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MOSFet Demonstration: MOSFET Device Simulation and Analysis
Animations | 11 Jun 2009 | Contributor(s):: Gerhard Klimeck, Benjamin P Haley
This video shows the simulation and analysis of a MOSFET device using the MOSFet tool. Several powerful analytic features of this tool are demonstrated.
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OMEN Nanowire Demonstration: Nanowire Simulation and Analysis
Animations | 11 Jun 2009 | Contributor(s):: Gerhard Klimeck, Benjamin P Haley
This video shows the simulation and analysis of a nanowire using OMEN Nanowire. Several powerful analytic features of this tool are demonstrated.
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NCN Nanomaterials: Simulation Tools for Education
Series | 02 Jun 2009
Please find an updated list of materials related simulation tools and resources at the Materials Science Education Group.
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NCN Nanomaterials: Simulation Tools for Research
Series | 02 Jun 2009
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Resonant Tunneling Diode Simulation with NEGF: First-Time User Guide
Teaching Materials | 01 Jun 2009 | Contributor(s):: Samarth Agarwal, Gerhard Klimeck
This first-time user guide for Resonant Tunneling Diode Simulation with NEGF provides some fundamental concepts regarding RTDs along with details on how device geometry and simulation parameters influence current and charge distribution inside the device.NCN@Purdue
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EPR - ESR
Tools | 14 Apr 2009 | Contributor(s):: Baudilio Tejerina, Joshua Telser
This program calculates the powder pattern EPR spectra of a 2-spin electronic system.
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Theoretical Analysis of Gold Nanoparticles
Teaching Materials | 04 May 2009 | Contributor(s):: Jon Camden, George C. Schatz, Baudilio Tejerina
All physical and chemical properties are size dependent, and the properties of materials on the nanosize scale have important consequences in wide ranging fields. Exploiting nanoscale behavior will eventually lead scientists to develop devices that can selectively attack diseased cells, increase...
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Thermoelectric Power Factor Calculator for Superlattices
Tools | 18 Oct 2008 | Contributor(s):: Terence Musho, Greg Walker
Quantum Simulation of the Seebeck Coefficient and Electrical Conductivity in 1D Superlattice Structures using Non-Equilibrium Green's Functions
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Nano-Plasmonic Bowtie Antenna Simulator
Tools | 18 Mar 2008 | Contributor(s):: Alexander S McLeod, Jeffrey B. Neaton, P. James Schuck, Eugene Song, Graham Chapman
A tool for simulating the near-field enhancement effects of nano-scale bowtie antennae.
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Thermoelectric Power Factor Calculator for Nanocrystalline Composites
Tools | 18 Oct 2008 | Contributor(s):: Terence Musho, Greg Walker
Quantum Simulation of the Seebeck Coefficient and Electrical Conductivity in a 2D Nanocrystalline Composite Structure using Non-Equilibrium Green's Functions
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Tutorial for NanogromacsSenior
Online Presentations | 28 Apr 2008 | Contributor(s):: Dairui Chen
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nanoHUB.org: Future Cyberinfrastructure Serving a Community of 60,000 Today
Online Presentations | 23 Apr 2008 | Contributor(s):: George B. Adams III, Gerhard Klimeck, Mark Lundstrom, Michael McLennan
nanoHUB.org provides users with "fingertip access" to over 70 simulation tools for research and education. Users not only launch jobs that are executed on the state-of-the-art computational facilities of Open Science Grid and TeraGrid, but also interactively visualize and analyze the results—all...
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UV/Vis Spectra simulator
Tools | 04 Mar 2008 | Contributor(s):: Baudilio Tejerina
This tool computes molecular electronic spectra.
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Quantum and Semi-classical Electrostatics Simulation of SOI Trigates
Tools | 19 Feb 2008 | Contributor(s):: Hyung-Seok Hahm, Andres Godoy
Generate quantum/semi-classical electrostatic simulation results for a simple Trigate structure
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CNDO/INDO
Tools | 09 Oct 2007 | Contributor(s):: Baudilio Tejerina, Jeff Reimers
Semi-empirical Molecular Orbital calculations.
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Computational Nanoscience, Lecture 7: Monte Carlo Simulation Part I
Teaching Materials | 15 Feb 2008 | Contributor(s):: Jeffrey C Grossman, Elif Ertekin
The purpose of this lecture is to introduce Monte Carlo methods as a form of stochastic simulation. Some introductory examples of Monte Carlo methods are given, and a basic introduction to relevant concepts in statistical mechanics is presented. Students will be introduced to the Metropolis...
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Computational Nanoscience, Lecture 4: Geometry Optimization and Seeing What You're Doing
Teaching Materials | 13 Feb 2008 | Contributor(s):: Jeffrey C Grossman, Elif Ertekin
In this lecture, we discuss various methods for finding the ground state structure of a given system by minimizing its energy. Derivative and non-derivative methods are discussed, as well as the importance of the starting guess and how to find or generate good initial structures. We also briefly...
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Opening Remarks: Excellence in Computer Simulation
Online Presentations | 03 Jan 2008 | Contributor(s):: Mark Lundstrom
Opening remarks for the one-day forum, "Excellence in Computer Simulation," which brought together a broad set of experts to reflect on the future of computational science and engineering.
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Excellence in Computer Simulation: Computational Materials
Online Presentations | 20 Dec 2007 | Contributor(s):: Eric Schwegler
This presentation was one of 13 presentations in the one-day forum, "Excellence in Computer Simulation," which brought together a broad set of experts to reflect on the future of computational science and engineering.
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Perspectives on Computational Quantum Chemistry
Online Presentations | 20 Dec 2007 | Contributor(s):: Martin P. Head-Gordon
This presentation was one of 13 presentations in the one-day forum, "Excellence in Computer Simulation," which brought together a broad set of experts to reflect on the future of computational science and engineering.