ONETEP (Order-N Electronic Total Energy Package) is a linear-scaling code for quantum-mechanical calculations based on density-functional theory.

Latest news

ONETEP Masterclass 2024

ONETEP Academic Release version 7.0 is now available!

ONETEP Masterclass 2023

ONETEP Masterclass is now full

Karl Wilkinson Prize

The ODG are pleased to announce the winner of the 2019 Karl Wilkinson prize: Subhayan Roychoudhury!

Find out more