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Nanoparticles & Cancer Cells (open access)

Nanoparticles & Cancer Cells

Undergraduate research thesis studying nanoparticles as a therapeutic approach in cancer-targeting drugs and their effects on mammals. The author hypothesizes that nanoparticles can make cancer-targeting drugs more effective. This thesis also includes the PowerPoint slides presented at UNT Scholar's Day.
Date: 2013~/2014~
Creator: deCarvalho, Roceli
Object Type: Thesis or Dissertation
System: The UNT Digital Library
What Can We Learn about Dispersion from the Conformer Surface of n-Pentane? (open access)

What Can We Learn about Dispersion from the Conformer Surface of n-Pentane?

Article describes study in which researchers mapped the torsional surface of n-pentane to 10-degree resolution at the CCSD(T)-F12 level near the basis set limit.
Date: March 28, 2013
Creator: Martin, Jan M. L.
Object Type: Article
System: The UNT Digital Library
What Can We Learn about Dispersion from the Conformer Surface of n-Pentane? (open access)

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.
Object Type: Article
System: The UNT Digital Library
The Melatonin Conformer Space: Benchmark and Assessment of Wave Function and DFT Methods for a Paradigmatic Biological and Pharmacological Molecule (open access)

The Melatonin Conformer Space: Benchmark and Assessment of Wave Function and DFT Methods for a Paradigmatic Biological and Pharmacological Molecule

This article describes reference quality conformational energies for the 52 unique conformers of melatonin by means of explicitly correlated ab initio methods as well as the ccCA composite method.
Date: December 21, 2012
Creator: Fogueri, Uma R.; Kozuch, Sebastian; Karton, Amir & Martin, Jan M. L.
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
Halogen Bonds: Benchmarks and Theoretical Analysis (open access)

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.
Object Type: Article
System: The UNT Digital Library
Bioinspired Hydrogenase Models: The Mixed-Valence Triiron Complex [Fe₃(CO)₇(μ-edt)₂] and Phosphine Derivatives [Fe₃(CO)₇−ₓ(PPh₃)ₓ(μ-edt)₂] (x = 1, 2) and [Fe₃(CO)₅(κ²‑diphosphine)(μ- edt)₂] as Proton Reduction Catalysts (open access)

Bioinspired Hydrogenase Models: The Mixed-Valence Triiron Complex [Fe₃(CO)₇(μ-edt)₂] and Phosphine Derivatives [Fe₃(CO)₇−ₓ(PPh₃)ₓ(μ-edt)₂] (x = 1, 2) and [Fe₃(CO)₅(κ²‑diphosphine)(μ- edt)₂] as Proton Reduction Catalysts

This article describes the preparation and structural characterization of the mixed-valence triiron complexes.
Date: July 15, 2013
Creator: Rahaman, Ahibur; Ghosh, Shishir; Unwin, David G.; Basak-Modi, Sucharita; Holt, Katherine B.; Kabir, Shariff E. et al.
Object Type: Article
System: The UNT Digital Library
Influence of Bath Composition at Acidic pH on Electrodeposition of Nickel-Layered Silicate Nanocomposites for Corrosion Protection (open access)

Influence of Bath Composition at Acidic pH on Electrodeposition of Nickel-Layered Silicate Nanocomposites for Corrosion Protection

This article describes how nickel-layered silicate nanocomposite films were electrochemically deposited using pulsed potentiostatic conditions from an acidic plating bath containing exfoliated layered silicate to enhance adhesion to the substrate, corrosion resistance, and mechanical properties.
Date: September 25, 2013
Creator: Tientong, Jeerapan; Thurber, Casey; D'Souza, Nandika; Mohamed, Adel M. A. & Golden, Teresa
Object Type: Article
System: The UNT Digital Library
Electrodeposition of Oriented Cerium Oxide Films (open access)

Electrodeposition of Oriented Cerium Oxide Films

This article discusses the process of depositing CeO₂ with a preferred crystalline orientation.
Date: September 13, 2013
Creator: Wang, Adele Qi & Golden, Teresa
Object Type: Article
System: The UNT Digital Library
Accurate quantum chemical energies for tetrapeptide conformations: why MP2 data with an insufficient basis set should be handled with caution (open access)

Accurate quantum chemical energies for tetrapeptide conformations: why MP2 data with an insufficient basis set should be handled with caution

This article discusses potential problems if the widely-applied MP2 approach is used in such situations with basis sets of insufficient size.
Date: January 29, 2013
Creator: Goerigk, Lars; Karton, Amir; Martin, Jan M. L. & Radom, Leo
Object Type: Article
System: The UNT Digital Library
Experimental and Kinetic Modeling Study of Methanol Ignition and Oxidation at High Pressure (open access)

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.
Object Type: Article
System: The UNT Digital Library
Saguaro Cactus and Joshua Trees (open access)

Saguaro Cactus and Joshua Trees

Front cover of the spring 2013 issue of The Hexagon, which features an image of a saguaro cactus and joshua trees at a location in northwest Arizona along highway US 93. The inside cover contains a table of contents, a staff list, an editorial, and details about the cover photograph.
Date: Spring 2013
Creator: Marshall, James L., 1940- & Marshall, Virginia R.
Object Type: Article
System: The UNT Digital Library
Rediscovery of the Elements: Rhenium and Technetium (open access)

