BraggPrediction: Work in progress

This commit is contained in:
2025-12-18 11:41:00 +01:00
parent c9b2584d9f
commit 8437f96644
5 changed files with 136 additions and 135 deletions

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@@ -141,9 +141,9 @@ void IndexAndRefine::QuickPredictAndIntegrate(DataMessage &msg,
BraggPredictionSettings settings_prediction{
.high_res_A = experiment.GetBraggIntegrationSettings().GetDMinLimit_A(),
.ewald_dist_cutoff = ewald_dist_cutoff,
.max_hkl = 100,
.centering = outcome.symmetry.centering
.centering = outcome.symmetry.centering,
.ewald_dist_cutoff = ewald_dist_cutoff,
};
auto nrefl = prediction.Calc(experiment, *outcome.lattice_candidate, settings_prediction);