
Homework assignment: learning about elastic constants via molecular dynamics simulations
11 Mar 2015  Teaching Materials  Contributor(s): Alejandro Strachan, David Ray Johnson
In this homework assignment students will use molecular dynamics to compute the elastic constants of metals using an embedded atom model to describe atomic interactions. They will deform a...
http://nanohub.org/resources/21949

Melting via molecular dynamics simulations
10 Mar 2015  Teaching Materials  Contributor(s): Alejandro Strachan
In this assignment you will use MD simulations to study melting in metals using the nanoMATERIALS simulation tool in nanoHUB. You will build a supercell and heat it up to study its melting. You...
http://nanohub.org/resources/22025

OnlineSimulation tutorial and assignment: bonding curves in H2 and He2 molecules
21 Feb 2015  Teaching Materials  Contributor(s): Alejandro Strachan
In this tutorial students will use density functional theory (DFT) calculations using the nanoHUB tool SeqQuest to study bonding in two simple molecules: H2 and He2. The tutorial shows how to...
http://nanohub.org/resources/21952

OnlineSimulation tutorial and assignment: electronic structure and spin in O2 molecule
21 Feb 2015  Teaching Materials  Contributor(s): Alejandro Strachan
In this tutorial students will use density functional theory (DFT) calculations using the nanoHUB tool SeqQuest to study the electronic structure and bonding in the O2 molecular. The...
http://nanohub.org/resources/21954

OnlineSimulation tutorial and assignment: electronic structure and spin of the O atom
21 Feb 2015  Teaching Materials  Contributor(s): Alejandro Strachan
In this tutorial students will use density functional theory (DFT) calculations using the nanoHUB tool SeqQuest to study the electronic structure of the oxygen atom. The tutorial shows...
http://nanohub.org/resources/21956

Carbon NanoTubes: Structure  Properties  Applications
19 Mar 2012  Teaching Materials  Contributor(s): Yuri A Kruglyak
Presentation slides for seminar given for students of Faculty of Computer Sciences of Odessa State Environmental University, Ukraine by Prof. Yuri Kruglyak on May 22, 2008.
http://nanohub.org/resources/13530

MSE 405 Homework Assignment 1
29 Jan 2011  Teaching Materials  Contributor(s): Mark Hersam
http://nanohub.org/resources/10632

MSE 405 Homework Assignment 2
29 Jan 2011  Teaching Materials  Contributor(s): Mark Hersam
http://nanohub.org/resources/10634

MSE 405 Homework Assignment 3
29 Jan 2011  Teaching Materials  Contributor(s): Mark Hersam
http://nanohub.org/resources/10636

MSE 405 Homework Assignment 4
29 Jan 2011  Teaching Materials  Contributor(s): Mark Hersam
http://nanohub.org/resources/10638

MSE 405 Homework Assignment 5
29 Jan 2011  Teaching Materials  Contributor(s): Mark Hersam
http://nanohub.org/resources/10640

MSE 405 Homework Assignment 6
29 Jan 2011  Teaching Materials  Contributor(s): Mark Hersam
http://nanohub.org/resources/10642

ME 597 Homework 4: AMAFM Scans and Basics of FMAFM
29 Dec 2010  Teaching Materials  Contributor(s): Ron Reifenberger
Problems:
Setting the feedback parameters in AMAFM scanning
Factors Affecting Contrast in dAFM Topographic and Phase Images
FMAFM
A dAFM “pocket guide”
http://nanohub.org/resources/10241

ME 597 Homework 3:
29 Dec 2010  Teaching Materials  Contributor(s): Arvind Raman
Problems:
Steady state vibration response far from sample
Attractive and repulsive regimes of oscillation
Practical issues
Theory
http://nanohub.org/resources/10239

ME 597 Homework 2: AFM Cantilevers
18 Oct 2010  Teaching Materials  Contributor(s): Arvind Raman
http://nanohub.org/resources/9887

ME 597 Homework 1: Quantum Transmission
18 Oct 2010  Teaching Materials  Contributor(s): Ron Reifenberger
Problems:
Transmission through a Square Barrier
Transmission resonances for an array of square barriers
A simple model for the vdW interaction
http://nanohub.org/resources/9885

Illinois ECE 440: Introduction to Crystal Properties Homework
28 Jan 2010  Teaching Materials  Contributor(s): Mohamed Mohamed
This homework Assignment covers basic introduction to Material Properties and Crystal Structures.
http://nanohub.org/resources/8243

Atomic Picture of Plastic Deformation in Metals: Lab Assignment Handout
19 Jan 2010  Teaching Materials  Contributor(s): Alejandro Strachan
In this lab students will perform online molecular dynamics (MD) simulations of metallic nanowires deformed uniaxially and analyze the results...
http://nanohub.org/resources/8140

CNTbands: FirstTime User Guide
15 Jun 2009  Teaching Materials  Contributor(s): Xufeng Wang, Youngki Yoon
This is a simple guide designed for firsttime users of CNTbands. It gives a brief introduction of the tool and a series of tutorials to help users learn the basics of CNTbands.
NCN@Purdue
http://nanohub.org/resources/6909

ABINIT: FirstTime User Guide
09 Jun 2009  Teaching Materials  Contributor(s): Benjamin P Haley
This firsttime user guide provides an introduction to using ABINIT on nanoHUB. We include a very brief summary of Density Functional Theory along with a tour of the Rappture interface. We...
http://nanohub.org/resources/6874