Quantitative Computational Thermochemistry of Transition Metal Species (open access)

Quantitative Computational Thermochemistry of Transition Metal Species

This article discusses quantitative computational thermochemistry of transition metal species. The correlation consistent Composite Approach (ccCA), which has been shown to achieve chemical accuracy (±1 kcal mol⁻¹) for a large benchmark set of main group and s-block metal compounds, is used to compute enthalpies of formation for a set of 17 3d transition metal species.
Date: May 15, 2007
Creator: DeYonker, Nathan J.; Peterson, Kirk A.; Steyl, Gideon; Wilson, Angela K. & Cundari, Thomas R., 1964-
Object Type: Article
System: The UNT Digital Library
Comparative Reactivity of TpRu(L)(NCMe)Ph (L = CO or PMe3): Impact of Ancillary Ligand L on Activation of Carbon-Hydrogen Bonds Including Catalytic Hydroarylation and Hydrovinylation/Oligomerization of Ethylene (open access)

Comparative Reactivity of TpRu(L)(NCMe)Ph (L = CO or PMe3): Impact of Ancillary Ligand L on Activation of Carbon-Hydrogen Bonds Including Catalytic Hydroarylation and Hydrovinylation/Oligomerization of Ethylene

Article discussing research on the comparative reactivity of TpRu(L)(NCMe)Ph (L = CO or PMe3) and the impact of ancillary ligand L on activation of carbon-hydrogen bonds including catalytic hydroarylation and hyrdovinylation/oligomerization of ethylene.
Date: May 9, 2007
Creator: Foley, Nicholas A.; Lail, Marty; Lee, John P.; Gunnoe, T. Brent; Cundari, Thomas R., 1964- & Petersen, Jeffrey L.
Object Type: Article
System: The UNT Digital Library
Tracembler - software for in-silico chromosome walking in unassembled genomes (open access)

Tracembler - software for in-silico chromosome walking in unassembled genomes

Article discussing Tracembler, a software for in-silico chromosome walking in unassembled genomes.
Date: May 9, 2007
Creator: Dong, Qunfeng; Wilkerson, Matthew D. & Brendel, Volker
Object Type: Article
System: The UNT Digital Library
Characterization of Room-Temperature Ionic Liquids by the Abraham Model with Cation-Specific and Anion-Specific Equation Coefficients (open access)

Characterization of Room-Temperature Ionic Liquids by the Abraham Model with Cation-Specific and Anion-Specific Equation Coefficients

Article on the characterization of room-temperature ionic liquids by the Abraham model with cation-specific and anion-specific equation coefficients.
Date: April 26, 2007
Creator: Sprunger, Laura M.; Clark, Michael; Acree, William E. (William Eugene) & Abraham, M. H. (Michael H.)
Object Type: Article
System: The UNT Digital Library
A functional genomics approach to (iso)flavonoid glycosylation in the model legume Medicago truncatula (open access)

A functional genomics approach to (iso)flavonoid glycosylation in the model legume Medicago truncatula

Article on a functional genomics approach to (iso)flavonoid glycosylation in the model legume Medicago truncatula.
Date: February 15, 2007
Creator: Modolo, Luzia V.; Blount, Jack W.; Achnine, Lahoucine; Naoumkina, Marina A.; Wang, Xiaoqiang & Dixon, R. A.
Object Type: Article
System: The UNT Digital Library
Dust Covering Factor, Silicate Emission, and Star Formation in Luminous QSOs (open access)

Dust Covering Factor, Silicate Emission, and Star Formation in Luminous QSOs

This article presents Spitzer IRS low resolution, mid-IR spectra of a sample of 25 high luminosity QSOs at 2 < z < 3.5.
Date: April 12, 2007
Creator: Maiolino, Roberto; Shemmer, Ohad; Imanishi, Masatoshi; Netzer, Hagai; Oliva, Ernesto; Lutz, Dieter et al.
Object Type: Article
System: The UNT Digital Library
Methods for Extending the Freshness of Cut Flowers, Ornamental Trees, and Plant Cuttings (open access)

Methods for Extending the Freshness of Cut Flowers, Ornamental Trees, and Plant Cuttings

Patent relating to methods for extending the freshness of cut flowers, ornamental trees, and plant cuttings.
Date: October 30, 2000
Creator: Chapman, Kent D. & Austin-Brown, Shea L.
Object Type: Patent
System: The UNT Digital Library
Ciencia y política: perspectiva histórica y modelos alternativos (open access)

Ciencia y política: perspectiva histórica y modelos alternativos

Article on the relations between science and policy offering an analysis of the historical antecedents of the policy of science and comparative data and ethical reflections on the policy of scientific budget.
Date: April 2007
Creator: Mitcham, Carl & Briggle, Adam
Object Type: Article
System: The UNT Digital Library
PAH Emission and Star Formation in the Host of the z ~ 2.56 Cloverleaf QSO (open access)

