Source code for magnopy._parallelization
# MAGNOPY - Python package for magnons.
# Copyright (C) 2023-2025 Magnopy Team
#
# e-mail: anry@uv.es, web: magnopy.com
#
# This program is free software: you can redistribute it and/or modify
# it under the terms of the GNU General Public License as published by
# the Free Software Foundation, either version 3 of the License, or
# (at your option) any later version.
#
# This program is distributed in the hope that it will be useful,
# but WITHOUT ANY WARRANTY; without even the implied warranty of
# MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
# GNU General Public License for more details.
#
# You should have received a copy of the GNU General Public License
# along with this program. If not, see <https://www.gnu.org/licenses/>.
from multiprocessing import Pool
# Save local scope at this moment
old_dir = set(dir())
old_dir.add("old_dir")
[docs]
def multiprocess_over_k(kpoints, function, relative=False, number_processors=None):
r"""
Parallelize calculation over the kpoints using |multiprocessing|_ module.
Parameters
----------
kpoints : (N, 3) |array-like|_
List of the kpoints.
function : callable
Function that process one kpoint and will be called as
.. code-block:: python
result = function(kpoints[i], relative)
relative : bool, default False
If ``relative=True``, then ``k`` is interpreted as given relative to the
reciprocal unit cell. Otherwise it is interpreted as given in absolute
coordinates.
number_processors : int, optional
By default magnopy uses all available processes. Pass ``number_processors=1`` to
run in serial.
Returns
-------
results : (N, ) list
List of objects that are returned by the ``function``.
Notes
-----
When using this function of magnopy in your Python scripts make sure to safeguard
your script with the
.. code-block:: python
import magnopy
# Import more stuff
# or
# Define your functions, classes
if __name__ == "__main__":
# Write your executable code here
For more information refer to the "Safe importing of main module" section in
|multiprocessing|_ docs.
"""
relative = [relative for _ in kpoints]
if number_processors == 1:
results = list(map(function, kpoints, relative))
else:
with Pool(number_processors) as p:
results = p.starmap(function, zip(kpoints, relative))
return results
# Populate __all__ with objects defined in this file
__all__ = list(set(dir()) - old_dir)
# Remove all semi-private objects
__all__ = [i for i in __all__ if not i.startswith("_")]
del old_dir