LCPQ/qp2
9
1
Fork 0
mirror of https://github.com/QuantumPackage/qp2.git synced 2024-11-07 14:03:37 +01:00
Code Releases Activity
f4e305c0a4
qp2/ocaml
History
Anthony Scemama f4e305c0a4 Doc'
2019-03-13 15:56:44 +01:00
..
tests Initial commit 2019-01-25 11:39:31 +01:00
_tags Removed core 2019-03-13 15:49:57 +01:00
.gitignore Doc' 2019-03-13 15:56:44 +01:00
.merlin Initial commit 2019-01-25 11:39:31 +01:00
Address.ml Initial commit 2019-01-25 11:39:31 +01:00
Atom.ml Removing Core 2019-03-13 14:08:02 +01:00
Atom.mli Initial commit 2019-01-25 11:39:31 +01:00
Basis.ml Initial commit 2019-01-25 11:39:31 +01:00
Basis.mli Initial commit 2019-01-25 11:39:31 +01:00
Bit.ml Removing Core 2019-03-13 14:08:02 +01:00
Bit.mli Initial commit 2019-01-25 11:39:31 +01:00
Bitlist.ml Removing Core 2019-03-13 14:08:02 +01:00
Bitlist.mli Initial commit 2019-01-25 11:39:31 +01:00
c_bindings.c Develop (#15) 2019-03-07 16:29:06 +01:00
Charge.ml Removing Core 2019-03-13 14:08:02 +01:00
Charge.mli Initial commit 2019-01-25 11:39:31 +01:00
Command_line.ml Initial commit 2019-01-25 11:39:31 +01:00
Command_line.mli Initial commit 2019-01-25 11:39:31 +01:00
create_git_sha1.sh Removing Core 2019-03-13 14:08:02 +01:00
Determinant.ml Initial commit 2019-01-25 11:39:31 +01:00
Determinant.mli Initial commit 2019-01-25 11:39:31 +01:00
element_create_db.ml Removing Core 2019-03-13 14:08:02 +01:00
Element.ml Removed Core from qp_create_ezfio.ml 2019-03-13 11:35:21 +01:00
Element.mli Initial commit 2019-01-25 11:39:31 +01:00
Excitation.ml Removing Core 2019-03-13 14:08:02 +01:00
Excitation.mli Initial commit 2019-01-25 11:39:31 +01:00
Gamess.ml Removed core 2019-03-13 15:49:57 +01:00
GaussianPrimitive.ml Removing Core 2019-03-13 14:08:02 +01:00
Generic_input_of_rst.ml Removing Core 2019-03-13 14:08:02 +01:00
Gto.ml Initial commit 2019-01-25 11:39:31 +01:00
Gto.mli Initial commit 2019-01-25 11:39:31 +01:00
Id.ml Initial commit 2019-01-25 11:39:31 +01:00
Id.mli Initial commit 2019-01-25 11:39:31 +01:00
Input_ao_basis.ml Removed core 2019-03-13 15:49:57 +01:00
Input_bitmasks.ml Removed core 2019-03-13 15:49:57 +01:00
Input_determinants_by_hand.ml Removed core 2019-03-13 15:49:57 +01:00
Input_electrons.ml Removed core 2019-03-13 15:49:57 +01:00
Input_mo_basis.ml Removed core 2019-03-13 15:49:57 +01:00
Input_nuclei_by_hand.ml Removed core 2019-03-13 15:49:57 +01:00
Input.ml Removed core 2019-03-13 15:49:57 +01:00
Io_ext.ml Initial commit 2019-01-25 11:39:31 +01:00
Long_basis.ml Initial commit 2019-01-25 11:39:31 +01:00
Long_basis.mli Initial commit 2019-01-25 11:39:31 +01:00
Makefile Initial commit 2019-01-25 11:39:31 +01:00
Message_lexer.mll Initial commit 2019-01-25 11:39:31 +01:00
Message.ml Removing Core 2019-03-13 14:08:02 +01:00
MO_class.ml Removed Core from qp_create_ezfio.ml 2019-03-13 11:35:21 +01:00
MO_class.mli Initial commit 2019-01-25 11:39:31 +01:00
MO_label.ml Removed Core from qp_create_ezfio.ml 2019-03-13 11:35:21 +01:00
MO_label.mli Initial commit 2019-01-25 11:39:31 +01:00
Molecule.ml Removed core 2019-03-13 15:49:57 +01:00
Molecule.mli Initial commit 2019-01-25 11:39:31 +01:00
Multiplicity.ml Removing Core 2019-03-13 14:08:02 +01:00
Multiplicity.mli Initial commit 2019-01-25 11:39:31 +01:00
myocamlbuild.ml Develop (#15) 2019-03-07 16:29:06 +01:00
Point3d.ml Removed Core from qp_create_ezfio.ml 2019-03-13 11:35:21 +01:00
Point3d.mli Initial commit 2019-01-25 11:39:31 +01:00
Primitive.mli Initial commit 2019-01-25 11:39:31 +01:00
Progress_bar.ml Removing Core 2019-03-13 14:08:02 +01:00
Pseudo.ml Removing Core 2019-03-13 14:08:02 +01:00
qp_create_ezfio.ml Removed core 2019-03-13 15:49:57 +01:00
qp_print_basis.ml Develop (#15) 2019-03-07 16:29:06 +01:00
qp_run.ml Removed Core from qp_run 2019-03-13 14:44:21 +01:00
qp_set_mo_class.ml Develop (#15) 2019-03-07 16:29:06 +01:00
Qpackage.ml Removing Core 2019-03-13 14:08:02 +01:00
qptypes_generator.ml Initial commit 2019-01-25 11:39:31 +01:00
Qputils.ml Removed core 2019-03-13 15:49:57 +01:00
Queuing_system.ml Removed core 2019-03-13 15:49:57 +01:00
Queuing_system.mli Initial commit 2019-01-25 11:39:31 +01:00
Range.ml Initial commit 2019-01-25 11:39:31 +01:00
Range.mli Initial commit 2019-01-25 11:39:31 +01:00
README_qp_edit.rst Initial commit 2019-01-25 11:39:31 +01:00
README.rst Initial commit 2019-01-25 11:39:31 +01:00
String_ext.ml Removed core 2019-03-13 15:49:57 +01:00
Symmetry.ml Initial commit 2019-01-25 11:39:31 +01:00
Symmetry.mli Initial commit 2019-01-25 11:39:31 +01:00
TaskServer.ml Removing Core 2019-03-13 14:08:02 +01:00
TaskServer.mli Develop (#15) 2019-03-07 16:29:06 +01:00
To_md5.ml Initial commit 2019-01-25 11:39:31 +01:00
Units.ml Initial commit 2019-01-25 11:39:31 +01:00
Units.mli Initial commit 2019-01-25 11:39:31 +01:00
Zmatrix.ml Initial commit 2019-01-25 11:39:31 +01:00

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>`_.