States

Onset of Ferrielectricity and the Hidden Nature of Nanoscale Polarization in Ferroelectric Thin Films (open access)

Onset of Ferrielectricity and the Hidden Nature of Nanoscale Polarization in Ferroelectric Thin Films

Article on the onset of ferrielectricity and the hidden nature of nanoscale polarization in ferroelectric thin films.
Date: September 5, 2008
Creator: Nuñez, Matías & Buongiorno Nardelli, Marco
Object Type: Article
System: The UNT Digital Library
Dissociation of Water on Defective Carbon Substrates (open access)

Dissociation of Water on Defective Carbon Substrates

Article on the dissociation of water on defective carbon substrates.
Date: September 23, 2005
Creator: Kostov, Milen; Santiso, Erik; George, A. M.; Gubbins, Keith E. & Buongiorno Nardelli, Marco
Object Type: Article
System: The UNT Digital Library
Using Paired Depth Interviews to Collect Qualitative Data (open access)

Using Paired Depth Interviews to Collect Qualitative Data

This article defines and describes paired depth interviews, discusses conceptualizations of paired depth interviews using Roulston's framework, delineates the strengths and limitations of paired depth interviews, and provides examples of paired depth interviews utilized in helping professions.
Date: September 5, 2016
Creator: Wilson, Angela K.; Onwuegbuzie, Anthony J. & Manning, LaShondra P.
Object Type: Article
System: The UNT Digital Library
The relaxation of OH (v = 1) and OD (v = 1) by H2O and D2O at temperatures from 251 to 390 K (open access)

The relaxation of OH (v = 1) and OD (v = 1) by H2O and D2O at temperatures from 251 to 390 K

Article on the relaxation of OH (v = 1) and OD (v = 1) by H₂O and D₂O at temperatures from 251 to 390 K.
Date: June 30, 2006
Creator: McCabe, D. C.; Rajakumar, B.; Marshall, Paul; Smith, Ian W. M. & Ravishankara, A. R.
Object Type: Article
System: The UNT Digital Library
Reduced structural flexibility for an exonuclease deficient DNA polymerase III mutant (open access)

Reduced structural flexibility for an exonuclease deficient DNA polymerase III mutant

This article reports on the dynamics of E coli DNA polymerase III proofreading in the presence of its processivity factor, the β₂-sliding clamp, at varying base pair termini using single-molecule FRET.
Date: June 29, 2018
Creator: Gahlon, Hailey L.; Walker, Alice R.; Cisneros, Gerardo Andrés; Lamers, Meindert H. & Rueda, David S.
Object Type: Article
System: The UNT Digital Library
Experimental and Computational Studies of Ruthenium(II)-Catalyzed Addition of Arene C-H Bonds to Olefins (open access)

Experimental and Computational Studies of Ruthenium(II)-Catalyzed Addition of Arene C-H Bonds to Olefins

This article discusses experimental and computational studies of Ruthenium(II)-Catalyzed addition of arene C-H bonds to olefins.
Date: September 10, 2004
Creator: Lail, Marty; Bell, Christen M.; Conner, David; Cundari, Thomas R., 1964-; Gunnoe, T. Brent & Petersen, Jeffrey L.
Object Type: Article
System: The UNT Digital Library
Ruthenium(II)-Mediated Carbon-Carbon Bond Formation between Acetonitrile and Pyrrole: Combined Experimental and Computational Study (open access)

Ruthenium(II)-Mediated Carbon-Carbon Bond Formation between Acetonitrile and Pyrrole: Combined Experimental and Computational Study

This article discusses ruthenium(II)-mediated carbon-carbon bond formation between acetonitrile and pyrrole.
Date: September 13, 2005
Creator: Pittard, Karl A.; Cundari, Thomas R., 1964-; Gunnoe, T. Brent; Day, Cynthia S. & Petersen, Jeffrey L.
Object Type: Article
System: The UNT Digital Library
An ab Initio Investigation of Halocarbenes (open access)

An ab Initio Investigation of Halocarbenes

Article on an ab initio investigation of halocarbenes.
Date: September 10, 1999
Creator: Schwartz, Martin & Marshall, Paul
Object Type: Article
System: The UNT Digital Library
A Neoteric Neodymium Model: Ground and Excited Electronic State Analysis of NdF²⁺ (open access)

