Core dictionary (coreCIF) version 2.3.1
Category DIFFRN_REFLN
Name:'_diffrn_refln_[]'
Definition:
Data items in the DIFFRN_REFLN category record details about the intensities measured in the diffraction experiment. The DIFFRN_REFLN data items refer to individual intensity measurements and must be included in looped lists. (The DIFFRN_REFLNS data items specify the parameters that apply to all intensity measurements. The DIFFRN_REFLNS data items are not looped.)Example:
Example 1 - extracted from the CAD-4 listing for Tl~2~Cd~2~(SO~4~)~3~ at
85 K (unpublished).
loop_
_diffrn_refln_index_h
_diffrn_refln_index_k
_diffrn_refln_index_l
_diffrn_refln_angle_chi
_diffrn_refln_scan_rate
_diffrn_refln_counts_bg_1
_diffrn_refln_counts_total
_diffrn_refln_counts_bg_2
_diffrn_refln_angle_theta
_diffrn_refln_angle_phi
_diffrn_refln_angle_omega
_diffrn_refln_angle_kappa
_diffrn_refln_scan_width
_diffrn_refln_elapsed_time
0 0 -16 0. 4.12 28 127 36 33.157 -75.846 16.404 50.170 1.516 19.43
0 0 -15 0. 4.12 38 143 28 30.847 -75.846 14.094 50.170 1.516 19.82
0 0 -14 0. 1.03 142 742 130 28.592 -75.846 11.839 50.170 1.516 21.32
0 0 -13 0. 4.12 26 120 37 26.384 -75.846 9.631 50.170 1.450 21.68
0 0 -12 0. 0.97 129 618 153 24.218 -75.846 7.464 50.170 1.450 23.20
0 0 -11 0. 4.12 33 107 38 22.087 -75.846 5.334 50.170 1.384 23.55
0 0 -10 0. 4.12 37 146 33 19.989 -75.846 3.235 50.170 1.384 23.90
0 0 -9 0. 4.12 50 179 49 17.918 -75.846 1.164 50.170 1.384 24.25
# - - - - data truncated for brevity - - - -
3 4 -4 0. 1.03 69 459 73 30.726 -53.744 46.543 -47.552 1.516 2082.58
3 4 -5 0. 1.03 91 465 75 31.407 -54.811 45.519 -42.705 1.516 2084.07
3 14 -6 0. 1.03 84 560 79 32.228 -55.841 44.745 -38.092 1.516 2085.57
# - - - - data truncated for brevity - - - -
|
Type: null
Category: category_overview
