Home
Basis Sets Lab Activity
Basis Set Main Page
Students
Introduction
Objectives
Background Reading
Procedure
Questions
Further Work
References/Support Materials
Teachers
Additional Background
Materials
Standards
First year chemistry curriculum concepts
Second year chemistry curriculum concepts
Readings
Overview
Atomic Orbitals
Lab Activities
Z-matrices
Basis Sets
Geometry Optimizations
Ionization Energies
Support Materials
Interactive Tools
Glossary of Terms
Quick Guide to DISCO Output File
Related Links
ChemViz
Computational Chemistry
SUCCEED's Computational Chemistry
Developers' Tools
What's New?
Discussion Board
Team Members
Email the Group
Contact Webmaster
|
In this lab you will be required to create a spreadsheet that will allow you
to compare a set of STOs and GTOs. This will be done for a hydrogen atom which
has only one electron. You will make the assumption that the Slater Type
Orbital answers are the most accurate and then attempt to model your Gaussian
Type Orbitals to fit the STOs.
|
|