PAH Emission and Star Formation in the Host of the z ~ 2.56 Cloverleaf QSO

This article reports the first detection of the 6.2 and 7.7 μm infrared polycyclic aromatic hydrocarbon emission features in the spectrum of a high-redshift QSO, from the Spitzer IRS spectrum of the Cloverleaf lensed QSO.
Date: March 30, 2007
Creator: Lutz, Dieter; Sturm, Eckhard; Tacconi, Linda; Valiante, Elisabetta; Schweitzer, Mario; Netzer, Hagai et al.
Object Type: Article
System: The UNT Digital Library
Rediscovery of the Elements: The Road to Karlsruhe (open access)

Rediscovery of the Elements: The Road to Karlsruhe

Article describing the history of atomic weight and the events leading up to the Karlsruhe Congress of chemists. The authors visited several sites pertinent to these events and offer tourist information.
Date: Spring 2007
Creator: Marshall, James L., 1940- & Marshall, Virginia R.
Object Type: Article
System: The UNT Digital Library
GRB 060505: A Possible Short-Duration Gamma-Ray Burst in a Star-Forming Region at a Redshift of 0.09 (open access)

GRB 060505: A Possible Short-Duration Gamma-Ray Burst in a Star-Forming Region at a Redshift of 0.09

This article reports the discovery of the GRB optical afterglow and observations of its environment using Gemini South, the Hubble Space Telescope, Chandra, Swift, and the Very Large Array.
Date: March 13, 2007
Creator: Ofek, Efran; Cenko, Brad; Gal-Yam, Avishay; Fox, Derek B.; Nakar, Ehud; Rau, Arne et al.
Object Type: Article
System: The UNT Digital Library
A fluctuating environment as a source of periodic modulation (open access)

A fluctuating environment as a source of periodic modulation

Article discussing a fluctuating environment as a source of periodic modulation.
Date: March 12, 2007
Creator: Bianco, Simone; Grigolini, Paolo & Paradisi, Paolo
Object Type: Article
System: The UNT Digital Library
Reactions of SO₃ with the O/H Radical Pool under Combustion Conditions (open access)

Reactions of SO₃ with the O/H Radical Pool under Combustion Conditions

Article on reactions of SO₃ with the O/H radical pool under combustion conditions.
Date: March 9, 2007
Creator: Hindiyarti, Lusi; Glarborg, Peter & Marshall, Paul
Object Type: Article
System: The UNT Digital Library
[Review] Infinite Nature (open access)

[Review] Infinite Nature

This article reviews the book "Infinite Nature," by R. Bruce Hull.
Date: March 2007
Creator: Rozzi, Ricardo, 1960-
Object Type: Review
System: The UNT Digital Library
Solubility of Anthracene in Binary Diisopropyl Ether + Alcohol Solvent Mixtures at 298.15 K (open access)

Solubility of Anthracene in Binary Diisopropyl Ether + Alcohol Solvent Mixtures at 298.15 K

Article on the solubility of anthracene in binary diisopropyl ether + alcohol solvent mixtures at 298.15 K.
Date: February 23, 2007
Creator: Corella, Monica; Wolcott, Kimberle; Carrillo, Miranda & Acree, William E. (William Eugene)
Object Type: Article
System: The UNT Digital Library
Supplemental Material: Enthalpy of Solvation Correlations for Gaseous Solutes Dissolved in Benzene and in Alkane Solvents Based on the Abraham Model (open access)

Supplemental Material: Enthalpy of Solvation Correlations for Gaseous Solutes Dissolved in Benzene and in Alkane Solvents Based on the Abraham Model

This document includes supplemental material to an article titled "Enthalpy of solvation correlations for gaseous solutes dissolved in benzene and in alkane solvents based on the Abraham model," published in QSAR & Combinatorial Science.
Date: February 13, 2007
Creator: Mintz, Christina; Clark, Michael; Burton, Katherine; Acree, William E. (William Eugene) & Abraham, M. H. (Michael H.)
Object Type: Text
System: The UNT Digital Library
Studies of the kinetics and thermochemistry of the forward and reverse reaction Cl + C₆H₆ = HCl + C₆H₅ (open access)

Studies of the kinetics and thermochemistry of the forward and reverse reaction Cl + C₆H₆ = HCl + C₆H₅

Article on studies of the kinetics and thermochemistry of the forward and reverse reaction Cl + C₆H₆ = HCl + C₆H₅.
Date: February 7, 2007
Creator: Alecu, I. M.; Gao, Yide; Hsieh, P-C; Sand, Jordan P.; Ors, Ahmet; McLeod, A. et al.
Object Type: Article
System: The UNT Digital Library
Thermodynamic Properties of Three Pyridine Carboxylic Acid Methyl Ester Isomers (open access)

