LCPQ/quantum_package
10
0
Fork 0
mirror of https://github.com/LCPQ/quantum_package synced 2025-04-16 05:29:35 +02:00
Code Issues Releases Wiki Activity
quantum_package/ocaml
History
Anthony Scemama caafe823be Added Molecule.of_xyz_file
2014-08-26 14:39:23 +02:00
..
_tags
Added GTOs in Ocaml
2014-08-13 17:54:32 +02:00
.gitignore
Added molecule in ocaml
2014-08-24 20:00:26 +02:00
atom.ml
Added Molecule.of_xyz_file
2014-08-26 14:39:23 +02:00
element.ml
Function to read the basis of an element
2014-08-23 16:18:19 +02:00
gto.ml
Added Molecule.of_xyz_file
2014-08-26 14:39:23 +02:00
Makefile
Added Molecule.of_xyz_file
2014-08-26 14:39:23 +02:00
molecule.ml
Added Molecule.of_xyz_file
2014-08-26 14:39:23 +02:00
multiplicity.ml
Added molecule in ocaml
2014-08-24 20:00:26 +02:00
point3d.ml
Added molecule in ocaml
2014-08-24 20:00:26 +02:00
primitive.ml
Added GTOs in Ocaml
2014-08-13 17:54:32 +02:00
qptypes.ml
Added molecule in ocaml
2014-08-24 20:00:26 +02:00
README.rst
Added molecule in ocaml
2014-08-24 20:00:26 +02:00
symmetry.ml
Added GTOs in Ocaml
2014-08-13 17:54:32 +02:00
test_atom.ml
Some utilities for input
2014-08-23 17:07:47 +02:00
test_elements.ml
Added molecule in ocaml
2014-08-24 20:00:26 +02:00
test_gto.ml
Function to read the basis of an element
2014-08-23 16:18:19 +02:00
test_molecule.ml
Added Molecule.of_xyz_file
2014-08-26 14:39:23 +02:00
test_point3d.ml
Some utilities for input
2014-08-23 17:07:47 +02:00

README.rst 

===============
Ocaml scripts
===============

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