fe complexes of tetra(4[prime]-methyl-2,2[prime]-bipyridine)porphyrin--catalytic epoxidation of olefins; water oxidation catalysis by doubly linked [mu]-oxo ruthenium complexes; polymer films formed by oxidation of transition metal electrodes into solutions of bisbipyridinealkane ligands; polymer films containing [CpMo([mu]-S)][sub 2]S[sub 2]CHR dinuclear clusters;and conducting polymer films for catalyst incorporation.
Date: April 1, 1993
Creator: Elliott, C.M.
System: The UNT Digital Library
Chemically modified electrodes and related solution studies. Final technical report, January 15, 1991--January 14, 1992 (open access)

Chemically modified electrodes and related solution studies. Final technical report, January 15, 1991--January 14, 1992

This report is divided into 5 sections: Ru{sub 4}/Fe complexes of tetra(4{prime}-methyl-2,2{prime}-bipyridine)porphyrin--catalytic epoxidation of olefins; water oxidation catalysis by doubly linked {mu}-oxo ruthenium complexes; polymer films formed by oxidation of transition metal electrodes into solutions of bisbipyridinealkane ligands; polymer films containing [CpMo({mu}-S)]{sub 2}S{sub 2}CHR dinuclear clusters;and conducting polymer films for catalyst incorporation.
Date: April 1, 1993
Creator: Elliott, C. M.
System: The UNT Digital Library
Cross-Spectral Study of the Spatial Relationships in the North Pacific Sea-Surface Temperature Anomaly Field. Report No. 23 (open access)

Cross-Spectral Study of the Spatial Relationships in the North Pacific Sea-Surface Temperature Anomaly Field. Report No. 23

Cross-spectral analysis is used to examine the dependence of the temporal covariation of sea-surface temperature (SST) anomalies at pairs of spatially separated points in the North Pacific on (1) the time scale of the variations, (2) the relative displacement of the points and (3) their location within the North Pacific basin. Spatial scales considered here range from 1000 kilometers up to the width of the basin. The study focuses on cross-spectral estimates for the interannual frequency band, 0.125-0.75 yr/sup -1/ although estimates for three other bands spanning higher frequencies are also examined.
Date: March 1, 1980
Creator: Middleton, John W.
System: The UNT Digital Library
Design, Construction, and Testing of a Residential Solar Heating and Cooling System. Progress Report, 1 September 1973--31 January 1974 (open access)
Detection of blockages in process piping Los Alamos National Laboratory. Final report (open access)

Detection of blockages in process piping Los Alamos National Laboratory. Final report

The attached reports and proposal summarize the work to date for the revised Ultrasonic Resonance Interferometry system. The most recent set of experiments, to determine the accuracy of the implementation of a new calibration curve to account for the variation of the wave speed with temperature, were never completed due to lack of funding. The general focus of the ongoing work, outlined in the weekly reports, had been improvements in accuracy of the measurement system using software modifications. The future focus of the project, as outlined in the attached proposal, was to incorporate a thermal conductivity probe with the ultrasonic measurement system to allow measurement of fluids which have a bimodal wavespeed vs. molarity relation.
Date: October 1, 1994
Creator: Histand, M.B.
System: The UNT Digital Library
Development of a gas-to-particle conversion model for use in three-dimensional global sulfur budget studies. Final report, 1 August 1991--30 June 1992 (open access)

Development of a gas-to-particle conversion model for use in three-dimensional global sulfur budget studies. Final report, 1 August 1991--30 June 1992

A fully-parameterized model for the formation and growth of aerosols via gas-to-particle conversion has been developed and tested. A particularly significant contribution is a new method for the prediction of numbers of particles nucleated using information on the vapor source rate, relative humidity, and preexisting aerosol alone, thus eliminating the need to solve a system of coupled ODEs. Preliminary tests indicate substantial reduction in computational costs, but it is recommended that the BIMODAM model be incorporated into a large-scale model of the sulfur cycle in order to more fully test its computational feasibility.
Date: August 1, 1993
Creator: Kreidenweis, S. M.
System: The UNT Digital Library
Development of a kinetic model and calculation of radiation dose estimates for sodium iodide-{sup 131}I in athyroid individuals (open access)

Development of a kinetic model and calculation of radiation dose estimates for sodium iodide-{sup 131}I in athyroid individuals

