Resource Type
Degree Department
Month
Day
Language
113 Matching Results
Results open in a new window/tab.
Results:
1 - 24 of
113
next
Expanding the Equilibrium Solubility and Dissolution Thermodynamics of Benzoic Acid in Aqueous Alcoholic Mixtures
This article determines the equilibrium solubility of benzoic acid in water and ethanol, as well as in nine {ethanol (1) + water (2)} mixtures from T = (293.15 to 323.15) K. The thermodynamic results presented could be useful in optimizing different physical and chemical processes involving benzoic acid in mixed aqueous-ethanol media.
Date:
August 1, 2022
Creator:
Akay, Sema; Kayan, Berkant; Peña, M. Ángeles; Jouyban, Abolghasem; Martínez, Fleming & Acree, William E. (William Eugene)
System:
The UNT Digital Library
Cysne et al. Reply
This article is a response to a comment on the authors' original article "Disentangling Orbital and Valley Hall Effects in Bilayers of Transition Metal Dichalcogenides." The authors' response concludes that they do not believe the main points of the original Letter are affected by the Comment.
Date:
October 1, 2021
Creator:
Cysne, Tarik P.; Costa, Marcio; Canonico, Luis M.; Buongiorno Nardelli, Marco; Muniz, R. B. & Rappoport, Tatiana G.
System:
The UNT Digital Library
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.
System:
The UNT Digital Library
Multimodal switching of a redox-active macrocycle
This article looks at molecules that can exist in multiple states with the possibility of toggling between those states based on different stimuli. They have potential for use in molecular switching or sensing applications. The coupling of two different oxidation states with two different charge-transfer states within one macrocyclic scaffold delivers up to five different optical outputs. This molecular switching manifold exploits intramolecular coupling of multiple redox active substituents within a single molecule.
Date:
March 1, 2019
Creator:
Payne, Daniel T.; Webre, W. A.; Matsushita, Yoshitaka; Zhu, Nianyong; Futera, Zdeněk; Labuta, J. et al.
System:
The UNT Digital Library
Comments Concerning "A Possible Simplification of the Goss-Modified Abraham Solvation Equation"
This article provides comments concerning "A possible simplification of the Goss-modified Abraham solvation equation," published in Chemosphere in 2013.
Date:
November 1, 2015
Creator:
Acree, William E. (William Eugene); Brumfield, Michela & Abraham, M. H. (Michael H.)
System:
The UNT Digital Library
Abraham Model Correlations for Estimating Solute Transfer of Neutral Molecules into Anhydrous Acetic Acid from Water and from the Gas Phase
Article on Abraham model correlations for estimating solute transfer of neutral molecules into anhydrous acetic acid from water and from the gas phase.
Date:
September 1, 2015
Creator:
Stovall, Dawn M.; Schmidt, Amber; Dai, Colleen; Zhang, Shoshana; Acree, William E. (William Eugene) & Abraham, M. H. (Michael H.)
System:
The UNT Digital Library
Abraham Model Correlations for Solute Transfer into 2-Ethoxyethanol from Water and from the Gas Phase
Article on Abraham model correlations for solute transfer into 2-ethoxyethanol from water and from the gas phase.
Date:
August 1, 2015
Creator:
Sedov, Igor A.; Stolov, Mikhail; Hart, Erin; Grover, Damini; Zettl, Heidi; Koshevarova, Victoria et al.
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.
System:
The UNT Digital Library
Commentary on "Study of Assorted Interactions of an Ionic Liquid in Significant Solvent Systems using Compensated Equation of Fuoss Conductance and Vibrational Mode"
Article offering commentary on the article titled "Study of assorted interactions of an ionic liquid in significant solvent systems using compensated equation of fuoss conductance and vibrational mode."
Date:
May 1, 2014
Creator:
Acree, William E. (William Eugene)
System:
The UNT Digital Library
Experimental and Kinetic Modeling Study of Methanol Ignition and Oxidation at High Pressure
Article on an experimental and kinetic modeling study of methanol ignition and oxidation at high pressure.
Date:
May 1, 2013
Creator:
Aranda, V.; Christensen, J. M.; Alzueta, María U.; Glarborg, Peter; Gersen, S.; Gao, Yide et al.
System:
The UNT Digital Library
Halogen Bonds: Benchmarks and Theoretical Analysis
This article describes an extensive survey of wave function and DFT methods to test their accuracy on geometries and dissociation energies of halogen bonds.
Date:
March 1, 2013
Creator:
Kozuch, Sebastian & Martin, Jan M. L.
System:
The UNT Digital Library
What Can We Learn about Dispersion from the Conformer Surface of n-Pentane?
