4 Commits

Author	SHA1	Message	Date
Anthony Scemama	d56c9dcb0f	Option to add automatically dummy basis functions	2015-11-17 22:25:26 +01:00
Anthony Scemama	3fd80125e4	Added lots of mli files for better error messages	2014-10-26 17:35:39 +01:00
Anthony Scemama	caafe823be	Added Molecule.of_xyz_file	2014-08-26 14:39:23 +02:00
Anthony Scemama	9bffc0883b	Added molecule in ocaml	2014-08-24 20:00:26 +02:00