Skip to: Site menu | Main content

2012 NWChem Workshop, June 8-9

Basic Introduction of Computational Chemistry Basic Introduction of NWChem software Ground and Excited States with DFT and TDDFT Correlated Methods for Ground and Excited states Relativity, Spectroscopy and the EMSL Basis Set Library Classical Molecular Dynamics and QM/MM Ab Initio Plane Wave Molecular Dynamics