stfc / alc-dls-exafs
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Repo Added 17 Sep 2025 09:08PM UTC

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Committed 10 Nov 2025 08:40PM UTC coverage: 70.796% (+0.04%) from 70.755%

Build # 19245476578

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Commit Message

Use imaginary part of χ(k) (second column of chi.dat) for ensemble av… (#43)

* Use imaginary part of χ(k) (second column of chi.dat) for ensemble averaging

* Update tests for new chi handling

* Wrap long line in test_feff_utils.py

* Trigger CI rerun

* Apply pre-commit fixes

---------

Co-authored-by: AndyDuff123 <andrew.duff@stfc.ac.uk>

Run Details

1503 of 2123 relevant lines covered (70.8%)

2.83 hits per line

Relevant lines Covered

2123 RELEVANT LINES 1503 COVERED LINES

2.83 HITS PER LINE

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Builds	Branch	Commit	Type	Ran	Committer	Via	Coverage
19245476578	main	Use imaginary part of χ(k) (second column of chi.dat) for ensemble av… (#43) * Use imaginary part of χ(k) (second column of chi.dat) for ensemble averaging * Update tests for new chi handling * Wrap long line in test_feff_utils.py * Trigger CI...	push	10 Nov 2025 08:41PM UTC	web-flow	github	70.8
19244043953	main	Merge a02b34f3c into 9c2e2b55e	Pull #43	10 Nov 2025 07:44PM UTC	web-flow	github	70.8
19243892171	main	Merge afa4aa709 into 9c2e2b55e	Pull #43	10 Nov 2025 07:38PM UTC	web-flow	github	70.8
19243787362	main	Merge 068291f60 into 9c2e2b55e	Pull #43	10 Nov 2025 07:34PM UTC	web-flow	github	70.8
19243514990	main	Merge cb36fdd3e into 9c2e2b55e	Pull #43	10 Nov 2025 07:24PM UTC	web-flow	github	70.8
18728085905	main	Reuse potentials (#42) * Add trajectory average structure function + tests * add criteria feff card supprt * Add option to re-use potentials from an initial structure. Also clean up actual feff calculation calls. --------- Co-authored-by: Kan...	push	22 Oct 2025 07:51PM UTC	web-flow	github	70.75
18652483451	main	Merge pull request #41 from stfc/validation_fix correct SCF ca validation	push	20 Oct 2025 12:48PM UTC	web-flow	github	71.74
18404954890	main	Merge pull request #39 from stfc/notebook-advanced-tab Notebook advanced tab and directories bugfix	push	10 Oct 2025 11:20AM UTC	web-flow	github	71.45
18373556501	main	Merge pull request #38 from AndyDuff1/clarify-plot-include-help Clarify plot-include help text for frames and sites	push	09 Oct 2025 10:36AM UTC	web-flow	github	72.48
18343630043	main	Move marimo_utils into larch_cli_wrapper (#37) Co-authored-by: Kane Shenton <jkshenton@gmail.com>	push	08 Oct 2025 11:49AM UTC	web-flow	github	72.48

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