Please see documentation on customizing the interface and the User's Guide for usage and configuration help.

The plan is to create a wiki page rich in information useful to computational or theoretical chemists as well as computational scientists. PLEASE contribute often!!

Contents 1 Chemistry Data 2 Comprehensive Computational Chemistry DataBase (CCCDB) 3 Computational Chemistry 4 Fortran 90/95/2000 5 Fundamental Constants 6 Literature 7 Glossary 8 Software 9 Theoretical Chemistry 10 UNIX commands

Chemistry Data

Molecular structure, vibrational frequencies, heats of formation, ...

Comprehensive Computational Chemistry DataBase (CCCDB)

Computational Chemistry

Practical guidelines, recommendations

Fortran 90/95/2000

Features of Fortran 90/95 that are used in MUNgauss

Fundamental Constants

Literature

References to relevant computational and theoretical journal articles and books.

Glossary

Glossary of terms related to theoretical, computational or physical chemistry

Software

Gaussian, MUNgauss, GAMESS, GROMACS, MOLden ...

Theoretical Chemistry

Basics of theoretical chemistry, and new and developing theories.

UNIX commands

The how to of using UNIX