Advanced Methods for Electronic Structure

This project will advance the capabilities of quantum chemical methods to describe efficiently and with controllable accuracy the electronic structure, statistical mechanics, and dynamics of atoms, molecules, and clusters.

Reports

• 2004 Annual Update: Multiresolution Quantum Chemistry – Guaranteed Precision and Speed

 
• 2003 Annual Update (Harrison): Guaranteed Precision and Speed – Multiresolution Quantum Chemistry
• 2003 Annual Update (Head-Gordon): Advanced Methods for Electronic Structure: Local Coupled Cluster Theory

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