Ab Initio Calculations for Kinetic Modeling of Halocarbons (open access)

Ab Initio Calculations for Kinetic Modeling of Halocarbons

This book chapter discusses ab initio calculations for kinetic modeling of halocarbons.
Date: 1998
Creator: Berry, Rajiv; Schwartz, Martin & Marshall, Paul
Object Type: Book Chapter
System: The UNT Digital Library
Brittle and Ductile Behavior in Carbon Nanotubes (open access)

Brittle and Ductile Behavior in Carbon Nanotubes

Article discussing research on the response of carbon nanotubes to a tensile load.
Date: November 23, 1998
Creator: Buongiorno Nardelli, Marco; Yakobson, Boris I. & Bernholc, Jerry
Object Type: Article
System: The UNT Digital Library
Computational Investigations of Iodine Oxides (open access)

Computational Investigations of Iodine Oxides

Article on a computational investigations of iodine oxides.
Date: October 16, 1998
Creator: Misra, Ashutosh & Marshall, Paul
Object Type: Article
System: The UNT Digital Library
Computational studies of the reactions of CH3I with H and OH (open access)

Computational studies of the reactions of CH3I with H and OH

Article on computational studies of the reactions of CH3I with H and OH.
Date: March 26, 1998
Creator: Marshall, Paul; Misra, Ashutosh & Berry, Rajiv
Object Type: Article
System: The UNT Digital Library
Computational Study of the Kinetics of Hydrogen Abstraction from Fluoromethanes by the Hydroxyl Radical (open access)

Computational Study of the Kinetics of Hydrogen Abstraction from Fluoromethanes by the Hydroxyl Radical

Article on a computational study of the kinetics of hydrogen abstraction from fluoromethanes by the hydroxyl radical.
Date: November 13, 1998
Creator: Schwartz, Martin; Marshall, Paul; Berry, Rajiv; Ehlers, C. J. & Petersson, George A.
Object Type: Article
System: The UNT Digital Library
Descriptors for solutes from the solubility of solids: trans-stilbene as an example (open access)

Descriptors for solutes from the solubility of solids: trans-stilbene as an example

Article on descriptors for solutes from the solubility of solids and trans-stilbene as an example.
Date: 1998
Creator: Abraham, M. H. (Michael H.); Green, Caroline E.; Acree, William E. (William Eugene); Hernández, Carmen E. & Roy, Lindsay Elizabeth
Object Type: Article
System: The UNT Digital Library
Experimental and Computational Investigations of the Reaction of OH with CF3I and the Enthalpy of Formation of HOI (open access)

Experimental and Computational Investigations of the Reaction of OH with CF3I and the Enthalpy of Formation of HOI

Article on experimental and computational investigations of the reaction of OH with CF3I and the enthalpy of formation of HOI.
Date: June 11, 1998
Creator: Berry, Rajiv; Yuan, Jessie; Misra, Ashutosh & Marshall, Paul
Object Type: Article
System: The UNT Digital Library
Inhibition of Nonpremixed Hydrogen Flames by CF3Br (open access)

Inhibition of Nonpremixed Hydrogen Flames by CF3Br

This article discusses the inhibition of non-premixed hydrogen flames by CF3Br.
Date: August 1998
Creator: Truett, Leonard
Object Type: Article
System: The UNT Digital Library
Kinetic studies of the reaction of atomic hydrogen with trifluoroiodomethane (open access)

Kinetic studies of the reaction of atomic hydrogen with trifluoroiodomethane

This article discusses kinetic studies of the reaction of atomic hydrogen with trifluoroiodomethane.
Date: December 4, 1998
Creator: Yuan, Jessie; Wells, Leah & Marshall, Paul
Object Type: Article
System: The UNT Digital Library
Kinetics-Based Indirect Spectrophotometric Method for Simultaneous Determination of MnO4 (-) and Cr207 (2-): A Modern Instrumental Analysis Laboratory Experiment (open access)

Kinetics-Based Indirect Spectrophotometric Method for Simultaneous Determination of MnO4 (-) and Cr207 (2-): A Modern Instrumental Analysis Laboratory Experiment

Article on kinetics-based indirect spectrophotometric method for simultaneous determination of MnO4 (-) and Cr2O7 (2-) and a modern instrumental analysis laboratory experiment.
Date: April 1, 1998
Creator: Pandey, Siddharth; McHale, Mary E. R.; Horton, Ann-Sofi M.; Padilla, Sandra A.; Trufant, Ashantè L.; De La Sancha, Noé U. et al.
Object Type: Article
System: The UNT Digital Library
Lip-Lip Interactions and the Growth of Multiwalled Carbon Nanotubes (open access)

Lip-Lip Interactions and the Growth of Multiwalled Carbon Nanotubes

Article on lip-lip interactions and the growth of multiwalled carbon nanotubes.
Date: January 12, 1998
Creator: Buongiorno Nardelli, Marco; Brabec, Charles; Roland, Christopher & Bernholc, Jerry
Object Type: Article
System: The UNT Digital Library
Modeling Nonlinear Optical Properties of Transition Metal Complexes. Basis Set, Effective Core Potential, and Geometry Effects (open access)

Modeling Nonlinear Optical Properties of Transition Metal Complexes. Basis Set, Effective Core Potential, and Geometry Effects

