Electronic transport in extended systems: Application to carbon nanotubes

Electronic transport in extended systems: Application to carbon nanotubes

Date: September 15, 1999
Creator: Buongiorno Nardelli, Marco
Description: Article on electronic transport in extended systems and the application to carbon nanotubes.
Contributing Partner: UNT College of Arts and Sciences
Onset of Ferrielectricity and the Hidden Nature of Nanoscale Polarization in Ferroelectric Thin Films

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

Date: September 5, 2008
Creator: Nuñez, Matías & Buongiorno Nardelli, Marco
Description: Article on the onset of ferrielectricity and the hidden nature of nanoscale polarization in ferroelectric thin films.
Contributing Partner: UNT College of Arts and Sciences
Mechanical deformations and coherent transport in carbon nanotubes

Mechanical deformations and coherent transport in carbon nanotubes

Date: December 15, 1999
Creator: Buongiorno Nardelli, Marco & Bernholc, Jerry
Description: Article on mechanical deformations and coherent transport in carbon nanotubes.
Contributing Partner: UNT College of Arts and Sciences
First principles theory of artificial metal chains on NiAl(110) surface

First principles theory of artificial metal chains on NiAl(110) surface

Date: July 8, 2005
Creator: Calzolari, Arrigo & Buongiorno Nardelli, Marco
Description: Article on the first principles theory of artificial metal chains on NiAl(110) surface.
Contributing Partner: UNT College of Arts and Sciences
First-principles theory of metal-alkaline earth oxide interfaces

First-principles theory of metal-alkaline earth oxide interfaces

Date: June 21, 2006
Creator: Nuñez, Matías & Buongiorno Nardelli, Marco
Description: Article on the first-principles theory of metal-alkaline earth oxide interfaces.
Contributing Partner: UNT College of Arts and Sciences
Dielectric properties and Raman spectra of ZnO from a first principles finite-differences/finite-fields approach

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
Description: Article on dielectric properties and Raman spectra of ZnO from a first principles finite-differences/finite-fields approach.
Contributing Partner: UNT College of Arts and Sciences
Electric Field Induced Phase Transitions in Polymers: A Novel Mechanism for High Speed Energy Storage

Electric Field Induced Phase Transitions in Polymers: A Novel Mechanism for High Speed Energy Storage

Date: February 23, 2012
Creator: Ranjan, Vivek; Buongiorno Nardelli, Marco & Bernholc, Jerry
Description: This article discusses electric field induced phase transitions in polymers.
Contributing Partner: UNT College of Arts and Sciences
Phonon Softening and High-Pressure Low-Symmetry Phases of Cesium Iodide

Phonon Softening and High-Pressure Low-Symmetry Phases of Cesium Iodide

Date: August 17, 1992
Creator: Buongiorno Nardelli, Marco; Baroni, Stefano & Giannozzi, Paolo
Description: Article on phonon softening and high-pressure low-symmetry phases of cesium iodide.
Contributing Partner: UNT College of Arts and Sciences
Electronic and Transport Properties of Artificial Gold Chains

Electronic and Transport Properties of Artificial Gold Chains

Date: August 27, 2004
Creator: Calzolari, Arrigo; Cavazzoni, Carlo & Buongiorno Nardelli, Marco
Description: Article on electronic and transport properties of artificial gold chains.
Contributing Partner: UNT College of Arts and Sciences
High-pressure low-symmetry phases of cesium halides

High-pressure low-symmetry phases of cesium halides

Date: April 1, 1995
Creator: Buongiorno Nardelli, Marco; Baroni, Stefano & Giannozzi, Paolo
Description: In this article, the relative stability of different high-pressure phases of various cesium halides is studied from first principles and analyzed using the Landau theory of phase transitions.
Contributing Partner: UNT College of Arts and Sciences
Theory of surface morphology of wurtzite GaN (0001) surfaces

Theory of surface morphology of wurtzite GaN (0001) surfaces

Date: November 15, 1997
Creator: Rapcewicz, Krzysztof; Buongiorno Nardelli, Marco & Bernholc, Jerry
Description: Article on the theory of surface morphology of wurtzite GaN (0001) surfaces.
Contributing Partner: UNT College of Arts and Sciences
Ultimate strength of carbon nanotubes: A theoretical study

Ultimate strength of carbon nanotubes: A theoretical study

Date: March 27, 2002
Creator: Zhao, Qingzhong; Buongiorno Nardelli, Marco & Bernholc, Jerry
Description: Article on a theoretical study of the ultimate strength of carbon nanotubes.
Contributing Partner: UNT College of Arts and Sciences
Strain effects on the interface properties of nitride semiconductors

Strain effects on the interface properties of nitride semiconductors

Date: March 15, 1997
Creator: Buongiorno Nardelli, Marco; Rapcewicz, Krzysztof & Bernholc, Jerry
Description: Article on the strain effects on the interface properties of nitride semiconductors.
Contributing Partner: UNT College of Arts and Sciences
Electronic properties of the graphene/6H-SiC(0001̅ ) interface: A first-principles study

