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changelog for v0.33 #1079

changelog for v0.33

changelog for v0.33 #1079

Triggered via pull request July 31, 2025 16:40
Status Failure
Total duration 13m 51s
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on: pull_request
Matrix: build
Matrix: release_sphinx
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1 error and 54 warnings
🐍 3.11 • optimization-dispersion • windows-latest
Process completed with exit code 1.
🐍 3.10 • xTB • ubuntu-latest
/usr/share/miniconda/lib/python3.13/argparse.py:1258: FutureWarning: `remote_definition` is deprecated and will be removed in 25.9. Use `conda env create --file=URL` instead. subnamespace, arg_strings = subparser.parse_known_args(arg_strings, None)
🐍 3.10 • xTB • ubuntu-latest
WARNING conda.cli.main_config:_set_key(453): Key auto_activate_base is an alias of auto_activate; setting value with latter
🐍 3.10 • xTB • ubuntu-latest
/usr/share/miniconda/lib/python3.13/site-packages/conda/base/context.py:211: FutureWarning: Adding 'defaults' to channel list implicitly is deprecated and will be removed in 25.9. To remove this warning, please choose a default channel explicitly with conda's regular configuration system, e.g. by adding 'defaults' to the list of channels: conda config --add channels defaults For more information see https://docs.conda.io/projects/conda/en/stable/user-guide/configuration/use-condarc.html deprecated.topic(
🐍 3.10 • MACE • ubuntu-latest
/usr/share/miniconda/lib/python3.13/argparse.py:1258: FutureWarning: `remote_definition` is deprecated and will be removed in 25.9. Use `conda env create --file=URL` instead. subnamespace, arg_strings = subparser.parse_known_args(arg_strings, None)
🐍 3.10 • MACE • ubuntu-latest
WARNING conda.cli.main_config:_set_key(453): Key auto_activate_base is an alias of auto_activate; setting value with latter
🐍 3.10 • MACE • ubuntu-latest
/usr/share/miniconda/lib/python3.13/site-packages/conda/base/context.py:211: FutureWarning: Adding 'defaults' to channel list implicitly is deprecated and will be removed in 25.9. To remove this warning, please choose a default channel explicitly with conda's regular configuration system, e.g. by adding 'defaults' to the list of channels: conda config --add channels defaults For more information see https://docs.conda.io/projects/conda/en/stable/user-guide/configuration/use-condarc.html deprecated.topic(
🐍 3.11 • AIMNET2 • ubuntu-latest
/usr/share/miniconda/lib/python3.13/argparse.py:1258: FutureWarning: `remote_definition` is deprecated and will be removed in 25.9. Use `conda env create --file=URL` instead. subnamespace, arg_strings = subparser.parse_known_args(arg_strings, None)
🐍 3.11 • AIMNET2 • ubuntu-latest
WARNING conda.cli.main_config:_set_key(453): Key auto_activate_base is an alias of auto_activate; setting value with latter
🐍 3.11 • AIMNET2 • ubuntu-latest
/usr/share/miniconda/lib/python3.13/site-packages/conda/base/context.py:211: FutureWarning: Adding 'defaults' to channel list implicitly is deprecated and will be removed in 25.9. To remove this warning, please choose a default channel explicitly with conda's regular configuration system, e.g. by adding 'defaults' to the list of channels: conda config --add channels defaults For more information see https://docs.conda.io/projects/conda/en/stable/user-guide/configuration/use-condarc.html deprecated.topic(
🐍 3.7 • QCore • ubuntu-latest
/usr/share/miniconda/lib/python3.13/argparse.py:1258: FutureWarning: `remote_definition` is deprecated and will be removed in 25.9. Use `conda env create --file=URL` instead. subnamespace, arg_strings = subparser.parse_known_args(arg_strings, None)
🐍 3.7 • QCore • ubuntu-latest
WARNING conda.cli.main_config:_set_key(453): Key auto_activate_base is an alias of auto_activate; setting value with latter
🐍 3.7 • QCore • ubuntu-latest
/usr/share/miniconda/lib/python3.13/site-packages/conda/base/context.py:211: FutureWarning: Adding 'defaults' to channel list implicitly is deprecated and will be removed in 25.9. To remove this warning, please choose a default channel explicitly with conda's regular configuration system, e.g. by adding 'defaults' to the list of channels: conda config --add channels defaults For more information see https://docs.conda.io/projects/conda/en/stable/user-guide/configuration/use-condarc.html deprecated.topic(
🐍 3.8 • ANI • ubuntu-latest
