Comput. Chemistry Lab

3rd Year Computational Chemistry Lab

Introduction

some introductory comments to go here

Resources

my web page: http://www.ch.ic.ac.uk/hunt/ click on the "links" tab (along the top), and then on "resources" in the left hand menu
Gaussian online manual: http://www.gaussian.com/g_ur/g03mantop.htm
and the book "Exploring Chemistry with Electronic Structure Methods",
by JB Foresmam and A. Frisch.

Parts

Part A: Ammonia
Part B: Phosporous Trichloride
Part C: Individual Projects

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