Electronic properties of the graphene/6H-SiC(0001̅ ) interface: A first-principles study

Date: July 27, 2011
Creator: Jayasekera, Thushari; Xu, Shu; Kim, Ki Wook & Buongiorno Nardelli, Marco
Description: This article discusses electronic properties of the graphene/6H-SiC(0001̅) interface.
Contributing Partner: UNT College of Arts and Sciences
Ab Initio Studies of Polarization and Piezoelectricity in Vinylidene Fluoride and BN-Based Polymers

Ab Initio Studies of Polarization and Piezoelectricity in Vinylidene Fluoride and BN-Based Polymers

Date: 2004
Creator: Nakhmanson, Serge M.; Buongiorno Nardelli, Marco & Bernholc, Jerry
Description: Article on ab initio studies of polarization and piezoelectricity in vinylidene fluoride and BN-based polymers.
Contributing Partner: UNT College of Arts and Sciences
Ad-dimers on Strained Carbon Nanotubes: A New Route for Quantum Dot Formation?

Ad-dimers on Strained Carbon Nanotubes: A New Route for Quantum Dot Formation?

Date: November 15, 1999
Creator: Orlikowski, Daniel; Buongiorno Nardelli, Marco; Bernholc, Jerry & Roland, Christopher
Description: Article on ad-dimers on strained carbon nano-tubes.
Contributing Partner: UNT College of Arts and Sciences
Phase Equilibria in High Energy Density PVDF-Based Polymers

Phase Equilibria in High Energy Density PVDF-Based Polymers

Date: July 27, 2007
Creator: Ranjan, Vivek; Yu, Liping; Buongiorno Nardelli, Marco & Bernholc, Jerry
Description: Article on phase equilibria in high energy density PVDF-based polymers.
Contributing Partner: UNT College of Arts and Sciences
Brittle and Ductile Behavior in Carbon Nanotubes

Brittle and Ductile Behavior in Carbon Nanotubes

Date: November 23, 1998
Creator: Buongiorno Nardelli, Marco; Yakobson, Boris I. & Bernholc, Jerry
Description: Article discussing research on the response of carbon nanotubes to a tensile load.
Contributing Partner: UNT College of Arts and Sciences
Band Structure and Quantum Conductance of Nanostructures from Maximally Localized Wannier Functions: The Case of Functionalized Carbon Nanotubes

Band Structure and Quantum Conductance of Nanostructures from Maximally Localized Wannier Functions: The Case of Functionalized Carbon Nanotubes

Date: August 12, 2005
Creator: Lee, Young-Su; Buongiorno Nardelli, Marco & Marzari, Nicola
Description: Article on band structure and quantum conductance of nanostructures from maximally localized Wannier functions.
Contributing Partner: UNT College of Arts and Sciences
Dynamic Conductance of Carbon Nanotubes

Dynamic Conductance of Carbon Nanotubes

Date: March 27, 2000
Creator: Roland, Christopher; Buongiorno Nardelli, Marco; Wang, Jian & Guo, Hong
Description: Article on dynamic conductance of carbon nanotubes.
Contributing Partner: UNT College of Arts and Sciences
Carbon Nanotube-Metal Cluster Composites: A New Road to Chemical Sensors?

Carbon Nanotube-Metal Cluster Composites: A New Road to Chemical Sensors?

Date: March 31, 2005
Creator: Zhao, Qingzhong; Buongiorno Nardelli, Marco; Lu, W. & Bernholc, Jerry
Description: Article on carbon nanotube-metal cluster composites proposed as prototype systems for molecular recognition at the nanoscale.
Contributing Partner: UNT College of Arts and Sciences
Structural and electronic properties of carbon nanotube tapers

Structural and electronic properties of carbon nanotube tapers

Date: October 29, 2001
Creator: Meunier, Vincent; Buongiorno Nardelli, Marco; Roland, Christopher & Bernholc, Jerry
Description: Article on structural and electronic properties of carbon nanotube tapers, a set of nanostructures comprised of straight tubular sections with decreasing diameters, joined to each other via conical funnels and terminated with a hemispherical cap.
Contributing Partner: UNT College of Arts and Sciences
Collective polarization effects in β-polyvinylidene fluoride and its copolymers with tri- and tetrafluoroethylene

Collective polarization effects in β-polyvinylidene fluoride and its copolymers with tri- and tetrafluoroethylene

Date: September 23, 2005
Creator: Nakhmanson, Serge M.; Buongiorno Nardelli, Marco & Bernholc, Jerry
Description: Article on collective polarization effects in β-polyvinylidene fluoride and its copolymers with tri- and tetrafluoroethylene.
Contributing Partner: UNT College of Arts and Sciences
Ab initio transport properties of nanostructures from maximally localized Wannier functions

Ab initio transport properties of nanostructures from maximally localized Wannier functions

Date: January 22, 2004
Creator: Calzolari, Arrigo; Marzari, Nicola; Souza, Ivo & Buongiorno Nardelli, Marco
Description: Article on ab initio transport properties of nanostructures from maximally localized Wannier functions.
Contributing Partner: UNT College of Arts and Sciences
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