The treatment for some thyroid carcinomas involves surgically removing the thyroid gland and administering the radiopharmaceutical Sodium iodide-{sup 131}I (NaI). A diagnostic dose of NaI is given to the patient to determine if remnant tissue from the gland remains or larger doses are administered in order to treat the malignant tissue. Past research regarding NaI uptake and retention in euthyroid individuals (normal functioning thyroid) reveal that radioiodine concentrates mainly in the thyroid tissue and the remaining material is excreted from the body. The majority of radioiodine in athyroid (without thyroid) individuals is also eliminated from the body; however, there has been recent evidence of a long-term retention phase for individuals with no radioiodine concentrating tissue. The general purpose of this study was to develop a kinetic model and estimate the absorbed dose to athyroid individuals regarding the distribution and retention of NaI.
Date: July 1, 1997
Creator: Rodriguez, M.
System: The UNT Digital Library
Diosmacycloalkanes as models for the formation of hydrocarbons from surface methylenes (open access)

Diosmacycloalkanes as models for the formation of hydrocarbons from surface methylenes

We are making progress on our investigation of the mechanism of olefin exchange with Os{sub 2}(C{sub 2}H{sub 4})(CO){sub 8}. We are probing this system by kinetic study of the reaction of Os{sub 2}(C{sub 2}H{sub 4})(CO){sub 8} with butyl acrylate (BA) under various pressures of ethylene.
Date: May 1, 1992
Creator: Norton, J.R.
System: The UNT Digital Library
Diosmacycloalkanes as models for the formation of hydrocarbons from surface methylenes (open access)

Diosmacycloalkanes as models for the formation of hydrocarbons from surface methylenes

We have obtained a neutron diffraction data set for Os{sub 2}(CO){sub 8}({mu}-C{sub 2}H{sub 4}). While the structure is still being solved, it is already clear that the hybridization at both of the ethylene carbons is sp{sup 3}. Our first interpretation of our liquid crystal NMR results had suggested a very acute H-C-H angle. We have also obtained {sup 13}C liquid crystal data for Os{sub 2}(CO){sub 8}({mu}-C{sub 2}H{sub 4}). Liquid crystal NMR ({sup 13}C as well as {sup 1}H) spectra have been obtained for Os(CO){sub 4}(C{sub 2}H{sub 4}) and its solution structure determined, in order to test our methodology on a molecule with a rigid structure. The normal modes of Os(CO){sub 4}({mu}-C{sub 2}H{sub 4}) and its deuterated and {sup 13}C-labelled isotopomers have been completely assigned. A partial vibrational analysis of Os{sub 2}(CO){sub 8}({mu}-propene), Os{sub 2}(CO){sub 8}(trans-2-butene), and Os{sub 2}(CO){sub 8}(1-butene) has been completed. We have prepared Os(CO){sub 4}({mu}-CH{sub 2}CH{sub 2}CH{sub 2}) and its 3,3-dideuterio analog. In the course of this work the reaction of Na{sub 2}Os(CO){sub 4} with a number of 1,3-propanediol derivatives has been examined. 1,3-Propanediol ditosylate afforded much better yields of the osmacycle than did either the ditriflate or diiodide. 2,2-Dideutero-1,3-propanediol ditosylate was used to prepare the deuterium-labelled osmacyclobutane.
Date: January 1, 1989
Creator: Norton, J.R.
System: The UNT Digital Library
Diosmacycloalkanes as models for the formation of hydrocarbons from surface methylenes (open access)

Diosmacycloalkanes as models for the formation of hydrocarbons from surface methylenes

The report is divided into: vibrational models for surface ethylidenes (on catalyst surfaces); alpha vs beta hydrogen elimination in formation of propene from an osmacyclobutane; mechanism of formation and fragmentation of diosmacyclobutanes; reaction of dienes and allenes with diosmacyclobutanes; structure of Os(CO)[sub 4](C[sub 2]H[sub 4]), an osmacyclopropane; and reaction of [mu]-oxobis [(trifluoromethanesulfanato) (phenyl)iodine(III)] with Group 14 propargyl derivatives and a propargyl ether. 16 refs, figs.
Date: May 1, 1993
Creator: Norton, J.R.
System: The UNT Digital Library
Diosmacycloalkanes as models for the formation of hydrocarbons from surface methylenes. Final report (open access)

Diosmacycloalkanes as models for the formation of hydrocarbons from surface methylenes. Final report

