PQS

Search Software

The PQS ab initio module is a computational chemistry package capable of performing Hartree-Fock, semi-empirical, density functional theory, and MP2 calculations.

SW Documentation: 

For a short introduction to the QuantumCube and the PQS software, please view this recent tutorial

http://http://www.pqs-chem.com/capabilities.php

Short Name: 
pqs
SW Module: 
Service Level: 
Minimal
SW Category: