Quantum Chemistry Software Manuals

Here are some links to on-line manuals for some of the Quantum Chemistry software used by me. Some links need updating and I will do that soon.

• Gamess (US) Quantum Chemistry Program.

• Tinker Molecular Mechanics Program.

• Dalton Quantum Chemistry Program.

• ZINDO Semi-empirical Molecular Orbital Method.

• Columbus Part of the Ohio State version of this ab initio code.

• MOPAC6 Quantum Chemistry Program. Note that we use MOPAC93 - the generally available version, but this manual is useful.

• CADPAC - the Cambridge Analytical Derivatives Program. Note this can only be used at ANU.

• MOLPRO Quantum Chemistry Package. Note this can only be used at ANU.