Introduction to Atomistix ToolKit and Virtual NanoLab
Introduction
Virtual NanoLab
Tutorial
Version
12.8
Copyright © 2008–2012 QuantumWise A/S
Legal Notice
Table of Contents
Introduction
ATK and VNL
Prerequisites
Overview of the work flow
Moving data around in VNL
Calculating the band structure of β-cristobalite
Preface
Defining the crystal
Setting up the calculation
Viewing a calculation script
Running the script
Analyzing your result
Transmission spectrum of a graphene nanoribbon with a distortion
Preface
Building the transport system
Optimizing the geometry
Setting up the transmission calculation
Analyzing the results
Comparing the results to a perfect ribbon