A Neoteric Neodymium Model: Ground and Excited Electronic State Analysis of NdF²⁺

This article studies neodymium monofluoride dictation as a model of the Nd-F bond in NDFₓ.
Date: May 10, 2013
Creator: Schoendorff, George; South, Christopher & Wilson, Angela K.
Object Type: Article
System: The UNT Digital Library
Kinetics and Thermochemistry of the Reaction Si(CH₃)₃ + HBr ⇋ Si(CH₃)₃H + Br: Determination of the (CH₃)₃Si-H Bond Energy (open access)

Kinetics and Thermochemistry of the Reaction Si(CH₃)₃ + HBr ⇋ Si(CH₃)₃H + Br: Determination of the (CH₃)₃Si-H Bond Energy

Article on kinetics and thermochemistry of the reaction Si(CH₃)₃ + HBr ⇋ Si(CH₃)₃H + Br and determination of the (CH₃)₃Si-H bond energy.
Date: September 1994
Creator: Kalinovski, Ilia J.; Gutman, D.; Krasnoperov, Lev N.; Goumri, Abdellatif; Yuan, W. J. & Marshall, Paul
Object Type: Article
System: The UNT Digital Library
Low Coordinate, Monomeric Molybdenum and Tungsten(III) Complexes: Structure, Reactivity and Calculational Studies of (silox)3Mo and (silox)3ML (M = Mo, W; L = PMe3, CO; silox = tBu3SiO) (open access)

Low Coordinate, Monomeric Molybdenum and Tungsten(III) Complexes: Structure, Reactivity and Calculational Studies of (silox)3Mo and (silox)3ML (M = Mo, W; L = PMe3, CO; silox = tBu3SiO)

This article discusses low coordinate, monomeric molybdenum and tungsten(III) complexes.
Date: September 6, 2008
Creator: Kuiper, David S.; Wolczanski, Peter T.; Lobkovsky, Emil B. & Cundari, Thomas R., 1964-
Object Type: Article
System: The UNT Digital Library
Catalytic Tuning of a Phosphinoethane Ligand for Enhanced C-H Activation (open access)

Catalytic Tuning of a Phosphinoethane Ligand for Enhanced C-H Activation

Article discussing research on the catalytic tuning of a phosphinoethane ligand for enhanced C-H activation.
Date: September 5, 2008
Creator: Cundari, Thomas R., 1964-; Jimenez-Halla, J. Oscar C.; Morello, Glenn R. & Vaddadi, Sridhar
Object Type: Article
System: The UNT Digital Library
Evidence for the Net Addition of Arene C-H Bonds across a Ru(II)-Hydroxide Bond (open access)

Evidence for the Net Addition of Arene C-H Bonds across a Ru(II)-Hydroxide Bond

Article discussing evidence for the net addition of Arene C-H bonds across a Ru(II)-Hydroxide bond.
Date: September 27, 2005
Creator: Feng, Yuee; Lail, Marty; Barakat, Khaldoon A.; Cundari, Thomas R., 1964-; Gunnoe, T. Brent & Petersen, Jeffrey L.
Object Type: Article
System: The UNT Digital Library
Through-Bond Interactions in the Diradical Intermediates Formed in the Rearrangements of Bicyclo[n.m.0]alkatetraenes (open access)

Through-Bond Interactions in the Diradical Intermediates Formed in the Rearrangements of Bicyclo[n.m.0]alkatetraenes

Article on through-bond interactions in the diradical intermediates formed in the rearrangements of bicyclo[n.m.0]alkatetraenes.
Date: September 24, 2010
Creator: Lovitt, Charity Flener; Dong, Hao; Hrovat, David A.; Gleiter, Rolf & Borden, Weston T.
Object Type: Article
System: The UNT Digital Library
Current Applications of Computational Chemistry in JACS - Molecules, Mechanisms, and Materials (open access)

Current Applications of Computational Chemistry in JACS - Molecules, Mechanisms, and Materials

Article discussing molecules, mechanisms, and materials and current applications of computational chemistry in the Journal of the American Chemical Society (JACS).
Date: September 21, 2011
Creator: Borden, Weston T.
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
Transition Metal Imido Complexes (open access)

