-
MIT Atomic-Scale Modeling Toolkit
Tools | 15 Jan 2008 | Contributor(s):: David A Strubbe, Enrique Guerrero, daniel richards, Elif Ertekin, Jeffrey C Grossman, Justin Riley
Tools for Atomic-Scale Modeling
-
MSE 498 Lesson 7: DFT
Online Presentations | 16 Mar 2015 | Contributor(s):: Andrew Ferguson
This new course will give students hands-on experience with popular computational materials science and engineering software through a series of projects in: electronic structure calculation (e.g., VASP), molecular simulation (e.g., GROMACS), phase diagram modeling (e.g., Thermo-Calc), finite...
-
MSEN 201 Lecture 16.3: Electrical Properties - Electronic Bands in Metals, Semiconductors, Insulators
Online Presentations | 13 Feb 2019 | Contributor(s):: Patrick J Shamberger
-
MSEN 201 Lecture 16.4: Electrical Properties - Electronic Band Structure
Online Presentations | 13 Feb 2019 | Contributor(s):: Patrick J Shamberger
-
MSL Simulator
Tools | 17 Jun 2005 | Contributor(s):: Kyeongjae Cho
Easy-to-use interface for designing and analyzing electronic properties of different nano materials
-
Nanoelectronic Modeling Lecture 07: Introduction to Bandstructure Engineering I
Online Presentations | 30 Dec 2009 | Contributor(s):: Gerhard Klimeck
This presentation serves as a reminder about basic quantum mechanical principles without any real math. The presentation reviews critical properties of classical systems that can be described as particles, propagating waves, standing waves, and chromatography.
-
Nanoelectronic Modeling Lecture 08: Introduction to Bandstructure Engineering II
Online Presentations | 30 Dec 2009 | Contributor(s):: Gerhard Klimeck
This presentation provides a brief overview of the concepts of bandstructure engineering and its potential applications to light detectors, light emitters, and electron transport devices. Critical questions of the origin of bandstructure and its dependence on local atom arrangements are raised to...
-
Nanoelectronic Modeling Lecture 12: Open 1D Systems - Transmission through Double Barrier Structures - Resonant Tunneling
Online Presentations | 25 Jan 2010 | Contributor(s):: Gerhard Klimeck, Dragica Vasileska
This presentation shows that double barrier structures can show unity transmission for energies BELOW the barrier height, resulting in resonant tunneling. The resonance can be associated with a quasi bound state, and the bound state can be related to a simple particle in a box calculation.
-
Nanoelectronic Modeling Lecture 14: Open 1D Systems - Formation of Bandstructure
Online Presentations | 25 Jan 2010 | Contributor(s):: Gerhard Klimeck, Dragica Vasileska
The infinite periodic structure Kroenig Penney model is often used to introduce students to the concept of bandstructure formation. It is analytically solvable for linear potentials and shows critical elements of bandstructure formation such as core bands and different effective masses in...
-
Nanoelectronic Modeling Lecture 25a: NEMO1D - Full Bandstructure Effects
Online Presentations | 02 Mar 2010 | Contributor(s):: Gerhard Klimeck
(quantitative RTD modeling at room temperature)
-
Nanoelectronic Modeling Lecture 25b: NEMO1D - Hole Bandstructure in Quantum Wells and Hole Transport in RTDs
Online Presentations | 02 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...
-
Nanoelectronic Modeling Lecture 26: NEMO1D -
Online Presentations | 02 Mar 2010 | Contributor(s):: Gerhard Klimeck
NEMO1D demonstrated the first industrial strength implementation of NEGF into a simulator that quantitatively simulated resonant tunneling diodes. The development of efficient algorithms that simulate scattering from polar optical phonons, acoustic phonons, alloy disorder, and interface roughness...
-
Nanoelectronic Modeling Lecture 33: Alloy Disorder in Bulk
Online Presentations | 07 Jul 2010 | Contributor(s):: Gerhard Klimeck, Timothy Boykin, Chris Bowen
This presentation discusses disorder in AlGaAs unstrained systems in bulk. Bandstructure of an ideal simple unit cellWhat happens when there is disorder?Concept of a supercellBand folding in a supercellBand extraction from the concept of approximate bandstructureComparison of alloy disorder with...
-
Nanoelectronic Modeling Lecture 34: Alloy Disorder in Quantum Dots
Online Presentations | 07 Jul 2010 | Contributor(s):: Gerhard Klimeck, Timothy Boykin, Chris Bowen
This presentation discusses the consequences of Alloy Disorder in strained InGaAs Quantum Dots Reminder of the origin of bandstructure and bandstructure engineeringWhat happens when there is disorder?Concept of disorder in the local bandstructureConfiguration noise, concentration noise,...
-
Nanoelectronic Modeling Lecture 35: Alloy Disorder in Nanowires
Online Presentations | 07 Jul 2010 | Contributor(s):: Gerhard Klimeck, Timothy Boykin, Neerav Kharche, Mathieu Luisier, Neophytos Neophytou
This presentation discusses the consequences of Alloy Disorder in unstrained strained AlGaAs nanowiresRelationship between dispersion relationship and transmission in perfectly ordered wiresBand folding in Si nanowiresTranmisison in disordered wires – relationship to an approximate...
-
Nanoelectronic Modeling Lecture 41: Full-Band and Atomistic Simulation of Realistic 40nm InAs HEMT
Online Presentations | 08 Jul 2010 | Contributor(s):: Gerhard Klimeck, Neerav Kharche, Neophytos Neophytou, Mathieu Luisier
This presentation demonstrates the OMEN capabilities to perform a multi-scale simulation of advanced InAs-based high mobility transistors.Learning Objectives:Quantum Transport Simulator Full-Band and Atomistic III-V HEMTs Performance Analysis Good Agreement with Experiment Some Open Issues...
-
Nanoelectronic Modeling: Exercises 1-3 - Barrier Structures, RTDs, and Quantum Dots
Online Presentations | 27 Jan 2010 | Contributor(s):: Gerhard Klimeck
Exercises:Barrier StructuresUses: Piece-Wise Constant Potential Barrier ToolResonant Tunneling DiodesUses: Resonant Tunneling Diode Simulation with NEGF • Hartree calculation • Thomas Fermi potentialQuantum DotsUses: Quantum Dot Lab • pyramidal dot
-
Nanoelectronics/Mechanics With Carbon Nanotubes
Online Presentations | 26 Feb 2004 | Contributor(s):: Ji-Yong Park
In this talk, I will present efforts to understand electrical/mechanical properties of carbon nanotubes (CNTs) by combining electric transport measurements and the scanning probe microscopy.
-
nanoMATERIALS SeqQuest DFT
Tools | 04 Feb 2008 | Contributor(s):: Ravi Pramod Kumar Vedula, Greg Bechtol, Benjamin P Haley, Alejandro Strachan
DFT calculations of materials
-
Nanotechnology Animation Gallery
Teaching Materials | 20 Apr 2010 | Contributor(s):: Saumitra Raj Mehrotra, Gerhard Klimeck
Animations and visualization are generated with various nanoHUB.org tools to enable insight into nanotechnology and nanoscience. Click on image for detailed description and larger image download. Additional animations are also...