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Installation of synergistic binding sites onto porous organic polymers for efficient removal of perfluorooctanoic acid
Article reports a strategy to construct highly efficient perfluorooctanoic acid (PFOA) adsorbents by installing synergistic electrostatic/hydrophobic sites onto porous organic polymers (POPs).
Date:
April 19, 2022
Creator:
Liu, Xiongli; Zhu, Changjia; Yin, Jun; Li, Jixin; Zhang, Zhiyuan; Li, Jinli et al.
Object Type:
Article
System:
The UNT Digital Library
Polarization in electrostatics and circuits: Computing and visualizing surface charge distributions
Article describing an algorithm or computing the detailed surface charge distributions in equilibrium electrostatic situations and in steady-state DC circuits, and discuss the results of the computations of surface charge distributions for several systems.
Date:
December 14, 2018
Creator:
Chabay, Ruth & Sherwood, Bruce
Object Type:
Article
System:
The UNT Digital Library
Triplet photosensitizer-nanotube conjugates: synthesis, characterization and photochemistry of charge stabilizing, palladium porphyrin/carbon nanotube conjugates
Author Manuscript version of an article investigating the ability of a triplet photosensitizer to generate long-lived charge separated states, in contrast to traditionally used singlet photosensitizers, in covalently functionalized single-walled carbon nanotube hybrids.
Date:
April 21, 2020
Creator:
Arellano, Luis M.; Gobeze, Habtom B.; Gómez-Escalonilla, María J.; Fierro, Jose Luis G.; D'Souza, Francis & Langa, Fernando
Object Type:
Article
System:
The UNT Digital Library
Proton reduction by phosphinidene-capped triiron clusters
This article prepares and examines Bis(phosphinidene)-capped triiron carbonyl clusters, including electron rich derivatives formed by substitution with chelating diphosphines as proton reduction catalysts.
Date:
April 20, 2021
Creator:
Rahaman, Ahibur; Lisensky, George C.; Haukka, Matti; Tocher, Derek A.; Richmond, Michael G.; Colbran, Stephen B. et al.
Object Type:
Article
System:
The UNT Digital Library
Oxygen atom transfer catalysis by dioxidomolybdenum(VI) complexes of pyridyl aminophenolate ligands
This article synthesizes and characterizes a series of new cationic dioxidomolybdenum(VI) complexes [MoO₂(Lⁿ)]PF₆ (2–5) with the tripodal tetradentate pyridyl aminophenolate ligands HL²-HL⁵.
Date:
April 21, 2021
Creator:
Hossain, Kamal; Schachner, Jörg A.; Haukka, Matti; Richmond, Michael G.; Mösch-Zanetti, Nadia C.; Lehtonen, Ari et al.
Object Type:
Article
System:
The UNT Digital Library
Evaluation of nine condensed-phase force fields of the GROMOS, CHARMM, OPLS, AMBER, and OpenFF families against experimental cross-solvation free energies
This article builds on a previous study [Kashefolgheta et al., J. Chem. Theory. Comput., 2020, 16, 7556–7580] by extending the comparison to five additional force fields, GROMOS-54A7, GROMOS-ATB, OPLS-LBCC, AMBER-GAFF2, and OpenFF.
Date:
April 30, 2021
Creator:
Kashefolgheta, Sadra; Wang, Shuzhe; Acree, William E. (William Eugene) & Hünenberger, Philippe H.
Object Type:
Article
System:
The UNT Digital Library
Discovery of higher-order topological insulators using the spin Hall conductivity as a topology signature
This article shows a connection between spin Hall effect and HOTIs using a combination of ab initio calculations and tight-binding modeling. The model demonstrates how a non-zero bulk midgap spin Hall conductivity (SHC) emerges within the HOTI phase. This work guides novel experimental and theoretical advances towards higher-order topological insulator realization and applications.