Assignment of the vibrational modes Of Os{sub 2}(CO){sub 8}(CHCH{sub 3}) and Os(CO){sub 4}(C{sub 2}H{sub 4)} has given fingerprint vibrational spectra for the following species when chemisorbed on metal catalyst surfaces: ethylidene and ethylene bound in a metallacyclopropane mode. The formation and fragmentation of diosmacyclobutanes have been shown to involve slippage of the outgoing olefin onto a single osmium, and associative exchange of the olefin from that site. The incorporation of vinylcyclopropane without rearrangement has confirmed the absence of a diradical intermediate. The anomalous stability of the diosmacyclobutane derived from trans-2-butene has proven due to greater destabilization (by the substituent methyls) of the slipped intermediate than of the ground state. Reaction of an osmacyclobutane with 1,3- or 1,2-dienes (allenes) gives 1,2 rather than 1,4 addition to the diosmium unit. Treatment of Os(CO){sub 4}(C{sub 2}H{sub 4}) with triflic acid results in the formation of Os(CO){sub 4}(C{sub 2}H{sub 5})OTf. The authors have found that the reaction of an aryl iodine(III) reagent with propargyl stannanes or silanes results in o-iodo propargyl arenes.
Date: April 25, 1994
Creator: Norton, J. R.
System: The UNT Digital Library
Diosmacycloalkanes as models for the formation of hydrocarbons from surface methylenes. Progress report, April 1, 1988--March 31, 1989 (open access)

Diosmacycloalkanes as models for the formation of hydrocarbons from surface methylenes. Progress report, April 1, 1988--March 31, 1989

We have obtained a neutron diffraction data set for Os{sub 2}(CO){sub 8}({mu}-C{sub 2}H{sub 4}). While the structure is still being solved, it is already clear that the hybridization at both of the ethylene carbons is sp{sup 3}. Our first interpretation of our liquid crystal NMR results had suggested a very acute H-C-H angle. We have also obtained {sup 13}C liquid crystal data for Os{sub 2}(CO){sub 8}({mu}-C{sub 2}H{sub 4}). Liquid crystal NMR ({sup 13}C as well as {sup 1}H) spectra have been obtained for Os(CO){sub 4}(C{sub 2}H{sub 4}) and its solution structure determined, in order to test our methodology on a molecule with a rigid structure. The normal modes of Os(CO){sub 4}({mu}-C{sub 2}H{sub 4}) and its deuterated and {sup 13}C-labelled isotopomers have been completely assigned. A partial vibrational analysis of Os{sub 2}(CO){sub 8}({mu}-propene), Os{sub 2}(CO){sub 8}(trans-2-butene), and Os{sub 2}(CO){sub 8}(1-butene) has been completed. We have prepared Os(CO){sub 4}({mu}-CH{sub 2}CH{sub 2}CH{sub 2}) and its 3,3-dideuterio analog. In the course of this work the reaction of Na{sub 2}Os(CO){sub 4} with a number of 1,3-propanediol derivatives has been examined. 1,3-Propanediol ditosylate afforded much better yields of the osmacycle than did either the ditriflate or diiodide. 2,2-Dideutero-1,3-propanediol ditosylate was used to prepare the deuterium-labelled osmacyclobutane.
Date: January 1, 1989
Creator: Norton, J. R.
System: The UNT Digital Library
Diosmacycloalkanes as Models for the Formation of Hydrocarbons From Surface Methylenes. Progress Report, November 1, 1991--October 31, 1992 (open access)

Diosmacycloalkanes as Models for the Formation of Hydrocarbons From Surface Methylenes. Progress Report, November 1, 1991--October 31, 1992

We are making progress on our investigation of the mechanism of olefin exchange with Os{sub 2}(C{sub 2}H{sub 4})(CO){sub 8}. We are probing this system by kinetic study of the reaction of Os{sub 2}(C{sub 2}H{sub 4})(CO){sub 8} with butyl acrylate (BA) under various pressures of ethylene.
Date: May 1, 1992
Creator: Norton, J. R.
System: The UNT Digital Library
Diosmacycloalkanes as Models for the Formation of Hydrocarbons From Surface Methylenes. Progress Report, November 1, 1992--October 31, 1993 (open access)

Diosmacycloalkanes as Models for the Formation of Hydrocarbons From Surface Methylenes. Progress Report, November 1, 1992--October 31, 1993

The report is divided into: vibrational models for surface ethylidenes (on catalyst surfaces); alpha vs beta hydrogen elimination in formation of propene from an osmacyclobutane; mechanism of formation and fragmentation of diosmacyclobutanes; reaction of dienes and allenes with diosmacyclobutanes; structure of Os(CO){sub 4}(C{sub 2}H{sub 4}), an osmacyclopropane; and reaction of {mu}-oxobis [(trifluoromethanesulfanato) (phenyl)iodine(III)] with Group 14 propargyl derivatives and a propargyl ether. 16 refs, figs.
Date: May 1, 1993
Creator: Norton, J. R.
System: The UNT Digital Library
Effects of Vegetation of Radon Transport Processes in Soil: The Origins and Pathways of {Sup 222}Rn Entering Into Basement Structures. Final Report, March 15, 1987--May 15, 1993 (open access)