Transition Metal Imido Complexes

Article discussing a wide range of transition metal imido (TMI) complexes using ab initio molecular orbital (MO) calculations.
Date: September 1, 1992
Creator: Cundari, Thomas R., 1964-
Object Type: Article
System: The UNT Digital Library
The correlation-consistent composite approach: Application to the G3/99 test set (open access)

The correlation-consistent composite approach: Application to the G3/99 test set

Article discussing research on the correlation consistent composite approach (ccCA) and an application to the G3/99 test set.
Date: September 13, 2006
Creator: DeYonker, Nathan J.; Grimes, Thomas V.; Yockel, Scott; Dinescu, Adriana; Mintz, Benjamin; Cundari, Thomas R., 1964- et al.
Object Type: Article
System: The UNT Digital Library
Solubility of Benzil in Binary Alkane + Methyl tert-Butyl Ether Solvent Mixtures (open access)

Solubility of Benzil in Binary Alkane + Methyl tert-Butyl Ether Solvent Mixtures

Article on the solubility of benzil in binary alkane + methyl tert-butyl ether solvent mixtures.
Date: September 12, 1996
Creator: McHale, Mary E. R.; Powell, Joyce R.; Kauppila, Ann-Sofi M. & Acree, William E. (William Eugene)
Object Type: Article
System: The UNT Digital Library
Solubility of Anthracene in Binary Alkane + Methyl tert-Butyl Ether Solvent Mixtures at 298.15 K (open access)

Solubility of Anthracene in Binary Alkane + Methyl tert-Butyl Ether Solvent Mixtures at 298.15 K

Article on the solubility of anthracene in binary alkane + methyl tert-butyl ether solvent mixtures at 298.15 K.
Date: September 12, 1996
Creator: McHale, Mary E. R.; Kauppila, Ann-Sofi M. & Acree, William E. (William Eugene)
Object Type: Article
System: The UNT Digital Library
Improvement of Quality in Publication of Experimental Thermophysical Property Data: Challenges, Assessment Tools, Global Implementation, and Online Support (open access)

Improvement of Quality in Publication of Experimental Thermophysical Property Data: Challenges, Assessment Tools, Global Implementation, and Online Support

Article on the improvement of quality in the publication of experimental thermophysical property data.
Date: September 6, 2013
Creator: Chirico, Robert D.; Frenkel, Michael; Magee, Joseph W.; Diky, Vladimir; Muzny, Chris D.; Kazakov, Andrei F. et al.
Object Type: Article
System: The UNT Digital Library
Solubility of Tris(hydroxymethyl)aminomethane in Water + 1-Propanol Mixtures at Various Temperatures (open access)

Solubility of Tris(hydroxymethyl)aminomethane in Water + 1-Propanol Mixtures at Various Temperatures

Article on the solubility of tris(hydroxymethyl)aminomethane in water + 1-propanol mixtures at various temperatures.
Date: September 17, 2014
Creator: Jouyban-Gharamaleki, Vahid; Jouyban-Gharamaleki, Karim; Soleymani, Jafar; Acree, William E. (William Eugene) & Jouyban, Abolghasem
Object Type: Article
System: The UNT Digital Library
Solubility of 2-Hydroxybenzoic Acid in Select Organic Solvents at 298.15 K (open access)

Solubility of 2-Hydroxybenzoic Acid in Select Organic Solvents at 298.15 K

Article on the solubility of 2-hydroxybenzoic acid in select organic solvents at 298.15 K.
Date: September 16, 1999
Creator: De Fina, Karina M.; Sharp, Tina L.; Roy, Lindsay Elizabeth & Acree, William E. (William Eugene)
Object Type: Article
System: The UNT Digital Library
Solubility of Anthracene in Ternary Dibutyl Ether + Alcohol + Heptane Solvent Mixtures at 298.15 K (open access)

Solubility of Anthracene in Ternary Dibutyl Ether + Alcohol + Heptane Solvent Mixtures at 298.15 K

Article on the solubility of anthracene in ternary dibutyl ether + alcohol + heptane solvent mixtures at 298.15 K.
Date: September 16, 1999
Creator: Pribyla, Karen J. & Acree, William E. (William Eugene)
Object Type: Article
System: The UNT Digital Library