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Absorption and emission modulation in a MoS2–GaN (0001) heterostructure by interface phonon–exciton coupling
Article reporting the change in the transient absorption characteristics of monolayer MoS2 and the modified PL emission characteristics in a monolayer MoS2–GaN (0001) heterostructure due to the coupling of carriers with the phonon modes and the energy exchange at the interface. The results demonstrate the relevance of interface coupling between the semiconductors for the development of optical and electronic applications.
Date:
September 26, 2019
Creator:
Poudel, Yuba; Sławińska, Jagoda; Gopal, Priya; Seetharaman, Sairaman; Hennighausen, Zachariah; Kar, Swastik et al.
Object Type:
Article
System:
The UNT Digital Library
Aluminum and Copper Chemical Vapor Deposition on Fluoropolymer Dielectrics and Subsequent Interfacial Interactions
This study is an investigation of the chemical vapor deposition (CVD) of aluminum and copper on fluoropolymer surfaces and the subsequent interfacial interactions.
Date:
December 1997
Creator:
Sutcliffe, Ronald David
Object Type:
Thesis or Dissertation
System:
The UNT Digital Library
Analyzing existing support structures for transfer students in Chemistry between the University of North Texas and Dallas College
Data management plan for a grant seeking to analyze existing support structures for transfer students in Chemistry between the University of North Texas and Dallas College.
Date:
2022-12-01/2023-11-30
Creator:
Atkinson, Molly B.
Object Type:
Text
System:
The UNT Digital Library
Apparent Specific Volumes of Sucrose in Different Aqueous Cosolvent Mixtures at 298.2 K
This article explores research to determine the apparent specific volume of sucrose by measuring the density of sucrose in {cosolvent + water} mixtures at 298.2 K. The study finds that a mean apparent specific volume value of 0.632 cm³.g⁻¹ for sucrose in different aqueous-cosolvent mixtures could be adequate for practical purposes in pharmaceutical industries.
Date:
December 30, 2018
Creator:
Tinjacá, Darío; Muñoz, María M.; Martínez, Fleming; Jouyban, Abolghasem & Acree, William E. (William Eugene)
Object Type:
Article
System:
The UNT Digital Library
Application of a General Computer Algorithm Based on the Group-Additivity Method for the Calculation of Two Molecular Descriptors at Both Ends of Dilution: Liquid Viscosity and Activity Coefficient in Water at Infinite Dilution
This paper presents the application of a commonly used computer algorithm based on the group-additivity method for the calculation of the liquid viscosity coefficient at 293.15 K and the activity coefficient at infinite dilution in water at 298.15 K or organic molecules.
Date:
December 10, 2017
Creator:
Naef, Rudolf & Acree, William E. (William Eugene)
Object Type:
Article
System:
The UNT Digital Library
Bulky Lesion Bypass Requires Dpo4 Binding in Distinct Conformations
Article describes study where researchers used single-molecule florescence resonance energy transfer (smFRET) experiments, classical molecular dynamics simulations, and nucleotide incorporation assays to investigate the mechanism by which the model Y-family polymerase, Dpo4, bypasses a (+)-cis-Benzo[a]pyrene (B[a]P)-N 2-dG adduct in DNA.
Date:
December 12, 2017
Creator:
Liyanage, Pramodha S.; Walker, Alice R.; Brenlla, Alfonso; Cisneros, Gerardo Andrés; Romano, Louis J. & Rueda, David S.
Object Type:
Article
System:
The UNT Digital Library
Carbon-Hydrogen Bond Activation, C-N Bond Coupling, and Cycloaddition Reactivity of a Three-Coordinate Nickel Complex Featuring a Terminal Imido Ligand
In this study, we describe reaction chemistry of the first nickel(II) complexes having a terminally bound imido ligand, (dtbpe)Ni=NR (R = 2,6-ⁱPr₂C₆H₃, 2,3,6-Me₃C₆H₂ (Mes), and Ad) with various small unsaturated molecules.
Date:
December 1, 2014
Creator:
Mindiola, Daniel J.; Waterman, Rory; Iluc, Vlad M.; Cundari, Thomas R., 1964- & Hillhouse, Gregory L.
