[ase-users] There is one error while running the command ase test
Anant Ojha
anandojha002 at gmail.com
Wed Jan 17 12:39:54 CET 2018
Dear authority,
I have just installed ASE and there is one error while running the command
ase test. Please help me. I have sent you the entire command and the error.
anandojha002 at anand:~$ ase test
platform Linux-4.4.0-104-generic-x86_64-with-Ubuntu-16.04-xenial
python-2.7.12 /usr/bin/python
ase-3.15.0 /home/anandojha002/ase/ase/
numpy-1.14.0 /home/anandojha002/.local/lib/python2.7/site-packages/numpy/
scipy-1.0.0 /home/anandojha002/.local/lib/python2.7/site-packages/scipy/
test-dir /tmp/ase-test-QzS1J1
...........................s.....E.................ss............s......s..............s..................s.sss.....s.....ssssssssss......s....ssssss..ss..s/home/anandojha002/ase/ase/io/dmol.py:78:
FutureWarning: `rcond` parameter will change to the default of machine
precision times ``max(M, N)`` where M and N are the input matrix dimensions.
To use the future default and silence this warning we advise to pass
`rcond=None`, to keep using the old, explicitly pass `rcond=-1`.
lstsq_fit = np.linalg.lstsq(atoms.cell, new_cell)
/home/anandojha002/ase/ase/calculators/dmol.py:528: FutureWarning: `rcond`
parameter will change to the default of machine precision times ``max(M,
N)`` where M and N are the input matrix dimensions.
To use the future default and silence this warning we advise to pass
`rcond=None`, to keep using the old, explicitly pass `rcond=-1`.
lstsq_fit = np.linalg.lstsq(A, B)
/home/anandojha002/ase/ase/io/dmol.py:226: FutureWarning: `rcond` parameter
will change to the default of machine precision times ``max(M, N)`` where M
and N are the input matrix dimensions.
To use the future default and silence this warning we advise to pass
`rcond=None`, to keep using the old, explicitly pass `rcond=-1`.
lstsq_fit = np.linalg.lstsq(atoms.cell, new_cell)
......ss............s............sssss..s.ssss.ssssssssssssssss
======================================================================
ERROR: doctests.py
----------------------------------------------------------------------
Traceback (most recent call last):
File "/home/anandojha002/ase/ase/test/__init__.py", line 50, in testfile
exec(compile(fd.read(), self.filename, 'exec'), {})
File "/home/anandojha002/ase/ase/test/doctests.py", line 26, in <module>
print(mod, doctest.testmod(mod, raise_on_error=True))
File "/usr/lib/python2.7/doctest.py", line 1911, in testmod
runner.run(test)
File "/usr/lib/python2.7/doctest.py", line 1799, in run
r = DocTestRunner.run(self, test, compileflags, out, False)
File "/usr/lib/python2.7/doctest.py", line 1454, in run
return self.__run(test, compileflags, out)
File "/usr/lib/python2.7/doctest.py", line 1363, in __run
self.report_failure(out, test, example, got)
File "/usr/lib/python2.7/doctest.py", line 1808, in report_failure
raise DocTestFailure(test, example, got)
DocTestFailure: <DocTest ase.spacegroup.spacegroup.Spacegroup from
/home/anandojha002/ase/ase/spacegroup/spacegroup.py:49 (6 examples)>
----------------------------------------------------------------------
Ran 219 tests in 99.196s
FAILED (errors=1, skipped=60)
--
WIth regards,
*A. Anand Ojha, *
*ETH-Zurich.*
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