/usr/share/miniconda/lib/python3.13/argparse.py:1258: FutureWarning: `remote_definition` is deprecated and will be removed in 25.9. Use `conda env create --file=URL` instead. subnamespace, arg_strings = subparser.parse_known_args(arg_strings, None)
🐍 3.8 • ANI • ubuntu-latest
WARNING conda.cli.main_config:_set_key(453): Key auto_activate_base is an alias of auto_activate; setting value with latter
🐍 3.8 • ANI • ubuntu-latest
/usr/share/miniconda/lib/python3.13/site-packages/conda/base/context.py:211: FutureWarning: Adding 'defaults' to channel list implicitly is deprecated and will be removed in 25.9. To remove this warning, please choose a default channel explicitly with conda's regular configuration system, e.g. by adding 'defaults' to the list of channels: conda config --add channels defaults For more information see https://docs.conda.io/projects/conda/en/stable/user-guide/configuration/use-condarc.html deprecated.topic(
🐍 3.12 • OpenMM • ubuntu-latest
/usr/share/miniconda/lib/python3.13/argparse.py:1258: FutureWarning: `remote_definition` is deprecated and will be removed in 25.9. Use `conda env create --file=URL` instead. subnamespace, arg_strings = subparser.parse_known_args(arg_strings, None)
🐍 3.12 • OpenMM • ubuntu-latest
WARNING conda.cli.main_config:_set_key(453): Key auto_activate_base is an alias of auto_activate; setting value with latter
🐍 3.12 • OpenMM • ubuntu-latest
/usr/share/miniconda/lib/python3.13/site-packages/conda/base/context.py:211: FutureWarning: Adding 'defaults' to channel list implicitly is deprecated and will be removed in 25.9. To remove this warning, please choose a default channel explicitly with conda's regular configuration system, e.g. by adding 'defaults' to the list of channels: conda config --add channels defaults For more information see https://docs.conda.io/projects/conda/en/stable/user-guide/configuration/use-condarc.html deprecated.topic(
🐍 3.8 • OpenMM • ubuntu-latest
/usr/share/miniconda/lib/python3.13/argparse.py:1258: FutureWarning: `remote_definition` is deprecated and will be removed in 25.9. Use `conda env create --file=URL` instead. subnamespace, arg_strings = subparser.parse_known_args(arg_strings, None)
🐍 3.8 • OpenMM • ubuntu-latest
WARNING conda.cli.main_config:_set_key(453): Key auto_activate_base is an alias of auto_activate; setting value with latter
🐍 3.8 • OpenMM • ubuntu-latest
/usr/share/miniconda/lib/python3.13/site-packages/conda/base/context.py:211: FutureWarning: Adding 'defaults' to channel list implicitly is deprecated and will be removed in 25.9. To remove this warning, please choose a default channel explicitly with conda's regular configuration system, e.g. by adding 'defaults' to the list of channels: conda config --add channels defaults For more information see https://docs.conda.io/projects/conda/en/stable/user-guide/configuration/use-condarc.html deprecated.topic(
🐍 3.8 • NWChem70 • ubuntu-latest
/usr/share/miniconda/lib/python3.13/argparse.py:1258: FutureWarning: `remote_definition` is deprecated and will be removed in 25.9. Use `conda env create --file=URL` instead. subnamespace, arg_strings = subparser.parse_known_args(arg_strings, None)
🐍 3.8 • NWChem70 • ubuntu-latest
WARNING conda.cli.main_config:_set_key(453): Key auto_activate_base is an alias of auto_activate; setting value with latter
🐍 3.8 • NWChem70 • ubuntu-latest
/usr/share/miniconda/lib/python3.13/site-packages/conda/base/context.py:211: FutureWarning: Adding 'defaults' to channel list implicitly is deprecated and will be removed in 25.9. To remove this warning, please choose a default channel explicitly with conda's regular configuration system, e.g. by adding 'defaults' to the list of channels: conda config --add channels defaults For more information see https://docs.conda.io/projects/conda/en/stable/user-guide/configuration/use-condarc.html deprecated.topic(
🐍 3.10 • Psi4-1.6 • ubuntu-latest
/usr/share/miniconda/lib/python3.13/argparse.py:1258: FutureWarning: `remote_definition` is deprecated and will be removed in 25.9. Use `conda env create --file=URL` instead. subnamespace, arg_strings = subparser.parse_known_args(arg_strings, None)
🐍 3.10 • Psi4-1.6 • ubuntu-latest
WARNING conda.cli.main_config:_set_key(453): Key auto_activate_base is an alias of auto_activate; setting value with latter
🐍 3.10 • Psi4-1.6 • ubuntu-latest
