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ABINIT
13 May 2004 | Tools | Contributor(s): Amritanshu Palaria, Xufeng Wang, Benjamin P Haley, Matteo Mannino, Gerhard Klimeck
Run the community code ABINIT for electronic structure calculations under density functional theory through a convenient graphical user interface
http://nanohub.org/resources/ABINIT
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Excellence in Computer Simulation
19 Dec 2007 | Workshops | Contributor(s): Mark Lundstrom, Jeffrey B. Neaton, Jeffrey C Grossman
Computational science is frequently labeled as a third branch of science - equal in standing with theory and experiment, and computational engineering is now an essential component of technology …
http://nanohub.org/resources/3617
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Quantum and Semi-classical Electrostatics Simulation of SOI Trigates
19 Feb 2008 | Tools | Contributor(s): Hyung-Seok Hahm, Andres Godoy
Generate quantum/semi-classical electrostatic simulation results for a simple Trigate structure
http://nanohub.org/resources/MCTrigate
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Boltzmann Transport Simulator for CNTs
20 Feb 2008 | Tools | Contributor(s): Zlatan Aksamija, Umberto Ravaioli
Simulate Electron transport in Single-walled carbon nanotubes using an upwinding discretization of the Boltzmann transport equation in the relaxation time approximation.
http://nanohub.org/resources/cntbte
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UV/Vis Spectra simulator
04 Mar 2008 | Tools | Contributor(s): Baudilio Tejerina
This tool computes molecular electronic spectra.
http://nanohub.org/resources/uvspec