Computational Chemistry
Spring 2005
Instructor:
Jiali Gao
101G Smith Hall, 625-0769
Office Hour: Tuesday 1-2pm and by appointment
TA:
Vanessa Lynch
224 Smith Hall, 626-0259
Office Hour: Friday 1-2pm and by appointment
General Information
Syllabus
Course Outline
Contact Info
Handouts and Selected Lecture Presentations
Unix Reference Card
Unix Tutorial
Insight II Tutorial
Insight II Practice Notes
Empirical Force Fields Lecture Presentation
1/28/05
Introduction to GaussView and Gaussian Tutorial
Assignments
Project 1
Assigned: 2-2-05 Due: 2-23-05
Solutions for Project 1
Example Write-up for Project 1
This is a great example of a write-up one of your fellow students did.
Project 2
Assigned: 2-23-05 Due: 3-23-05
Solutions for Project 2
Project 3
Assigned: 3-2-05 Due: 4-6-05
Project 4
Assigned: 4-15-05 Due: 5-1-05
Project 5
Assigned: 4-27-05 Due: 5-9-05
Announcements
Need help setting up your alias to CHARMM? Click
here
.
Useful Links
MSI
Comp Chem
SSH Program
Read about and download this free program to login to the SP from home.
Or you can download another version
here
as well.
Electronic Journals
Last updated on April 19, 2005.
Please contact Vanessa Lynch with any problems with this page.