LCPQ/quantum_package
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quantum_package/data
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TApplencourt d8fa797cf8 Add basis set in qp
2016-01-14 15:17:57 +01:00
..
ezfio_defaults n_det_max in in dets, and PT2_max and var_pt2_max are in Perturbation. Delete all the multiple occurance 2015-05-12 15:14:54 +02:00
.gitignore Removed useless stuff in data (old input files) 2015-01-15 16:44:55 +01:00
BFD-Orbital.dump Add basis set in qp 2016-01-14 15:17:57 +01:00
BFD-Pseudo.dump Add basis set in qp 2016-01-14 15:17:57 +01:00
GAMESS-US.dump Add basis set in qp 2016-01-14 15:17:57 +01:00
periodic-table Added cc-pVDZ basis set and periodic table data 2014-08-13 16:00:52 +02:00
README.rst Removed useless stuff in data (old input files) 2015-01-15 16:44:55 +01:00

README.rst 

====
Data
====


This directory contains all the data files needed for the Quantum Package.