From 876ab5d33f07ac15454d63e773b6884be451ae71 Mon Sep 17 00:00:00 2001 From: Matthew Rowles Date: Thu, 19 Jun 2025 23:01:43 +0800 Subject: [PATCH] examples PD_PREP --- cif_pow.dic | 21 ++++++++++++++++++--- 1 file changed, 18 insertions(+), 3 deletions(-) diff --git a/cif_pow.dic b/cif_pow.dic index 9458d2d..97032c5 100644 --- a/cif_pow.dic +++ b/cif_pow.dic @@ -10097,6 +10097,22 @@ save_PD_PREP _name.category_id PD_GROUP _name.object_id PD_PREP _category_key.name '_pd_prep.id' + _description_example.case +; + _pd_prep.char_id 'Acme anatase 1234' + _pd_prep.id 'rutile 1234' + _pd_prep.conditions + ; + 1 kg of anatase from Acme, Lot#1234 was placed in several + platinum crucible in a furnace at atmospheric pressure. + The furnace was heated at 5 K/min to 1100 K, and held there + overnight. The furnace was then switched off and allowed to + cool naturally. The batch was combined, homogenised, and + riffle-split into 50 g packets. + ; + _pd_prep.pressure 101.3 + _pd_prep.temperature 1100 +; save_ @@ -13025,10 +13041,9 @@ save_ clarify that identical values refer to the same data point in each disparate loop; they cannot be assigned values independently. - Added example PD_QPA_CALIB_FACTOR - Added examples to PD_CALC_OVERALL, PD_CALIB_INCIDENT_INTENSITY, PD_CHAR, - _pd_diffractogram.id, PD_PHASE_MASS, PD_PROC_LS, PD_SPEC. + _pd_diffractogram.id, PD_PHASE_MASS, PD_PREP, PD_PROC_LS, + PD_QPA_CALIB_FACTOR, PD_SPEC. PD_CALIB_WAVELENGTH removed. _diffrn_radiation_wavelength.phase_id and _diffrn_radiation_wavelength.diffractogram_id added to record