biology/gaussian98/pkg-descr


1
2
3
4
5
6
7
8
9
10
11

Gaussian is ab-initio molecular orbital calculation program
calculates energy, molecular structure, vibrational frequencies
from the basic principle of quantum mechanics.

We also included simple launcher called `gaussian98'
for your convenience. You don't need to set any environment variable
to run gaussian.

WWW: http://www.gaussian.com/
- NAKATA, Maho
  E-mail: chat95@mbox.kyoto-inet.or.jp