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XYZ & packaging bug fixes #199

Merged
merged 6 commits into from
Mar 20, 2024

Switch internal coordinate test to atom 3

a968191
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Merged

XYZ & packaging bug fixes #199

Switch internal coordinate test to atom 3
a968191
Select commit
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Codecov / codecov/patch failed Mar 20, 2024 in 1s

53.12% of diff hit (target 66.76%)

View this Pull Request on Codecov

53.12% of diff hit (target 66.76%)

Annotations

Check warning on line 820 in src/SCF/iter.F90

See this annotation in the file changed.

@codecov codecov / codecov/patch

src/SCF/iter.F90#L819-L820

Added lines #L819 - L820 were not covered by tests

Check warning on line 941 in src/SCF/iter.F90

See this annotation in the file changed.

@codecov codecov / codecov/patch

src/SCF/iter.F90#L938-L941

Added lines #L938 - L941 were not covered by tests

Check warning on line 213 in src/input/getgeo.F90

See this annotation in the file changed.

@codecov codecov / codecov/patch

src/input/getgeo.F90#L213

Added line #L213 was not covered by tests

Check warning on line 217 in src/input/getgeo.F90

See this annotation in the file changed.

@codecov codecov / codecov/patch

src/input/getgeo.F90#L216-L217

Added lines #L216 - L217 were not covered by tests

Check warning on line 344 in src/input/readmo.F90

See this annotation in the file changed.

@codecov codecov / codecov/patch

src/input/readmo.F90#L341-L344

Added lines #L341 - L344 were not covered by tests

Check warning on line 347 in src/input/readmo.F90

See this annotation in the file changed.

@codecov codecov / codecov/patch

src/input/readmo.F90#L347

Added line #L347 was not covered by tests

Check warning on line 363 in src/input/readmo.F90

See this annotation in the file changed.

@codecov codecov / codecov/patch

src/input/readmo.F90#L363

Added line #L363 was not covered by tests