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Merge pull request #440 from rowlesmr/harmonise-SU-descriptions
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Harmonise SU descriptions.
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vaitkus committed Apr 11, 2024
2 parents 0f998c0 + 2a38a9d commit 350bad4
Showing 1 changed file with 40 additions and 72 deletions.
112 changes: 40 additions & 72 deletions cif_core.dic
Original file line number Diff line number Diff line change
Expand Up @@ -125,8 +125,7 @@ save_diffrn.ambient_pressure_su
_definition.update 2023-07-01
_description.text
;
Standard uncertainty of the mean hydrostatic pressure
at which intensities were measured.
Standard uncertainty of _diffrn.ambient_pressure.
;
_name.category_id diffrn
_name.object_id ambient_pressure_su
Expand Down Expand Up @@ -224,8 +223,7 @@ save_diffrn.ambient_temperature_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the mean temperature
at which intensities were measured.
Standard uncertainty of _diffrn.ambient_temperature.
;
_name.category_id diffrn
_name.object_id ambient_temperature_su
Expand Down Expand Up @@ -990,8 +988,7 @@ save_cell.reciprocal_angle_alpha_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the reciprocal of the angle
between _cell.length_b and _cell.length_c.
Standard uncertainty of _cell.reciprocal_angle_alpha.
;
_name.category_id cell
_name.object_id reciprocal_angle_alpha_su
Expand Down Expand Up @@ -1047,8 +1044,7 @@ save_cell.reciprocal_angle_beta_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the reciprocal of the angle
between _cell.length_a and _cell.length_c.
Standard uncertainty of _cell.reciprocal_angle_beta.
;
_name.category_id cell
_name.object_id reciprocal_angle_beta_su
Expand Down Expand Up @@ -1104,8 +1100,7 @@ save_cell.reciprocal_angle_gamma_su
_definition.update 2023-07-01
_description.text
;
Standard uncertainty of the reciprocal of the angle
between _cell.length_a and _cell.length_b.
Standard uncertainty of _cell.reciprocal_angle_gamma.
;
_name.category_id cell
_name.object_id reciprocal_angle_gamma_su
Expand Down Expand Up @@ -1155,7 +1150,7 @@ save_cell.reciprocal_length_a_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the reciprocal of the _cell.length_a.
Standard uncertainty of _cell.reciprocal_length_a.
;
_name.category_id cell
_name.object_id reciprocal_length_a_su
Expand Down Expand Up @@ -1205,7 +1200,7 @@ save_cell.reciprocal_length_b_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the reciprocal of the _cell.length_b.
Standard uncertainty of _cell.reciprocal_length_b.
;
_name.category_id cell
_name.object_id reciprocal_length_b_su
Expand Down Expand Up @@ -1255,7 +1250,7 @@ save_cell.reciprocal_length_c_su
_definition.update 2023-07-01
_description.text
;
Standard uncertainty of the reciprocal of the _cell.length_c.
Standard uncertainty of _cell.reciprocal_length_c.
;
_name.category_id cell
_name.object_id reciprocal_length_c_su
Expand Down Expand Up @@ -1707,7 +1702,7 @@ save_cell.volume_su
_definition.update 2014-06-08
_description.text
;
Standard uncertainty of the volume of the crystal unit cell.
Standard uncertainty of _cell.volume.
;
_name.category_id cell
_name.object_id volume_su
Expand Down Expand Up @@ -1823,8 +1818,7 @@ save_cell_measurement.pressure_su
;
** DEPRECATED **

Standard uncertainty of the pressure at which
the unit-cell parameters were measured.
Standard uncertainty of _cell_measurement.pressure.
;
_name.category_id cell_measurement
_name.object_id pressure_su
Expand Down Expand Up @@ -1936,8 +1930,7 @@ save_cell_measurement.temperature_su
;
** DEPRECATED **

Standard uncertainty of the temperature of at which
the unit-cell parameters were measured.
Standard uncertainty of _cell_measurement.temperature.
;
_name.category_id cell_measurement
_name.object_id temperature_su
Expand Down Expand Up @@ -3470,8 +3463,7 @@ save_diffrn_radiation_wavelength.value_su
_definition.update 2021-08-03
_description.text
;
Standard uncertainty of the wavelength of radiation used in diffraction
measurements.
Standard uncertainty of _diffrn_radiation_wavelength.value.
;
_name.category_id diffrn_radiation_wavelength
_name.object_id value_su
Expand Down Expand Up @@ -6310,7 +6302,7 @@ save_refln.f_meas_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the measured structure factor amplitude.