Rediscovery of the Elements: Rhenium and Technetium

Article describing the discovery of rhenium and technetium by Walter Karl Friedrich Noddack and Ida Eva Noddack-Tacke. Information regarding pertinent locations is included.
Date: Winter 2013
Creator: Marshall, James L., 1940- & Marshall, Virginia R.
Object Type: Article
System: The UNT Digital Library
Gas Phase Kinetics and Equilibrium of Allyl Radical Reactions with NO and NO₂ (open access)

Gas Phase Kinetics and Equilibrium of Allyl Radical Reactions with NO and NO₂

Article on gas phase kinetics and equilibrium of allyl radical reactions with NO and NO₂.
Date: January 11, 2013
Creator: Rissanen, Matti P.; Amedro, Damien; Krasnoperov, Lev N.; Marshall, Paul & Timonen, Raimo S.
Object Type: Article
System: The UNT Digital Library
Rate Constant and Branching Fraction for the NH₂ + NO₂ Reaction (open access)

Rate Constant and Branching Fraction for the NH₂ + NO₂ Reaction

Article on rate constant and branching fraction for the NH₂ + NO₂ reaction.
Date: August 22, 2013
Creator: Klippenstein, Stephen J.; Harding, Lawrence B.; Glarborg, Peter; Gao, Yide; Hu, Huanzhen & Marshall, Paul
Object Type: Article
System: The UNT Digital Library
Oxidation of Reduced Sulfur Species: Carbonyl Sulfide (open access)

Oxidation of Reduced Sulfur Species: Carbonyl Sulfide

Article on the oxidation of reduced sulfur species and carbonyl sulfide.
Date: April 25, 2013
Creator: Glarborg, Peter & Marshall, Paul
Object Type: Article
System: The UNT Digital Library
[5,10,15,20-Tetrakis (4-methoxyphenyl)-porphyrinato] zinc dichloromethane disolvate (open access)

[5,10,15,20-Tetrakis (4-methoxyphenyl)-porphyrinato] zinc dichloromethane disolvate

Article on 5,10,15,20-tetrakis(4-methoxyphenyl)-porphyrinato] zinc dichloromethane disolvate.
Date: July 24, 2013
Creator: McGill, Sean; Nesterov, Vladimir N. & Gould, Stephanie L.
Object Type: Article
System: The UNT Digital Library
Dielectric properties and Raman spectra of ZnO from a first principles finite-differences/finite-fields approach (open access)

Dielectric properties and Raman spectra of ZnO from a first principles finite-differences/finite-fields approach

Article on dielectric properties and Raman spectra of ZnO from a first principles finite-differences/finite-fields approach.
Date: August 5, 2013
Creator: Calzolari, Arrigo & Buongiorno Nardelli, Marco
Object Type: Article
System: The UNT Digital Library
Nanomanipulation Coupled Nanospray Mass Spectrometry (NMS) (open access)

Nanomanipulation Coupled Nanospray Mass Spectrometry (NMS)

Patent relating to nanomanipulation coupled nanospray mass spectrometry (NMS).
Date: March 12, 2013
Creator: Verbeck, Guido F.
Object Type: Patent
System: The UNT Digital Library
Silver and Silver Nanoparticle Maldi Matrix Utilizing Online Soft Landing Ion Mobility (open access)

Silver and Silver Nanoparticle Maldi Matrix Utilizing Online Soft Landing Ion Mobility

Patent relating to silver and silver nanoparticle maldi matrix utilizing online soft landing ion mobility.
Date: November 2, 2011
Creator: Verbeck, Guido F. & Davila, Stephen
Object Type: Patent
System: The UNT Digital Library
Fluorinated Metal-Organic Frameworks for Gas Storage (open access)

Fluorinated Metal-Organic Frameworks for Gas Storage

Patent relating to fluorinated metal-organic frameworks for gas storage.
Date: September 12, 2008
Creator: Omary, Mohammad A. & Yang, Chi
Object Type: Patent
System: The UNT Digital Library
Rediscovery of the Elements: Columbium and Tantalum (open access)

Rediscovery of the Elements: Columbium and Tantalum

Article describing the discovery of columbium and tantalum. Tourist information regarding locations significant to these discoveries are included.
Date: Summer 2013
Creator: Marshall, James L., 1940- & Marshall, Virginia R.
Object Type: Article
System: The UNT Digital Library
Rediscovery of the Elements: Niobium and Tantalum (open access)

Rediscovery of the Elements: Niobium and Tantalum

Article describing the discovery of niobium and tantalum. Tourist information regarding locations significant to these discoveries are included.
Date: Autumn 2013
Creator: Marshall, James L., 1940- & Marshall, Virginia R.
Object Type: Article
System: The UNT Digital Library
The Antropoff Periodic Table found at UC Berkeley (open access)

The Antropoff Periodic Table found at UC Berkeley

Article discussing the Andreas von Antropoff Periodic Table found at the University of California at Berkeley.
Date: Autumn 2013
Creator: Marshall, James L., 1940- & Marshall, Virginia R.
Object Type: Article
System: The UNT Digital Library