Your message dated Wed, 24 Nov 2021 09:34:26 +0000
with message-id <e1mpofa-000j0p...@fasolo.debian.org>
and subject line Bug#1000466: fixed in phonopy 2.12.0-2
has caused the Debian Bug report #1000466,
regarding phonopy: autopkgtest failure
to be marked as done.
This means that you claim that the problem has been dealt with.
If this is not the case it is now your responsibility to reopen the
Bug report if necessary, and/or fix the problem forthwith.
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--
1000466: https://bugs.debian.org/cgi-bin/bugreport.cgi?bug=1000466
Debian Bug Tracking System
Contact ow...@bugs.debian.org with problems
--- Begin Message ---
Source: phonopy
Version: 2.12.0-1
Severity: serious
https://ci.debian.net/data/autopkgtest/testing/amd64/p/phonopy/16901578/log.gz
...
=================================== FAILURES ===================================
_________________________________ test_QHA_Si __________________________________
self = <phonopy.qha.eos.EOSFit object at 0x7feba99a84c0>
initial_parameters = [-43.375124, 1.0, 4.0, 163.32]
def fit(self, initial_parameters):
"""Fit."""
import logging
import sys
import warnings
try:
> import scipy
E ModuleNotFoundError: No module named 'scipy'
/usr/lib/python3/dist-packages/phonopy/qha/eos.py:133: ModuleNotFoundError
During handling of the above exception, another exception occurred:
def test_QHA_Si():
"""Test of QHA calculation by Si."""
indices = list(range(11))
> phonopy_qha = PhonopyQHA(
volumes=ev_vs_v[indices, 0],
electronic_energies=ev_vs_v[indices, 1],
eos="vinet",
temperatures=temperatures,
free_energy=fe_phonon[:, indices],
cv=cv[:, indices],
entropy=entropy[:, indices],
t_max=1000,
verbose=True,
)
test/qha/test_QHA.py:154:
_ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _
/usr/lib/python3/dist-packages/phonopy/api_qha.py:105: in __init__
self._bulk_modulus = BulkModulus(volumes, electronic_energies, eos=eos)
/usr/lib/python3/dist-packages/phonopy/qha/core.py:82: in __init__
) = fit_to_eos(volumes, self._energies, self._eos)
/usr/lib/python3/dist-packages/phonopy/qha/eos.py:101: in fit_to_eos
fit.fit([fe[len(fe) // 2], 1.0, 4.0, volumes[len(volumes) // 2]])
_ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _
self = <phonopy.qha.eos.EOSFit object at 0x7feba99a84c0>
initial_parameters = [-43.375124, 1.0, 4.0, 163.32]
def fit(self, initial_parameters):
"""Fit."""
import logging
import sys
import warnings
try:
import scipy
from scipy.optimize import leastsq
except ImportError:
print("You need to install python-scipy.")
> sys.exit(1)
E SystemExit: 1
/usr/lib/python3/dist-packages/phonopy/qha/eos.py:137: SystemExit
----------------------------- Captured stdout call -----------------------------
You need to install python-scipy.
=========================== short test summary info ============================
FAILED test/qha/test_QHA.py::test_QHA_Si - SystemExit: 1
============= 1 failed, 138 passed, 1 skipped in 62.19s (0:01:02) ==============
autopkgtest [15:31:27]: test command1: -----------------------]
autopkgtest [15:31:27]: test command1: - - - - - - - - - - results - - - - - -
- - - -
python3-scipy is a !nocheck build dependency.
--- End Message ---
--- Begin Message ---
Source: phonopy
Source-Version: 2.12.0-2
Done: Andrius Merkys <mer...@debian.org>
We believe that the bug you reported is fixed in the latest version of
phonopy, which is due to be installed in the Debian FTP archive.
A summary of the changes between this version and the previous one is
attached.
Thank you for reporting the bug, which will now be closed. If you
have further comments please address them to 1000...@bugs.debian.org,
and the maintainer will reopen the bug report if appropriate.
Debian distribution maintenance software
pp.
Andrius Merkys <mer...@debian.org> (supplier of updated phonopy package)
(This message was generated automatically at their request; if you
believe that there is a problem with it please contact the archive
administrators by mailing ftpmas...@ftp-master.debian.org)
-----BEGIN PGP SIGNED MESSAGE-----
Hash: SHA512
Format: 1.8
Date: Wed, 24 Nov 2021 04:16:43 -0500
Source: phonopy
Architecture: source
Version: 2.12.0-2
Distribution: unstable
Urgency: medium
Maintainer: Debichem Team <debichem-de...@lists.alioth.debian.org>
Changed-By: Andrius Merkys <mer...@debian.org>
Closes: 1000466
Changes:
phonopy (2.12.0-2) unstable; urgency=medium
.
[ Andrius Merkys ]
* python3-phonopy Depends on python3-scipy (Closes: #1000466).
.
[ lintian-brush ]
* Set upstream metadata fields: Bug-Database, Bug-Submit, Repository,
Repository-Browse.
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--- End Message ---