Standard uncertainty of _refln.F_meas.
;
_name.category_id refln
_name.object_id F_meas_su
Expand Down Expand Up @@ -6424,7 +6416,7 @@ save_refln.f_squared_meas_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the measured structure factor squared.
Standard uncertainty of _refln.F_squared_meas.
;
_name.category_id refln
_name.object_id F_squared_meas_su
Expand Down Expand Up @@ -6704,7 +6696,7 @@ save_refln.intensity_meas_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the measured intensity.
Standard uncertainty of _refln.intensity_meas.
;
_name.category_id refln
_name.object_id intensity_meas_su
Expand Down Expand Up @@ -9160,8 +9152,7 @@ save_chemical.temperature_decomposition_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the temperature at which
a crystalline solid decomposes.
Standard uncertainty of _chemical.temperature_decomposition.
;
_name.category_id chemical
_name.object_id temperature_decomposition_su
Expand Down Expand Up @@ -9248,8 +9239,7 @@ save_chemical.temperature_sublimation_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the temperature at which
a crystalline solid sublimates.
Standard uncertainty of _chemical.temperature_sublimation.
;
_name.category_id chemical
_name.object_id temperature_sublimation_su
Expand Down Expand Up @@ -10266,8 +10256,7 @@ save_exptl_crystal.density_meas_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the crystal density measured
using standard chemical and physical methods.
Standard uncertainty of _exptl_crystal.density_meas.
;
_name.category_id exptl_crystal
_name.object_id density_meas_su
Expand Down Expand Up @@ -10360,8 +10349,7 @@ save_exptl_crystal.density_meas_temp_su
_definition.update 2012-11-22
_description.text
;
Standard uncertainty of the temperature at
which _exptl_crystal.density_meas was determined.
Standard uncertainty of _exptl_crystal.density_meas_temp.
;
_name.category_id exptl_crystal
_name.object_id density_meas_temp_su
Expand Down Expand Up @@ -12704,8 +12692,7 @@ save_geom_angle.value_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the angle defined by
the sites identified by _geom_angle.id.
Standard uncertainty of _geom_angle.value.
;
_name.category_id geom_angle
_name.object_id value_su
Expand Down Expand Up @@ -12852,8 +12839,7 @@ save_geom_bond.distance_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the intramolecular bond distance
between the sites identified by _geom_bond.id.
Standard uncertainty of _geom_bond.distance.
;
_name.category_id geom_bond
_name.object_id distance_su
Expand Down Expand Up @@ -13142,8 +13128,7 @@ save_geom_contact.distance_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the intermolecular distance between
the atomic sites identified by _geom_contact.id.
Standard uncertainty of _geom_contact.distance.
;
_name.category_id geom_contact
_name.object_id distance_su
Expand Down Expand Up @@ -13305,8 +13290,7 @@ save_geom_hbond.angle_dha_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the angle subtended by the sites identified
by _geom_hbond.id. The hydrogen at site H is at the apex of the angle.
Standard uncertainty of _geom_hbond.angle_DHA.
;
_name.category_id geom_hbond
_name.object_id angle_DHA_su
Expand Down Expand Up @@ -13417,8 +13401,7 @@ save_geom_hbond.distance_da_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the set of data items which specify
the distance between the three atom sites identified by _geom_hbond.id.
Standard uncertainty of _geom_hbond.distance_DA.
;
_name.category_id geom_hbond
_name.object_id distance_DA_su
Expand Down Expand Up @@ -13481,8 +13464,7 @@ save_geom_hbond.distance_dh_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the set of data items which specify
the distance between the three atom sites identified by _geom_hbond.id.
Standard uncertainty of _geom_hbond.distance_DH.
;
_name.category_id geom_hbond
_name.object_id distance_DH_su
Expand Down Expand Up @@ -13545,8 +13527,7 @@ save_geom_hbond.distance_ha_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the set of data items which specify
the distance between the three atom sites identified by _geom_hbond.id.
Standard uncertainty of _geom_hbond.distance_HA.
;
_name.category_id geom_hbond
_name.object_id distance_HA_su
Expand Down Expand Up @@ -13769,7 +13750,7 @@ save_geom_torsion.angle_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the torsion angle.
Standard uncertainty of _geom_torsion.angle.
;
_name.category_id geom_torsion
_name.object_id angle_su
Expand Down Expand Up @@ -20784,9 +20765,7 @@ save_atom_site.b_equiv_geom_mean_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the equivalent isotropic atomic displacement
parameter, B(equiv), in angstroms squared, calculated as the geometric
mean of the anisotropic atomic displacement parameters.
