Source: spglib, cod-tools Control: found -1 spglib/1.11.0-1 Control: found -1 cod-tools/2.2+dfsg-3 X-Debbugs-CC: debian...@lists.debian.org User: debian...@lists.debian.org Usertags: breaks needs-update
Dear maintainers,
With a recent upload of spglib the autopkgtest of cod-tools fails in
testing when that autopkgtest is run with the binary packages of spglib
from unstable. It passes when run with only packages from testing. In
tabular form:
pass fail
spglib from testing 1.11.0-1
cod-tools from testing 2.2+dfsg-3
all others from testing from testing
I copied some of the output at the bottom of this report.
Currently this regression is contributing to the delay of the migration
of spglib to testing [1]. Due to the nature of this issue, I filed this
bug report against both packages. Can you please investigate the
situation and reassign the bug to the right package? If needed, please
change the bug's severity.
More information about this bug and the reason for filing it can be found on
https://wiki.debian.org/ContinuousIntegration/RegressionEmailInformation
Paul
[1] https://qa.debian.org/excuses.php?package=spglib
https://ci.debian.net/data/autopkgtest/testing/amd64/c/cod-tools/1296192/log.gz
/tmp/autopkgtest-lxc.9ex462xd/downtmp/autopkgtest_tmp/tests/cases/cif_find_symmetry_001.inp:
FAILED:
50,53c50,53
< V1 V 0.5 0.8222 0.25 0.00000 Uiso 1.00
< H2 H 0.5 0.5149 0.25 0.00000 Uiso 0.50
< O9 O 0 0.7111 0.25 0.00000 Uiso 1.00
< O10 O 0 0.9262 0.25 0.00000 Uiso 1.00
---
> V1 V 0.5 0.1778 0.25 0.00000 Uiso 1.00
> H2 H 0.5 0.4851 0.25 0.00000 Uiso 0.50
> O9 O 1 0.2889 0.25 0.00000 Uiso 1.00
> O10 O 1 0.0738 0.25 0.00000 Uiso 1.00
/tmp/autopkgtest-lxc.9ex462xd/downtmp/autopkgtest_tmp/tests/cases/cif_find_symmetry_002.inp:
OK
/tmp/autopkgtest-lxc.9ex462xd/downtmp/autopkgtest_tmp/tests/cases/cif_find_symmetry_003.inp:
Test skipped by request - test only compatible with spglib v1.9.9
/tmp/autopkgtest-lxc.9ex462xd/downtmp/autopkgtest_tmp/tests/cases/cif_find_symmetry_004.inp:
Test skipped by request - test only compatible with spglib v1.9.9
/tmp/autopkgtest-lxc.9ex462xd/downtmp/autopkgtest_tmp/tests/cases/cif_find_symmetry_005.inp:
FAILED:
32,33c32,33
< _cell_angle_alpha 89.9999831346
< _cell_angle_beta 89.9999831346
---
> _cell_angle_alpha 90.0000168654
> _cell_angle_beta 90.0000168654
/tmp/autopkgtest-lxc.9ex462xd/downtmp/autopkgtest_tmp/tests/cases/cif_find_symmetry_006.inp:
OK
/tmp/autopkgtest-lxc.9ex462xd/downtmp/autopkgtest_tmp/tests/cases/cif_find_symmetry_007.inp:
Test skipped by request - test only compatible with spglib v1.9.9
/tmp/autopkgtest-lxc.9ex462xd/downtmp/autopkgtest_tmp/tests/cases/cif_find_symmetry_008.inp:
FAILED:
2c2
< _cell_length_a 4.01206506674
---
> _cell_length_a 4.01206456672
5,7c5,7
< _cell_angle_alpha 90.0000000001
< _cell_angle_beta 89.9999999995
< _cell_angle_gamma 120.000007695
---
> _cell_angle_alpha 89.9999999999
> _cell_angle_beta 89.9999999996
> _cell_angle_gamma 119.999995327
24,25c24,25
< Ac 0.333333333333 0.666666666667 0.666666666667
< Ac 0.666666666667 0.333333333333 0.555533333333
---
> Ac 0.666666666667 0.333333333333 0.333333333333
> Ac 0.333333333333 0.666666666667 0.444466666667
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