Article discussing modeling nonlinear optical properties of transition metal complexes and the basis set, effective core potential, and geometry effects.
Date: April 4, 1998
Creator: Cundari, Thomas R., 1964-; Kurtz, Henry A. & Zhou, Tie
Object Type: Article
System: The UNT Digital Library
Molecular Modeling of Vanadium-Oxo Complexes. A Comparison of Quantum and Classical Methods (open access)

Molecular Modeling of Vanadium-Oxo Complexes. A Comparison of Quantum and Classical Methods

This article discusses molecular modeling of vanadium-oxo complexes and a comparison of quantum and classical methods.
Date: January 22, 1998
Creator: Cundari, Thomas R., 1964-; Saunders, Leah & Sisterhen, Laura L.
Object Type: Article
System: The UNT Digital Library
Quantitative Analysis Laboratory Experiment: Bilinear Regression Analysis as a Means to Reduce Matrix Effects in Simultaneous Spectrophotometric Determination of Cr(III) and Co(II) (open access)

Quantitative Analysis Laboratory Experiment: Bilinear Regression Analysis as a Means to Reduce Matrix Effects in Simultaneous Spectrophotometric Determination of Cr(III) and Co(II)

Article on bilinear regression analysis as a means to reduce matrix effects in simultaneous spectrophotometric determination of Cr(III) and Co(II) and a quantitative analysis laboratory experiment.
Date: July 1, 1998
Creator: Pandey, Siddharth; McHale, Mary E. R.; Coym, Karen S. & Acree, William E. (William Eugene)
Object Type: Article
System: The UNT Digital Library
[Review] Chemistry of Advanced Materials: An Overview (open access)

[Review] Chemistry of Advanced Materials: An Overview

This article reviews the book "Chemistry of Advanced Materials: An Overview," edited by Leonard V. Interrante and Mark J. Hampden-Smith.
Date: December 29, 1998
Creator: Cundari, Thomas R., 1964-
Object Type: Review
System: The UNT Digital Library
Solubility of Anthracene in Binary Alkane + 2-Ethyl-1-hexanol and Alkane + 1-Pentanol Solvent Mixtures at 298.2 K (open access)

Solubility of Anthracene in Binary Alkane + 2-Ethyl-1-hexanol and Alkane + 1-Pentanol Solvent Mixtures at 298.2 K

Article on the solubility of anthracene in binary alkane + 2-ethyl-1-hexanol and alkane + 1-pentanol solvent mixtures at 298.2 K.
Date: April 23, 1998
Creator: Roy, Lindsay Elizabeth; Hernández, Carmen E.; Reddy, Gaddum D.; Sanders, Jessica T.; Deng, Taihe; Tuggle, Michael B. et al.
Object Type: Article
System: The UNT Digital Library
Solubility of Anthracene in Ternary Propanol + 2,2,4-Trimethylpentane + Cyclohexane and Butanol + 2,2,4-Trimethylpentane + Cyclohexane Solvent Mixtures (open access)

Solubility of Anthracene in Ternary Propanol + 2,2,4-Trimethylpentane + Cyclohexane and Butanol + 2,2,4-Trimethylpentane + Cyclohexane Solvent Mixtures

Article on the solubility of anthracene in ternary propanol + 2,2,4-trimethylpentane + cyclohexane and butanol + 2,2,4-trimethylpentane + cyclohexane solvent mixtures.
Date: October 2, 1998
Creator: Deng, Taihe & Acree, William E. (William Eugene)
Object Type: Article
System: The UNT Digital Library
Solubility of Anthracene in Ternary Propanol + Butanol + 2,2,4-Trimethylpentane Solvent Mixtures (open access)

Solubility of Anthracene in Ternary Propanol + Butanol + 2,2,4-Trimethylpentane Solvent Mixtures

Article on the solubility of anthracene in ternary propanol + butanol + 2,2,4-trimethylpentane solvent mixtures.
Date: October 28, 1998
Creator: Deng, Taihe; Childress, Sabrina D.; De Fina, Karina M.; Sharp, Tina L. & Acree, William E. (William Eugene)
Object Type: Article
System: The UNT Digital Library
Solubility of Anthracene in Ternary Propanol + Butanol + Cyclohexane Solvent Mixtures (open access)

Solubility of Anthracene in Ternary Propanol + Butanol + Cyclohexane Solvent Mixtures

Article on the solubility of anthracene in ternary propanol + butanol + cyclohexane solvent mixtures.
Date: October 2, 1998
Creator: Deng, Taihe & Acree, William E. (William Eugene)
Object Type: Article
System: The UNT Digital Library
Structural Dichotomy in Six-Coordinate d⁰ Complexes: Trigonal Prismatic (ᵗBu₃SiC≡C)₆Ta⁻ and Octahedral (ᵗBu₃SiC≡C)₆M²⁻ (M = Zr, Hf) (open access)

Structural Dichotomy in Six-Coordinate d⁰ Complexes: Trigonal Prismatic (ᵗBu₃SiC≡C)₆Ta⁻ and Octahedral (ᵗBu₃SiC≡C)₆M²⁻ (M = Zr, Hf)

Article discussing structural dichotomy in six-coordinate d⁰ complexes and trigonal prismatic (ᵗBu₃SiC≡C)₆Ta⁻ and octahedral (ᵗBu₃SiC≡C)₆M²⁻ (M ≡ Zr, Hf).
Date: September 19, 1998
Creator: Vaid, Thomas P.; Veige, Adam S.; Lobkovsky, Emil B.; Glassey, Wingfield V.; Wolczanski, Peter T.; Liable-Sands, Louise M. et al.
Object Type: Article
System: The UNT Digital Library