ONETEP (Order-N Electronic Total Energy Package) is a linear-scaling code for quantum-mechanical calculations based on density-functional theory.
ONETEP has been used to provide new insights on a variety of high-impact industrial and technological challenges. A selection of these applications are highlighted in the following case studies.
Karl Wilkinson Prize
The ODG are pleased to announce the winner of the 2019 Karl Wilkinson prize: Subhayan Roychoudhury!