QMDFF - A general quantum mechanically derived force field
QMSIM - A molecular dynamics simulation program of nonperiodic and periodic systems
FODplot tools for TURBOMOLEgCP - A geometrical counterpoise correction for HF and DFT
HF-3c - A Corrected Small Basis Set Hartree-Fock Method
CH4/CH4, CH4/CF4, and CF4/CF4 database
sTDA - A simplified Tamm-Dancoff density functional approach for electronic excitation spectra
Movies from EI-MS molecular dynamics trajectories
Peacemaker - The Quantum Cluster Equilibrium Approach to Liquid Phase Properties
TRAVIS - Trajectory Analyzer and Visualizer
Consistent Gaussian basis sets for solid-state calculations