Date:
April 12, 2021
Creator:
Costa, Marcio; Mera Acosta, Carlos; Padilha, Antonio C.M.; Cerasoli, Frank T.; Buongiorno Nardelli, Marco & Fazzio, Adalberto
Object Type:
Article
System:
The UNT Digital Library
Facile Photochemical Syntheses of Conjoined Nanotwin Gold-Silver Particles within a Biologically-Benign Chitosan Polymer
This article developed a simple photochemical method for making conjoined bi-metallic gold-silver (Au/Ag) nanotwins, a new breed of nanoparticles.
Date:
March 6, 2019
Creator:
Korir, Daniel K.; Gwalani, Bharat; Joseph, Abel; Kamras, Brian; Arvapally, Ravi K.; Omary, Mohammad A. et al.
Object Type:
Article
System:
The UNT Digital Library
Crystal structure of 1,3-bis(hydroxymethyl)-2-oxaadamantane, C₁₁H₁₈O₃
This article describes the crystal structure of 1,3-bis(hydroxymethyl)-2-oxaadamantane, C₁₁H₁₈O₃.
Date:
April 1, 2001
Creator:
Bryan, J.C.; Mlinarić-Majerski, K.; Kragol, G. & Marchand, A.P.
Object Type:
Article
System:
The UNT Digital Library
Crystal structure of bis(acetonitrile-𝖪N)(4,4'-di-tert-butyl-2,2'-bipyridine-𝖪²N,N')platinum(II) bis(tetra-fluoridoborate) packing as head-to-head dimers
This article describes the crystal structure of a platinum(II) supramolecular building block, [Pt-(dbbpy)NNCCH₃)₂](BF₄)₂ (dbbpy = 4,4'-di-tert-butyl-2,2'-bipyridine, C₁₈H₂₄N₂).
Date:
April 16, 2018
Creator:
Joseph, Chris; Nesterov, Vladimir N. & Smucker, Bradley W.
Object Type:
Article
System:
The UNT Digital Library
The positions of λₘₐₓ for some trimethylsilyl-substituted silylenes
This article describes how low-temperature photolysis of tris(trimethylsilyl)silane derivatives in a 3-methylpentane glass at 77 K yields hexamethyldisilane and trimethylsilyl-substituted silylenes.
Date:
January 25, 1995
Creator:
Bott, S. G.; Marshall, Paul; Wagenseller, P. E.; Wang, Y. & Conlin, R. T.
Object Type:
Article
System:
The UNT Digital Library
Direct Graphene Growth on Metal Oxides by Molecular Epitaxy
Patent relating to the controlled, layer-by-layer growth of graphene on a useful, magnetizable/and or insulating substrate using molecular beam epitaxy (MBE).
Date:
June 13, 2013
Creator:
Kelber, Jeffry A.
Object Type:
Patent
System:
The UNT Digital Library
Synthesis and Characterization of Dimethylbis(2-pyridyl)borate Nickel(II) Complexes: Unimolecular Square-Planar to Square-Planar Rotation around Nickel(II)
This article reports the synthesis, characterization, and solution dynamics of the novel nickel(II) complexes (dimethylbis(2-pyridyl)borate)(triphenylphosphine)nickel(II) chloride (4) and (dimethylbis(2-pyridyl)borate)nickel(II) acetylacetonate (6).
Date:
April 7, 2014
Creator:
Celaje, Jeff A.; Pennington-Boggio, Megan K.; Flaig, Robinson W.; Richmond, Michael G. & Williams, Travis J.
Object Type:
Article
System:
The UNT Digital Library
Negative Ion Photoelectron Spectroscopy of P₂N₃⁻: Electron Affinity and Electronic Structures of P₂N₃˙
This article reports a negative ion photoelectron spectroscopy (NIPES) and ab initio study of the recently synthesized planar aromatic inorganic ion P₂N₃⁻, to investigate the electronic structures of P₂N₃⁻ and its neutral P₂N₃˙ radical.
Date:
April 5, 2016
Creator:
Hou, Gao-Lei; Chen, Bo; Transue, Wesley J.; Hrovat, David A.; Cummins, Christopher C.; Borden, Weston T. et al.
