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26 changes: 13 additions & 13 deletions cif_pd.dic
Original file line number Diff line number Diff line change
Expand Up @@ -2177,7 +2177,7 @@ save_PD_CALC_OVERALL
1 4.03625 1053.9 1074.628 [ 21.34 204.535 513.156 ]
2 4.07375 1060.2 1072.667 [ 21.45 205.755 516.456 ]
3 4.11125 1017.3 1070.768 [ 21.55 206.975 513.256 ]
#...
# ...
;
_description_example.detail
;
Expand Down Expand Up @@ -2750,7 +2750,7 @@ save_PD_CALIB_DETECTED_INTENSITY
2 B 10.01 1364.36(57) 1318.22(94)
3 A 10.02 1324.35(87) 1324.35(87)
4 B 10.03 1298.36(74) 1254.45(102)
#...
# ...
;
;
The detector responses of 1 and 1.035 for detectors A and B given
Expand Down Expand Up @@ -3631,7 +3631,7 @@ save_PD_CALIB_XCOORD
2 A 1114.742200 1.495170
3 A 1119.201170 1.501138
4 A 1123.677980 1.507131
...
# ...

loop_
_pd_data.point_id
Expand All @@ -3644,7 +3644,7 @@ save_PD_CALIB_XCOORD
ii A 1114.742200 1.495170 0.635318 0.571286
iii A 1119.201170 1.501138 0.646909 0.593895
iv A 1123.677980 1.507131 0.655807 0.620014
...
# ...
;
;
A diffractogram identified as "TOF_STD" was collected on the
Expand All @@ -3670,7 +3670,7 @@ save_PD_CALIB_XCOORD
2 A 1141.764990 0.728226
3 A 1146.332050 0.734770
4 A 1150.917370 0.767760
...
# ...
;
;
A diffractogram identified as "SAMPLE_1" was collected on the
Expand Down Expand Up @@ -4454,7 +4454,7 @@ save_PD_CALIBRATION
a 1 20051.5 4.1 1234
b 2 20139.1 4.2 1434
c 3 20226.7 4.3 1457
#...
# ...
;
_description_example.detail
;
Expand Down Expand Up @@ -6973,7 +6973,7 @@ save_PD_DIFFRACTOGRAM
5.04 38.007 0.0505 26.200290 26.200290
5.07 38.318 0.0465 26.404083 26.404083
5.10 41.877 0.0452 26.606346 26.606346
#...
# ...
;
;
A set of diffraction conditions, instrument settings, and specimen
Expand Down Expand Up @@ -7030,7 +7030,7 @@ save_PD_DIFFRACTOGRAM
5.04 38.007 0.0505 26.200290 26.200290
5.07 38.318 0.0465 26.404083 26.404083
5.10 41.877 0.0452 26.606346 26.606346
#...
# ...
;
;
A functionally identical data set as to the first example.
Expand Down Expand Up @@ -9238,7 +9238,7 @@ save_PD_MEAS_OVERALL
_pd_meas.counts_total
1 1234
2 1256
#...
# ...
;
;
The measured diffractogram is in equally spaced 2θ points, starting
Expand Down Expand Up @@ -9266,7 +9266,7 @@ save_PD_MEAS_OVERALL
_pd_meas.counts_total
1 5.02 1234
2 5.04 1256
#...
# ...
;
;
The information here applies to the diffractogram with the id
Expand All @@ -9289,7 +9289,7 @@ save_PD_MEAS_OVERALL
_pd_meas.intensity_total_su
1 50300 1234 23
2 50400 1256 24
#...
# ...
;
;
The information here applies to the diffractogram with the id
Expand Down Expand Up @@ -10631,7 +10631,7 @@ save_PD_PHASE_MASS
;
;
data_all_results
_audit_schema Custom
_audit.schema Custom
_pd_diffractogram.id ANOTHER_DIFFRACTOGRAM

_pd_qpa_internal_std.mass_percent 25.000
Expand Down Expand Up @@ -12548,7 +12548,7 @@ save_PD_PROC_OVERALL
_pd_proc.intensity_total_su
1 1234 23
2 1256 24
#...
# ...
;
;
The processed diffractogram is in equally-spaced 2θ points, starting
Expand Down