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iodata.test.test_gaussianinput module
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iodata.test.test_gaussianinput module
¶
Test iodata.formats.gaussianinput module.
check_water
(
mol
,
title
)
[source]
¶
Test water molecule attributes.
test_load_error
(
)
[source]
¶
test_load_multi_link
(
)
[source]
¶
test_load_multi_route
(
)
[source]
¶
test_load_multi_title
(
)
[source]
¶
test_load_water_com
(
)
[source]
¶
test_load_water_gjf
(
)
[source]
¶
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