Object Type:
Article
System:
The UNT Digital Library
Investigation of Structural and Optical Properties of Ag Nanoclusters Formed in Si(100) After Multiple Implantations of Low Energies Ag Ions and Post-Thermal Annealing at a Temperature Below the Ag-Si Eutectic Point
This paper investigates the synthesis of Ag NCs in Si(100) substrate by implanting multiple energies and fluences of Ag ions and subsequent thermal annealing.
Date:
April 2, 2014
Creator:
Dhoubhadel, Mangal; Rout, Bibhudutta; Lakshantha, Wickramaarachchige J.; Das, Sushanta K.; D'Souza, Francis; Glass, Gary A. et al.
Object Type:
Paper
System:
The UNT Digital Library
A Computational Study of the Reactions of Atomic Hydrogen with Fluoromethanes: Kinetics and Product Channels
This article discusses a computational study of the reactions of atomic hydrogen with fluoromethanes and kinetics and product channels.
Date:
April 25, 1997
Creator:
Berry, Rajiv; Ehlers, C. J.; Burgess, Donald R.; Zachariah, Michael Russel, 1957- & Marshall, Paul
Object Type:
Article
System:
The UNT Digital Library
A Discharge-Flow/Chemiluminescence Study of the Reaction O + Si2H6 at Room Temperature
Article on a discharge-flow/chemiluminescence study of the reaction O + Si2H6 at room temperature.
Date:
April 23, 1993
Creator:
Taylor, Craig A. & Marshall, Paul
Object Type:
Article
System:
The UNT Digital Library
Spectroscopic Properties of Polycyclic Aromatic Compounds. Part 4: Effect of Solvent Polarity and Nitromethane on the Fluorescence Emission Behavior of Select Bipolycyclic Aromatic Hydrocarbons
Article on spectroscopic properties of polycyclic aromatic compounds and the effect of solvent polarity and nitromethane on the fluorescence emission behavior of select bipolycyclic aromatic hydrocarbons.
Date:
April 1, 1994
Creator:
Tucker, Sheryl A. (Sheryl Ann); Griffin, Jason M.; Acree, William E. (William Eugene); Zander, Maximilian & Mitchell, Reginald H.
Object Type:
Article
System:
The UNT Digital Library
Computational Study of C-H Bond Strengths in Polyfluoroalkanes
Article on a computational study of C-H bond strengths in polyfluoroalkanes.
Date:
April 10, 1997
Creator:
Marshall, Paul & Schwartz, Martin
Object Type:
Article
System:
The UNT Digital Library
Experimental and Computational Studies of the Kinetics of the Reaction of Atomic Hydrogen with Methanethiol
Article on experimental and computational studies of the kinetics of the reaction of atomic hydrogen with methanethiol.
Date:
April 14, 2015
Creator:
Kerr, Katherine E.; Alecu, I. M.; Thompson, Kristopher; Gao, Yide & Marshall, Paul
Object Type:
Article
System:
The UNT Digital Library
Solubility of Crystalline Nonelectrolyte Solutes in Organic Solvents: Mathematical Correlation of Benzil Solubilities with the Abraham General Solvation Model
Article on the solubility of crystalline nonelectrolyte solutes in organic solvents and the mathematical correlation of benzil solubilities with the Abraham general solvation model.
Date:
April 1, 2002
Creator:
Acree, William E. (William Eugene) & Abraham, M. H. (Michael H.)
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
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
Deduction of physiochemical properties from solubilities: 2,4-dihydroxybenzophenone, biotin, and caprolactam as examples
Article discussing the deduction of physiochemical properties from solubilities and 2,4-dihydroxybenzophenone, biotin, and caprolactam as examples.
Date:
April 15, 2015
Creator:
Abraham, M. H. (Michael H.); Acree, William E. (William Eugene); Brumfield, Michela; Hart, Erin; Pipersburgh, Lila; Mateja, Katherine et al.
Object Type:
Article
System:
The UNT Digital Library
Kinetics of the Reaction of Atomic Oxygen with Tetramethylsilane
Article on kinetics of the reaction of atomic oxygen with tetramethylsilane.
Date:
April 1993
Creator:
Ding, Luying & Marshall, Paul
Object Type:
Article
System:
The UNT Digital Library