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QuantumPackage/ocaml
History
Anthony Scemama 44a0c4a833 Merge branch 'master' into dev-lcpq
2019-08-21 16:31:15 +02:00
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tests Initial commit 2019-01-25 11:39:31 +01:00
_tags Removed core 2019-03-13 15:49:57 +01:00
.merlin Added qp_tunnel 2019-06-15 00:43:09 +02:00
Address.ml Initial commit 2019-01-25 11:39:31 +01:00
Atom.ml Removing Core 2019-03-13 14:08:02 +01:00
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Basis.ml Initial commit 2019-01-25 11:39:31 +01:00
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c_bindings.c Develop (#15) 2019-03-07 16:29:06 +01:00
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create_git_sha1.sh Removing Core 2019-03-13 14:08:02 +01:00
Determinant.ml Optimized qp_edit -n (#60) 2019-08-21 16:29:23 +02:00
Determinant.mli Initial commit 2019-01-25 11:39:31 +01:00
element_create_db.ml Removed unused variable 2019-05-27 12:08:31 +02:00
Element.ml Updated atomic data 2019-05-28 11:42:36 +02:00
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Input_determinants_by_hand.ml Optimized qp_edit -n (#60) 2019-08-21 16:29:23 +02:00
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MO_label.ml added MCSCF type (for PETER) 2019-04-11 17:04:49 +02:00
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myocamlbuild.ml Develop (#15) 2019-03-07 16:29:06 +01:00
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qp_print_basis.ml Develop (#15) 2019-03-07 16:29:06 +01:00
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qp_set_mo_class.ml Develop (#15) 2019-03-07 16:29:06 +01:00
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README_qp_edit.rst Initial commit 2019-01-25 11:39:31 +01:00
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README.rst 

===============
OCaml scripts
===============

This directory contains all the scripts that control the input/output
with the user.

All executables start with `qp_` and all tests start with `test_`. Modules
file names start with a capital letter.

Info on how to extend the `qp_edit` tool is given in
`README_qp_edit.rst <https://github.com/LCPQ/quantum_package/blob/master/ocaml/README_qp_edit.rst>`_.