e70bf2800e
* Fixes #211 * Removed debug print * Revert input coordinates * Fix MPI * Multi-state modification for qmcpack * Removed useless file |
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Symmetry | ||
basis | ||
ezfio_defaults | ||
pseudo | ||
.gitignore | ||
README.rst | ||
Titanium.png | ||
qp.png |
README.rst
==== Data ==== This directory contains all the data files needed for the Quantum Package. The `basis` directory contains some of the most popular basis sets, and the `pseudo` directory contains pseudopotential data.