Thermodynamic Properties of Three Pyridine Carboxylic Acid Methyl Ester Isomers

This article discusses the thermodynamic properties of three pyridine carboxylic acid methyl ester isomers.
Date: February 6, 2007
Creator: Silva, Maria D. M. C. Ribeiro da; Freitas, Vera L. S.; Santos, Luís M. N. B. F.; Fulem, Michal; Sottomayor, M. J.; Monte, Manuel J. S. et al.
Object Type: Article
System: The UNT Digital Library
Supporting Information: Thermochemical studies on 3-methylquinoxaline-2-carboxamide 1,4-dioxide derivatives: enthalpies of formation and of (N-O) bond dissociation (open access)

Supporting Information: Thermochemical studies on 3-methylquinoxaline-2-carboxamide 1,4-dioxide derivatives: enthalpies of formation and of (N-O) bond dissociation

This document includes supplemental material to an article titled "Thermochemical studies on 3-methylquinoxaline-2-carboxamide 1,4-dioxide derivatives: enthalpies of formation and of (N-O) bond dissociation," published in the Journal of Physical Chemistry B.
Date: February 3, 2007
Creator: Gomes, José R. B.; Sousa, Emanuel A.; Gomes, Paula; Vale, Nuno; Gonçalves, Jorge M.; Pandey, Siddharth et al.
Object Type: Text
System: The UNT Digital Library
Thermochemical studies on 3-methylquinoxaline-2-carboxamide 1,4-dioxide derivatives: enthalpies of formation and of (N-O) bond dissociation (open access)

Thermochemical studies on 3-methylquinoxaline-2-carboxamide 1,4-dioxide derivatives: enthalpies of formation and of (N-O) bond dissociation

Article discussing thermochemical studies on 3-methyl-quinoxaline-2-carboxamide-1,4-dioxide derivatives and enthalpies of formation and of N-O bond dissociation.
Date: February 3, 2007
Creator: Gomes, José R. B.; Sousa, Emanuel A.; Gomes, Paula; Vale, Nuno; Gonçalves, Jorge M.; Pandey, Siddharth et al.
Object Type: Article
System: The UNT Digital Library
Low-frequency index of refraction for a two-dimensional metallodielectric photonic crystal (open access)

Low-frequency index of refraction for a two-dimensional metallodielectric photonic crystal

This article discusses the low-frequency index of refraction for a two-dimensional metallodialectric photonic crystal.
Date: January 29, 2007
Creator: Krokhin, Arkadii A.; Reyes, E. & Gumen, L.
Object Type: Article
System: The UNT Digital Library
Controlled terahertz frequency response and transparency of Josephson chains and superconducting multilayers (open access)

Controlled terahertz frequency response and transparency of Josephson chains and superconducting multilayers

This article discusses controlled terahertz frequency response and transparency of Josephson chains and superconducting multilayers.
Date: January 26, 2007
Creator: Yampol'skii, V. A.; Savel'ev, Sergey; Usatenko, O. V.; Mel'nik, S. S.; Kusmartsev, F. V.; Krokhin, Arkadii A. et al.
Object Type: Article
System: The UNT Digital Library
Evidence for Strong Tantalum-to-Boron Dative Interactions in (silox)3Ta(BH3) and (silox)3Ta(ɳ2-B,CI-BCI2Ph) (silox = tBu3SiO)1 (open access)

Evidence for Strong Tantalum-to-Boron Dative Interactions in (silox)3Ta(BH3) and (silox)3Ta(ɳ2-B,CI-BCI2Ph) (silox = tBu3SiO)1

This article discusses strong tantalum-to-boron dative interactions in (silox)3Ta(BH3) and (silox)3Ta(ɳ2-B,CI-BCI2Ph) (silox = tBu3SiO)1.
Date: January 24, 2007
Creator: Bonanno, Jeffrey B.; Henry, Thomas P.; Wolczanski, Peter T.; Pierpont, Aaron W. & Cundari, Thomas R., 1964-
Object Type: Article
System: The UNT Digital Library
Hexagon versus Trimer Formation in In Nanowires on Si(111): Energetics and Quantum Conductance (open access)

Hexagon versus Trimer Formation in In Nanowires on Si(111): Energetics and Quantum Conductance

Article on hexagon versus trimer formation in In nanowires on Si(111).
Date: January 12, 2007
Creator: Stekolnikov, A. A.; Seino, Kaori; Bechstedt, Friedhelm; Calzolari, Arrigo & Buongiorno Nardelli, Marco
Object Type: Article
System: The UNT Digital Library