/usr/share/miniconda/lib/python3.13/site-packages/conda/base/context.py:211: FutureWarning: Adding 'defaults' to channel list implicitly is deprecated and will be removed in 25.9. To remove this warning, please choose a default channel explicitly with conda's regular configuration system, e.g. by adding 'defaults' to the list of channels: conda config --add channels defaults For more information see https://docs.conda.io/projects/conda/en/stable/user-guide/configuration/use-condarc.html deprecated.topic(
🐍 3.8 • ADCC • ubuntu-latest
/usr/share/miniconda/lib/python3.13/argparse.py:1258: FutureWarning: `remote_definition` is deprecated and will be removed in 25.9. Use `conda env create --file=URL` instead. subnamespace, arg_strings = subparser.parse_known_args(arg_strings, None)
🐍 3.8 • ADCC • ubuntu-latest
WARNING conda.cli.main_config:_set_key(453): Key auto_activate_base is an alias of auto_activate; setting value with latter
🐍 3.8 • ADCC • ubuntu-latest
/usr/share/miniconda/lib/python3.13/site-packages/conda/base/context.py:211: FutureWarning: Adding 'defaults' to channel list implicitly is deprecated and will be removed in 25.9. To remove this warning, please choose a default channel explicitly with conda's regular configuration system, e.g. by adding 'defaults' to the list of channels: conda config --add channels defaults For more information see https://docs.conda.io/projects/conda/en/stable/user-guide/configuration/use-condarc.html deprecated.topic(
🐍 3.8 • ADCC • ubuntu-latest
'nodefaults' channel detected: will remove 'defaults' if added implicitly. In the future, 'nodefaults' to remove 'defaults' won't be supported. Please set 'conda-remove-defaults' = 'true' in setup-miniconda to remove this warning.
🐍 3.7 • Psi4-1.5 • ubuntu-latest
/usr/share/miniconda/lib/python3.13/argparse.py:1258: FutureWarning: `remote_definition` is deprecated and will be removed in 25.9. Use `conda env create --file=URL` instead. subnamespace, arg_strings = subparser.parse_known_args(arg_strings, None)
🐍 3.7 • Psi4-1.5 • ubuntu-latest
WARNING conda.cli.main_config:_set_key(453): Key auto_activate_base is an alias of auto_activate; setting value with latter
🐍 3.7 • Psi4-1.5 • ubuntu-latest
/usr/share/miniconda/lib/python3.13/site-packages/conda/base/context.py:211: FutureWarning: Adding 'defaults' to channel list implicitly is deprecated and will be removed in 25.9. To remove this warning, please choose a default channel explicitly with conda's regular configuration system, e.g. by adding 'defaults' to the list of channels: conda config --add channels defaults For more information see https://docs.conda.io/projects/conda/en/stable/user-guide/configuration/use-condarc.html deprecated.topic(
🐍 3.13 • optimization-dispersion • ubuntu-latest
/usr/share/miniconda/lib/python3.13/argparse.py:1258: FutureWarning: `remote_definition` is deprecated and will be removed in 25.9. Use `conda env create --file=URL` instead. subnamespace, arg_strings = subparser.parse_known_args(arg_strings, None)
🐍 3.13 • optimization-dispersion • ubuntu-latest
WARNING conda.cli.main_config:_set_key(453): Key auto_activate_base is an alias of auto_activate; setting value with latter
🐍 3.13 • optimization-dispersion • ubuntu-latest
/usr/share/miniconda/lib/python3.13/site-packages/conda/base/context.py:211: FutureWarning: Adding 'defaults' to channel list implicitly is deprecated and will be removed in 25.9. To remove this warning, please choose a default channel explicitly with conda's regular configuration system, e.g. by adding 'defaults' to the list of channels: conda config --add channels defaults For more information see https://docs.conda.io/projects/conda/en/stable/user-guide/configuration/use-condarc.html deprecated.topic(
🐍 3.12 • Psi4-1.8 • windows-latest
C:\Miniconda\Lib\argparse.py:1258: FutureWarning: `remote_definition` is deprecated and will be removed in 25.9. Use `conda env create --file=URL` instead. subnamespace, arg_strings = subparser.parse_known_args(arg_strings, None)
🐍 3.12 • Psi4-1.8 • windows-latest
WARNING conda.cli.main_config:_set_key(453): Key auto_activate_base is an alias of auto_activate; setting value with latter
🐍 3.12 • Psi4-1.8 • windows-latest
C:\Miniconda\Lib\site-packages\conda\base\context.py:211: FutureWarning: Adding 'defaults' to channel list implicitly is deprecated and will be removed in 25.9. To remove this warning, please choose a default channel explicitly with conda's regular configuration system, e.g. by adding 'defaults' to the list of channels: conda config --add channels defaults For more information see https://docs.conda.io/projects/conda/en/stable/user-guide/configuration/use-condarc.html deprecated.topic(