Object Type:
Article
System:
The UNT Digital Library
Carbon-Oxygen Bond Formation via Organometallic Baeyer-Villiger Transformations: A Computational Study on the Impact of Metal Identity
Article discussing a computational study on the impact of metal identity and carbon-oxygen bond formation via organometallic Baeyer-Villiger transformations.
Date:
December 20, 2011
Creator:
Figg, Travis M.; Webb, Joanna R.; Cundari, Thomas R., 1964- & Gunnoe, T. Brent
Object Type:
Article
System:
The UNT Digital Library
Characterization of Reaction Pathways on the Potential Energy Surfaces for H + SO2 and HS + O2
Article on the characterization of reaction pathways on the potential energy surfaces for H + SO2 and HS + O2.
Date:
December 7, 1999
Creator:
Goumri, Abdellatif; Rocha, John-David Ray; Laakso, Dianna; Smith, C. E. & Marshall, Paul
Object Type:
Article
System:
The UNT Digital Library
The chemical coupling between moist CO oxidation and gas-phase potassium sulfation
Article discusses how the chemical coupling between moist CO oxidation and transformation of gaseous potassium salts (KCl or KOH) in the presence and absence of SO2 was investigated experimentally and through chemical kinetic modeling. Analysis of the calculations indicates that sulfation pathways in the model involving KOSO3 contribute to the overprediction, but both the thermodynamic properties and rate constants in the model involve significant uncertainties and more work is required to resolve the discrepancy.
Date:
December 15, 2022
Creator:
Chanpirak, Arphaphon; Hashemi, Hamid; Frandsen, Flemming; Wu, Hao; Glarborg, Peter & Marshall, Paul
Object Type:
Article
System:
The UNT Digital Library
Comment on "Measurement and correlation of the solubility of p-coumaric acid in nine pure and water + ethanol mixed solvents at temperatures from 293.15 to 333.15 K"
This article provides comments on the article "Measurement and correlation of the solubility of p-coumaric acid in nine pure and water + ethanol mixed solvents at temperatures from 293.15 to 333.15 K" published in the Journal of Chemical and Engineering Data in 2016.
Date:
December 7, 2016
Creator:
Acree, William E. (William Eugene); Barrera, Maribel & Abraham, M. H. (Michael H.)
Object Type:
Article
System:
The UNT Digital Library
Comments Concerning "Fluorescent Probe Studies on the Microstructure of Polystyrene-Poly (vinylpyridine) Diblock Copolymer Film"
This article provides comments on "Fluorescent Probe Studies on the Microstructure of Polystyrene-Poly (vinylpyridine) Diblock Copolymer Film," published in 'Macromolecules,' 1992.
Date:
December 1993
Creator:
Acree, William E. (William Eugene); Tucker, Sheryl A. (Sheryl Ann) & Wilkins, Denise C.
Object Type:
Article
System:
The UNT Digital Library
Comments on “What if Cocrystallization Fails for Neutral Molecules? Screening Offered Eutectics as Alternate Pharmaceutical Materials: Leflunomide-A Case Study”
Features commentary on the previously published article "What if Cocrystallization Fails for Neutral Molecules? Screening Offered Eutectics as Alternate Pharmaceutical Materials: Leflunomide-A Case Study”
Date:
December 2019
Creator:
Acree, William E. (William Eugene) & Jouyban, Abolghasem
Object Type:
Article
System:
The UNT Digital Library
A Computational Investigation of the Molecular Geometry and Rotational Barriers in Ethylmethyl Ether
Article on a computational investigation of the molecular geometry and rotational barriers in ethyl methyl ether.
Date:
December 1, 1993
Creator:
Stanton, C. L.; Marshall, Paul & Schwartz, Martin
Object Type:
Article
System:
The UNT Digital Library
Computational studies of the potential energy surface for O(¹D) + H₂S: Characterization of pathways involving H₂SO, HOSH, and H₂OS
Article on computational studies of the potential energy surface for O(¹D) + H₂S and the characterization of pathways involving H₂SO, HOSH, and H₂OS.
Date:
December 1, 1994
Creator:
Goumri, Abdellatif; Rocha, John-David Ray; Laakso, Dianna; Smith, C. E. & Marshall, Paul
Object Type:
Article
System:
The UNT Digital Library
Computational study of the gas-phase reactions of sulfuric acid with OH(ΠJ), O(3PJ), Cl(2P) and O(1D2) radicals
This article is about how rate coefficients for reactions of H2SO4 with OH, O(3P) and Cl radicals over 160–298 K were estimated computationally. The authors propose kOH = 8.5 × 10-14 exp(-50 K/T), kO = 1.1 × 10-12 exp(-5012 K/T) and kCl = 3.1 × 10-9 exp(-3314 K/T) cm3 molecule-1 s−1.