Effects of Vegetation of Radon Transport Processes in Soil: The Origins and Pathways of {Sup 222}Rn Entering Into Basement Structures. Final Report, March 15, 1987--May 15, 1993

The entry rate of {sup 22}Rn into a basement structure was measured continuously. These measurements demonstrated that radon entry did not vanish even when the structure was slightly pressurized. This persistent entry has been determined to be dominated by diffusion through the floor and walls and a combination of diffusion and convection through the floor-wall joint. The highest indoor radon concentrations occurred during calm periods when the pressure differentials between the inside and outside of the structure were small. The objectives of this work were to identify the origins of the radon and investigate the entry pathways. The radon could originate either in the concrete or in the soil surrounding the structure. Entry pathways into the basement were through the concrete floor and walls as well as through the floor-wall joint. The contributions of the origins and entry pathways were determined by continuously measuring the radon entry rate into the basement, using a trace gas system, and the flux density through portions of the floor and walls. Radon entry through the floor-wall joint could be controlled using a baseboard barrier system. Results indicated that, during calm conditions with wind speeds less than 1 m s{sup {minus}1}, 25 % of the …
Date: August 1, 1992
Creator: Borak, T. B.
System: The UNT Digital Library
Effects of Vegetation on Radon Transport Processes in Soil (open access)

Effects of Vegetation on Radon Transport Processes in Soil

A large component of radon entry cannot be explained by pressure differences between the soil and inside the structures. The persistence of this radon entry even when the house is pressurized by 1 Pa indicates that it must be due to molecular diffusion. The radon entry rate as measured by accumulators below ground level (soil + concrete) is roughly 2 times greater than that measured above ground level (concrete alone). The soil permeability is about 10{sup {minus}12} m{sup 2} and does not change dramatically with depth down to 2 m. The diffusion component of radon entry is reduced by about 30% when the floor wall joint is sealed. The Rn3D model is operating on our computer system and is being modified to accommodate the geometrical configurations of the underground test structure.
Date: January 1, 1991
Creator: Borak, T.B.
System: The UNT Digital Library
Evaluation of Aftermarket Fuel Delivery Systems for Natural Gas and Lpg Vehicles (open access)

Evaluation of Aftermarket Fuel Delivery Systems for Natural Gas and Lpg Vehicles

This study was designed to evaluate the effectiveness of aftermarket fuel delivery systems for vehicles fueled by compressed natural gas (CNG) and liquefied petroleum gas (LPG). Most of the CNG and LPG vehicles studied were converted to the alternative fuel after purchase. There are wide variations in the quality of the conversion hardware and the installation. This leads to questions about the overall quality of the converted vehicles, in terms of emissions, safety, and performance. There is a considerable body of emissions data for converted light-duty vehicles, and a smaller amount for medium- and heavy-duty vehicles. However, very few of these data involve real world conditions, and there is growing concern about in-use emissions. This report also attempts to assess factors that could allow in-use emissions to vary from the ``best-case`` results normally reported. The study also addresses issues of fuel supply, fuel composition, performance, safety, and warranty waivers. The report is based on an extensive literature and product survey and on the author`s experience with fuel delivery systems for light-duty vehicles.
Date: September 1, 1992
Creator: Willson, B.
System: The UNT Digital Library
Evaluation of Aftermarket Fuel Delivery Systems for Natural Gas and Lpg Vehicles (open access)

Evaluation of Aftermarket Fuel Delivery Systems for Natural Gas and Lpg Vehicles

This study was designed to evaluate the effectiveness of aftermarket fuel delivery systems for vehicles fueled by compressed natural gas (CNG) and liquefied petroleum gas (LPG). Most of the CNG and LPG vehicles studied were converted to the alternative fuel after purchase. There are wide variations in the quality of the conversion hardware and the installation. This leads to questions about the overall quality of the converted vehicles, in terms of emissions, safety, and performance. There is a considerable body of emissions data for converted light-duty vehicles, and a smaller amount for medium- and heavy-duty vehicles. However, very few of these data involve real world conditions, and there is growing concern about in-use emissions. This report also attempts to assess factors that could allow in-use emissions to vary from the best-case'' results normally reported. The study also addresses issues of fuel supply, fuel composition, performance, safety, and warranty waivers. The report is based on an extensive literature and product survey and on the author's experience with fuel delivery systems for light-duty vehicles.
Date: September 1, 1992
Creator: Willson, B. (Colorado State Univ., Fort Collins, CO (United States))
System: The UNT Digital Library