🐍 3.8 • MRChem • ubuntu-latest
/usr/share/miniconda/lib/python3.13/argparse.py:1258: FutureWarning: `remote_definition` is deprecated and will be removed in 25.9. Use `conda env create --file=URL` instead. subnamespace, arg_strings = subparser.parse_known_args(arg_strings, None)
🐍 3.8 • MRChem • ubuntu-latest
WARNING conda.cli.main_config:_set_key(453): Key auto_activate_base is an alias of auto_activate; setting value with latter
🐍 3.8 • MRChem • ubuntu-latest
/usr/share/miniconda/lib/python3.13/site-packages/conda/base/context.py:211: FutureWarning: Adding 'defaults' to channel list implicitly is deprecated and will be removed in 25.9. To remove this warning, please choose a default channel explicitly with conda's regular configuration system, e.g. by adding 'defaults' to the list of channels: conda config --add channels defaults For more information see https://docs.conda.io/projects/conda/en/stable/user-guide/configuration/use-condarc.html deprecated.topic(
🐍 3.12 • QCSk-next • ubuntu-latest
/usr/share/miniconda/lib/python3.13/argparse.py:1258: FutureWarning: `remote_definition` is deprecated and will be removed in 25.9. Use `conda env create --file=URL` instead. subnamespace, arg_strings = subparser.parse_known_args(arg_strings, None)
🐍 3.12 • QCSk-next • ubuntu-latest
WARNING conda.cli.main_config:_set_key(453): Key auto_activate_base is an alias of auto_activate; setting value with latter
🐍 3.12 • QCSk-next • ubuntu-latest
/usr/share/miniconda/lib/python3.13/site-packages/conda/base/context.py:211: FutureWarning: Adding 'defaults' to channel list implicitly is deprecated and will be removed in 25.9. To remove this warning, please choose a default channel explicitly with conda's regular configuration system, e.g. by adding 'defaults' to the list of channels: conda config --add channels defaults For more information see https://docs.conda.io/projects/conda/en/stable/user-guide/configuration/use-condarc.html deprecated.topic(
🐍 3.12 • QCSk-next • ubuntu-latest
'nodefaults' channel detected: will remove 'defaults' if added implicitly. In the future, 'nodefaults' to remove 'defaults' won't be supported. Please set 'conda-remove-defaults' = 'true' in setup-miniconda to remove this warning.
🐍 3.11 • optimization-dispersion • windows-latest
C:\Miniconda\Lib\argparse.py:1258: FutureWarning: `remote_definition` is deprecated and will be removed in 25.9. Use `conda env create --file=URL` instead. subnamespace, arg_strings = subparser.parse_known_args(arg_strings, None)
🐍 3.11 • optimization-dispersion • windows-latest
WARNING conda.cli.main_config:_set_key(453): Key auto_activate_base is an alias of auto_activate; setting value with latter
🐍 3.11 • optimization-dispersion • windows-latest
C:\Miniconda\Lib\site-packages\conda\base\context.py:211: FutureWarning: Adding 'defaults' to channel list implicitly is deprecated and will be removed in 25.9. To remove this warning, please choose a default channel explicitly with conda's regular configuration system, e.g. by adding 'defaults' to the list of channels: conda config --add channels defaults For more information see https://docs.conda.io/projects/conda/en/stable/user-guide/configuration/use-condarc.html deprecated.topic(
🐍 3.11 • optimization-dispersion • windows-latest
'nodefaults' channel detected: will remove 'defaults' if added implicitly. In the future, 'nodefaults' to remove 'defaults' won't be supported. Please set 'conda-remove-defaults' = 'true' in setup-miniconda to remove this warning.
🐍 3.12 • NWChem • ubuntu-latest
/usr/share/miniconda/lib/python3.13/argparse.py:1258: FutureWarning: `remote_definition` is deprecated and will be removed in 25.9. Use `conda env create --file=URL` instead. subnamespace, arg_strings = subparser.parse_known_args(arg_strings, None)
🐍 3.12 • NWChem • ubuntu-latest
WARNING conda.cli.main_config:_set_key(453): Key auto_activate_base is an alias of auto_activate; setting value with latter
🐍 3.12 • NWChem • ubuntu-latest
/usr/share/miniconda/lib/python3.13/site-packages/conda/base/context.py:211: FutureWarning: Adding 'defaults' to channel list implicitly is deprecated and will be removed in 25.9. To remove this warning, please choose a default channel explicitly with conda's regular configuration system, e.g. by adding 'defaults' to the list of channels: conda config --add channels defaults For more information see https://docs.conda.io/projects/conda/en/stable/user-guide/configuration/use-condarc.html deprecated.topic(