Date:
December 27, 2021
Creator:
Marshall, Paul & Burkholder, James B. (James Bart), 1954-
Object Type:
Article
System:
The UNT Digital Library
Correlation of solute partitioning into isooctane from water and from the gas phase based on updated Abraham equations
This article discusses the correlation of solute partitioning into isooctane from water and from the gas phase based on updated Abraham equations.
Date:
December 1, 2011
Creator:
Stephens, Timothy W.; Wilson, Anastasia; Dabadge, Nishu; Tian, Amy; Zimmerman, Malcolm; Hensley, Hali J. et al.
Object Type:
Article
System:
The UNT Digital Library
Correlation of surface tension of mixed solvents with solvent composition
Article on the correlation of surface tension of mixed solvents with solvent composition.
Date:
December 1, 2004
Creator:
Jouyban, Abolghasem; Fathi-Azarbayjani, Anahita; Barzegar-Jalali, Mohammad & Acree, William E. (William Eugene)
Object Type:
Article
System:
The UNT Digital Library
A Coupled-Cluster Study of the Enthalpy of Formation of Nitrogen Sulfide, NS
Article on a coupled-cluster study of the enthalpy of formation of nitrogen sulfide, NS.
Date:
December 20, 2002
Creator:
Peebles, Lynda R. & Marshall, Paul
Object Type:
Article
System:
The UNT Digital Library
The Crucial Role of Solvation Forces in the Steric Stabilization of Nanoplatelets
Article says that the steric stability of inorganic colloidal particles in an apolar solvent is usually described in terms of the balance between three contributions: the van der Waals attraction, the free energy of mixing, and the ligand compression. The authors demonstrate that for sufficiently large nanoplatelets, solvation forces are proportional to the interacting facet area, and their strength is intrinsically tied to the softness of the ligand shell.
Date:
December 9, 2022
Creator:
Petersen, Nanning; Girard, Martin; Riedinger, Andreas & Valsson, Omar
Object Type:
Article
System:
The UNT Digital Library
Descriptors for the Prediction of Partition Coefficients and Solubilities of Organophosphorus Compounds
This article discusses the determination of Abraham descriptors for several series of organophosphorus compounds.
Date:
December 19, 2011
Creator:
Abraham, M. H. (Michael H.) & Acree, William E. (William Eugene)
Object Type:
Article
System:
The UNT Digital Library
Development of Abraham model correlations for solvation characteristics of linear alcohols
This article discusses the development of Abraham model correlations for solvation characteristics of linear alcohols.
Date:
December 15, 2009
Creator:
Sprunger, Laura M.; Achi, Sai S.; Pointer, Racheal; Blake-Taylor, Brooke H.; Acree, William E. (William Eugene) & Abraham, M. H. (Michael H.)
Object Type:
Article
System:
The UNT Digital Library
Enthalpies of combustion of 2-iodosobenzoic acid and 4-nitrosophenol: the dissociation enthalpy of the I-O bond
Article on the enthalpies of combustion of 2-iodosobenzoic acid and 4-nitrosophenol and the dissociation enthalpy of the I-O bond.
Date:
December 1, 1999
Creator:
Silva, Maria D. M. C. Ribeiro da; Matos, M. Agostinha R.; Ferrão, Maria Luísa C. C. H.; Amaral, Luísa M. P. F.; Miranda, Margarida S.; Acree, William E. (William Eugene) et al.
Object Type:
Article
System:
The UNT Digital Library
Enthalpies of solution and enthalpies of solvation of organic solutes in ethylene glycol at 298.15 K: prediction and analysis of intermolecular interaction contributions
This article studies thermochemistry of solvation of inert gases and organic solutes in ethylene glycol was thoroughly studied using solution calorimetry technique.
Date:
December 24, 2016
Creator:
Stolov, Mikhail; Zaitseva, Ksenia V.; Varfolomeev, Mikhail A. & Acree, William E. (William Eugene)
Object Type:
Article
System:
The UNT Digital Library