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|ultrasoft pseudo-potentials. For an overview see the `Dacapo Pseudopotential library <http://oldwww.fysik.dtu.dk/CAMPOS/Documentation/Dacapo/PseudoPotentialOverView/index.html>`_.||ultrasoft pseudo-potentials. For an overview see the `Pseudopotential Library` page`_.|
Dacapo is a total energy program based on density functional theory. It uses a plane wave basis for the valence electronic states and describes the core-electron interactions with Vanderbilt ultrasoft pseudo-potentials. For an overview see the Pseudopotential Library page`_.
Calculations using dacapo are done using the Atomic Simulation Environment (ASE).