Tags: tight-binding

Description

In solid-state physics, the tight binding model is an approach to the calculation of electronic band structure using an approximate set of wave functions based upon superposition of wave functions for isolated atoms located at each atomic site. The method is closely related to the linear combination of atomic orbitals molecular orbital method used for molecules. Tight binding calculates the ground state electronic energy and position of band gaps for a molecule.

Learn more about quantum dots from the many resources on this site, listed below. More information on Tight binding can be found here.

All Categories (21-40 of 43)

  1. Carbon nanotube bandstructure

    Animations | 22 Apr 2010 | Contributor(s):: Saumitra Raj Mehrotra, Gerhard Klimeck

    Carbon nanotubes are allotropes of carbon with a cylindrical nanostructure, and can be categorized into single-walled nanotubes (SWNT) and multi-walled nanotubes (MWNT). These cylindrical carbon molecules have novel properties that make them potentially useful in many nanotechnology applications,...

  2. Nanoelectronic Modeling Lecture 25b: NEMO1D - Hole Bandstructure in Quantum Wells and Hole Transport in RTDs

    Online Presentations | 09 Mar 2010 | Contributor(s):: Gerhard Klimeck

    Heterostructures such as resonant tunneling diodes, quantum well photodetectors and lasers, and cascade lasers break the symmetry of the crystalline lattice. Such break in lattice symmetry causes a strong interaction of heavy-, light- and split-off hole bands. The bandstructure of holes and the...

  3. Mahesh R Neupane

    Though Mahesh hails from Nepal, he graduated with a Bachelors of Engineering (BE)degree in Computer Science from University of Madras, India, in 2003. In 2005, he received a MS degree in Computer...

    https://nanohub.org/members/38579

  4. Lecture 2: Graphene Fundamentals

    Online Presentations | 22 Sep 2009 | Contributor(s):: Supriyo Datta

  5. Band Structure Lab Demonstration: Bulk Strain

    Animations | 12 Jun 2009 | Contributor(s):: Gerhard Klimeck

    This video shows an electronic structure calculation of bulk Si using Band Structure Lab. Several powerful features of this tool are demonstrated.

  6. Quantum Dot Lab Demonstration: Pyramidal Qdots

    Animations | 11 Jun 2009 | Contributor(s):: Gerhard Klimeck, Benjamin P Haley

    This video shows the simulation and analysis of a pyramid-shaped quantum dot using Quantum Dot Lab. Several powerful analytic features of this tool are demonstrated.

  7. 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.

  8. OMEN Nanowire

    Tools | 02 Sep 2008 | Contributor(s):: SungGeun Kim, Mathieu Luisier, Benjamin P Haley, Abhijeet Paul, Saumitra Raj Mehrotra, Gerhard Klimeck, Hesameddin Ilatikhameneh

    Full-band 3D quantum transport simulation in nanowire structure

  9. Real space first-principles semiempirical pseudopotentials for Fe/MgO/Fe

    Downloads | 03 Dec 2008 | Contributor(s):: Kirk Bevan

    A set of semiempirical pseudopotentials for the atomistic modeling of Fe/MgO/Fe tunnel junctions. See the attached document for a full description of their derivation and the modeling approach.Document Abstract:We present a real space density functional theory (DFT) localized basis set...

  10. 1D Heterostructure Tool

    Tools | 04 Aug 2008 | Contributor(s):: Arun Goud Akkala, Sebastian Steiger, Jean Michel D Sellier, Sunhee Lee, Michael Povolotskyi, Tillmann Christoph Kubis, Hong-Hyun Park, Samarth Agarwal, Gerhard Klimeck, James Fonseca, Archana Tankasala, Kuang-Chung Wang, Chin-Yi Chen, Fan Chen

    Poisson-Schrödinger Solver for 1D Heterostructures

  11. Computational Nanoscience, Lecture 17: Tight-Binding, and Moving Towards Density Functional Theory

    Teaching Materials | 21 Mar 2008 | Contributor(s):: Elif Ertekin, Jeffrey C Grossman

    The purpose of this lecture is to illustrate the application of the Tight-Binding method to a simple system and then to introduce the concept of Density Functional Theory. The motivation to mapping from a wavefunction to a density-based description of atomic systems is provided, and the necessary...

  12. Semiconductor Device Education Material

    Teaching Materials | 28 Jan 2008 | Contributor(s):: Gerhard Klimeck

    This page has moved to "a Wiki page format" When we hear the words, semiconductor device, we may think first of the transistors in PCs or video game consoles, but transistors are the basic component in all of the electronic devices we use in our daily lives. Electronic systems are...

  13. High Precision Quantum Control of Single Donor Spins in Silicon

    Papers | 14 Jan 2008 | Contributor(s):: Rajib Rahman, marta prada, Gerhard Klimeck, Lloyd Hollenberg

    The Stark shift of the hyperfine coupling constant is investigated for a P donor in Si far below the ionization regime in the presence of interfaces using tight-binding and band minima basis approaches and compared to the recent precision measurements. In contrast with previous effective...

  14. Valley splitting in strained silicon quantum wells modeled with 2 degree miscuts, step disorder, and alloy disorder

    Papers | 14 Jan 2008 | Contributor(s):: Neerav Kharche, marta prada, Timothy Boykin, Gerhard Klimeck

    Valley splitting (VS) in strained SiGe/Si/SiGe quantum wells grown on (001) and 2° miscut substrates is computed in a magnetic field. Calculations of flat structures significantly overestimate, while calculations of perfectly ordered structures underestimate experimentally observed VS. Step...

  15. Atomistic Electronic Structure Calculations of Unstrained Alloyed Systems Consisting of a Million Atoms

    Papers | 14 Jan 2008 | Contributor(s):: Gerhard Klimeck, Timothy Boykin

    The broadening of the conduction and valence band edges due to compositional disorder in alloyed materials of finite extent is studied using an s p3 s ∗ tight binding model. Two sources of broadening due to configuration and concentration disorder are identified. The concentrational disorder...

  16. Quantum Dot Lab Learning Module: An Introduction

    Online Presentations | 02 Jul 2007 | Contributor(s):: James K Fodor, Jing Guo

    THIS MATERIAL CORRESPONDS TO AN OLDER VERSION OF QUANTUM DOT LAB THAN CURRENTLY AVAILABLE ON nanoHUB.org.

  17. Vidur Vidur

    https://nanohub.org/members/20084

  18. CGTB

    Tools | 15 Jun 2006 | Contributor(s):: Gang Li, yang xu, Narayan Aluru

    Compute the charge density distribution and potential variation inside a MOS structure by using a coarse-grained tight binding model

  19. Quantum Dot Lab

    Tools | 12 Nov 2005 | Contributor(s):: Prasad Sarangapani, James Fonseca, Daniel F Mejia, James Charles, Woody Gilbertson, Tarek Ahmed Ameen, Hesameddin Ilatikhameneh, Andrew Roché, Lars Bjaalie, Sebastian Steiger, David Ebert, Matteo Mannino, Hong-Hyun Park, Tillmann Christoph Kubis, Michael Povolotskyi, Michael McLennan, Gerhard Klimeck

    Compute the eigenstates of a particle in a box of various shapes including domes, pyramids and multilayer structures.

  20. Gerhard Klimeck

    Gerhard Klimeck is the Elmore Chaired Professor of Electrical and Computer Engineering at Purdue University and leads two research centers in Purdue's Discovery Park. He is also Vice President for...

    https://nanohub.org/members/3482