Standard uncertainty of _atom_site.B_equiv_geom_mean.
;
_name.category_id atom_site
_name.object_id B_equiv_geom_mean_su
Expand Down Expand Up @@ -20844,10 +20823,7 @@ save_atom_site.b_iso_or_equiv_su
_definition.update 2023-01-16
_description.text
;
Standard uncertainty of the isotropic atomic displacement parameter,
or equivalent isotropic atomic displacement parameter, B(equiv),
in angstroms squared, calculated from anisotropic atomic displacement
parameters.
Standard uncertainty of _atom_site.B_iso_or_equiv.
;
_name.category_id atom_site
_name.object_id B_iso_or_equiv_su
Expand Down Expand Up @@ -21502,8 +21478,7 @@ save_atom_site.occupancy_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the fraction of the atom type
present at this site.
Standard uncertainty of _atom_site.occupancy.
;
_name.category_id atom_site
_name.object_id occupancy_su
Expand Down Expand Up @@ -21821,7 +21796,7 @@ save_atom_site.u_equiv_geom_mean_su
_definition.update 2012-11-20
_description.text
;
Standard uncertainty values (esds) of the U(equiv).
Standard uncertainty of _atom_site.U_equiv_geom_mean.
;
_name.category_id atom_site
_name.object_id U_equiv_geom_mean_su
Expand Down Expand Up @@ -21874,7 +21849,7 @@ save_atom_site.u_iso_or_equiv_su
_definition.update 2012-11-20
_description.text
;
Standard uncertainty values (esds) of the U(iso) or U(equiv).
Standard uncertainty of _atom_site.U_iso_or_equiv.
;
_name.category_id atom_site
_name.object_id U_iso_or_equiv_su
Expand Down Expand Up @@ -25642,8 +25617,7 @@ save_refine_diff.density_max_su
_definition.update 2023-01-12
_description.text
;
Standard uncertainty of the maximum density value
in a difference Fourier map.
Standard uncertainty of _refine_diff.density_max.
;
_name.category_id refine_diff
_name.object_id density_max_su
Expand Down Expand Up @@ -25709,8 +25683,7 @@ save_refine_diff.density_min_su
_definition.update 2023-01-12
_description.text
;
Standard uncertainty of the minimum density value
in a difference Fourier map.
Standard uncertainty of _refine_diff.density_min.
;
_name.category_id refine_diff
_name.object_id density_min_su
Expand Down Expand Up @@ -25781,8 +25754,7 @@ save_refine_diff.density_rms_su
_definition.update 2023-01-12
_description.text
;
Standard uncertainty of the root mean square density value
in a difference Fourier map.
Standard uncertainty of _refine_diff.density_RMS.
;
_name.category_id refine_diff
_name.object_id density_RMS_su
Expand Down Expand Up @@ -25887,8 +25859,7 @@ save_refine_ls.abs_structure_flack_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the measure of absolute structure
as defined by Flack (1983).
Standard uncertainty of _refine_ls.abs_structure_Flack.
;
_name.category_id refine_ls
_name.object_id abs_structure_Flack_su
Expand Down Expand Up @@ -25943,8 +25914,7 @@ save_refine_ls.abs_structure_rogers_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the measure of absolute structure
as defined by Rogers (1981).
Standard uncertainty of _refine_ls.abs_structure_Rogers.
;
_name.category_id refine_ls
_name.object_id abs_structure_Rogers_su
Expand Down Expand Up @@ -26060,7 +26030,7 @@ save_refine_ls.extinction_coef_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the extinction coefficient.
Standard uncertainty of _refine_ls.extinction_coef.
;
_name.category_id refine_ls
_name.object_id extinction_coef_su
Expand Down Expand Up @@ -26308,8 +26278,7 @@ save_refine_ls.goodness_of_fit_all_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the least-squares goodness-of-fit
parameter S for all reflections after the final cycle of refinement.
Standard uncertainty of _refine_ls.goodness_of_fit_all.
;
_name.category_id refine_ls
_name.object_id goodness_of_fit_all_su
Expand Down Expand Up @@ -26382,8 +26351,7 @@ save_refine_ls.goodness_of_fit_gt_su
_definition.update 2021-03-03
_description.text
;
Standard uncertainty of the least-squares goodness-of-fit
parameter S for gt reflections after the final cycle of refinement.
Standard uncertainty of _refine_ls.goodness_of_fit_gt.
;
_name.category_id refine_ls
_name.object_id goodness_of_fit_gt_su
Expand Down

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