This article maps the torsional surface of n-pentane to 10-degree resolution at the CCSD(T)-F12 level near the basis set limit.
Date:
February 8, 2013
Creator:
Martin, Jan M. L.
System:
The UNT Digital Library
Response to "A critique of Abraham and Acree's correlation for deca-1,9-diene/water partition coefficients"
This article is a response to "A critique of Abraham and Acree's correlation for deca-1,9-diene/water partition coefficients," published in New Journal of Chemistry, 2013.
Date:
February 1, 2013
Creator:
Abraham, M. H. (Michael H.) & Acree, William E. (William Eugene)
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.
System:
The UNT Digital Library
Predicted thermochemistry and unimolecular kinetics of nitrous sulfide
Article on predicted thermochemistry and unimolecular kinetics of nitrous sulfide.
Date:
September 1, 2011
Creator:
Marshall, Paul; Gao, Yide & Glarborg, Peter
System:
The UNT Digital Library
The Role of the Glycine Triad in Human Glutathione Synthetase
Article discussing the role of the glycine triad in human glutathione synthetase.
Date:
October 1, 2010
Creator:
Dinescu, Adriana; Brown, Teresa R.; Barelier, Sarah; Cundari, Thomas R., 1964- & Anderson, Mary E.
System:
The UNT Digital Library
A General Treatment of Solubility 4. Description and Analysis of a PCA Model for Ostwald Solubility Coefficients
Article discussing a general treatment of solubility and a description and analysis of a principal component analysis (PCA) model for Ostwald solubility coefficients.
Date:
July 1, 2010
Creator:
Tulp, Indrek; Dobchev, Dimitar A.; Katritzky, Alan R.; Acree, William E. (William Eugene) & Maran, Uko, 1966-
System:
The UNT Digital Library
Solubility Prediction of Paracetamol in Water-Ethanol-Propylene Glycol Mixtures at 25 and 30°C Using Practical Approaches
Article on the solubility prediction of paracetamol in water-ethanol-propylene glycol mixtures at 25 and 30° C using practical approaches.
Date:
April 1, 2008
Creator:
Jouyban, Abolghasem; Azarmir, Olduz; Mirzaei, Shahla; Hassanzadeh, Davoud; Ghafourian, Taravat; Acree, William E. (William Eugene) et al.
System:
The UNT Digital Library
Deviations of drug solubility in water-cosolvent mixtures from the Jouyban-Acree model - effect of solute structure
Article on the deviations of drug solubility in water-cosolvent mixtures from the Jouyban-Acree model and the effect of solute structure.
Date:
February 1, 2008
Creator:
Jouyban, Abolghasem; Fakhree, Mohammad Amin Abolghassemi; Ghafourian, Taravat; Saei, A. A. & Acree, William E. (William Eugene)
System:
The UNT Digital Library
Kinetics and Thermochemistry of the Addition of Atomic Chlorine to Acetylene
Article on the kinetics and thermochemistry of the addition of atomic chlorine to acetylene.
Date:
January 1, 2007
Creator:
Gao, Yide; Alecu, I. M.; Hsieh, P-C; McLeod, A.; McLeod, Chris; Jones, Maxwell et al.
System:
The UNT Digital Library
Mechanisms of Radical Removal by SO2
Article on mechanisms of radical removal by SO2.
Date:
January 1, 2007
Creator:
Rasmussen, Christian Lund; Glarborg, Peter & Marshall, Paul
System:
The UNT Digital Library
Metal ion-molecule kinetics at combustion temperatures. The reaction of Ca+ with O2
Article on metal ion-molecule kinetics at combustion temperatures and the reaction of Ca+ with O2.
Date:
January 1, 2007
Creator:
Cosic, Biljana; Ermoline, Alexandre; Fontijn, A. (Arthur) & Marshall, Paul
System:
The UNT Digital Library
Mathematical representation of solubility of amino acids in binary aqueous-organic solvent mixtures at various temperatures using the Jouyban-Acree model
Article on mathematical representation of solubility of amino acids in binary aqueous-organic solvent mixtures at various temperatures using the Jouyban-Acree model.
Date:
September 1, 2006
Creator:
Jouyban, Abolghasem; Khoubnasabjafari, Maryam; Chan, Hak-Kim & Acree, William E. (William Eugene)
System:
The UNT Digital Library
Predicting Solubility of Anthracene in Non-aqueous Solvent Mixtures Using a Combination of Jouyban-Acree and Abraham Models
Article on predicting the solubility of anthracene in non-aqueous solvent mixtures using a combination of Jouyban-Acree and Abraham models.
Date:
August 1, 2006
Creator:
Jouyban, Abolghasem; Khoubnasabjafari, Maryam & Acree, William E. (William Eugene)
System:
The UNT Digital Library