
Dacapo 1.04
Free
Latest version:
1.04.0001
See all
Developer:
FEV Motorentechnik GmbH
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).
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