From 22debb1be6aa575100f2b8796895df095b80cb5c Mon Sep 17 00:00:00 2001 From: Filip Leonarski Date: Mon, 26 Oct 2026 11:35:15 +0100 Subject: [PATCH] docs: the stills rocking-curve datasets in the _process.h5 master Co-Authored-By: Claude Opus 5.5 Claude-Session: https://claude.ai/code/session_015CeEGgpKdfkCTJb3YNMJcu (cherry picked from commit 1195b9be6e0ca66774774f6de4867180b7bd0a47) --- docs/HDF5.md | 3 +++ 1 file changed, 3 insertions(+) diff --git a/docs/HDF5.md b/docs/HDF5.md index fa82e587b..a84f5a709 100644 --- a/docs/HDF5.md +++ b/docs/HDF5.md @@ -394,6 +394,9 @@ variants. | `iceRingScoreMean` | ratio | mean `iceRingScore` over the run — the single "how icy was this dataset" number (1 = no ice) | | `indexedLatticeCount` | | per-image lattice count summary (master). *Note: data files use `indexingLatticeCount`; readers accept either.* | | `reindexMatrix` | | change of basis from the setting the per-image data are in to the setting of `/entry/sample/unit_cell` (`[9]`, `int32`, flattened 3×3, row major) — see below | +| `stillsRockingWidthFormula` | 1/Å, rad, relative | stills: the run's rocking width σ² = γ₀² + (γₑ d\*)² + (σ_bw λ d\*²/2)², as `[γ₀, γₑ, σ_bw]`; offline (Rugnux) only | +| `stillsRadialScale` | | stills: the scale of the reciprocal lattice the rocking curve is centred on | +| `stillsRockingWidthTableDstar`, `stillsRockingWidthTable` | 1/Å | stills: the rocking width σ measured against d\*, which the partialities use (held beyond the first and last entry; the formula above is what the prediction window uses); `--mode scale` merges with formula and table instead of measuring another | **Reindex matrix.** The per-image `h`, `k`, `l` and `latticeIndexed` are written as each image is processed, in the setting that image was *indexed* in. The space group is only settled afterwards, by