XmlmmCIF equivalent: diffrn_reflns
Data items in the DIFFRN_REFLNS category record details about
the set of 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 in a diffraction data set.
XmlmmCIF equivalent: diffrn_reflns/av_R_equivalents
The residual [sum|avdel(I)| / sum|av(I)|] for symmetry-equivalent
reflections used to calculate the average intensity av(I). The
avdel(I) term is the average difference between av(I) and the
individual symmetry-equivalent intensities.
XmlmmCIF equivalent: diffrn_reflns/av_sigmaI_over_netI
Measure [sum|sigma(I)|/sum|net(I)|] for all measured reflections.
XmlmmCIF equivalent: diffrn_reflns/limit_h_max
The maximum value of the diffraction reflection data specified
by _diffrn_refln.index_h.
XmlmmCIF equivalent: diffrn_reflns/limit_h_min
The minimum value of the diffraction reflection data specified
by _diffrn_refln.index_h.
XmlmmCIF equivalent: diffrn_reflns/limit_k_max
The maximum value of the diffraction reflection data specified
by _diffrn_refln.index_k.
XmlmmCIF equivalent: diffrn_reflns/limit_k_min
The minimum value of the diffraction reflection data specified
by _diffrn_refln.index_k.
XmlmmCIF equivalent: diffrn_reflns/limit_l_max
The maximum value of the diffraction reflection data specified
by _diffrn_refln.index_l.
XmlmmCIF equivalent: diffrn_reflns/limit_l_min
The minimum value of the diffraction reflection data specified
by _diffrn_refln.index_l.
XmlmmCIF equivalent: diffrn_reflns/number
The total number of measured intensities, excluding reflections
that are classified as systematically absent.
XmlmmCIF equivalent: diffrn_reflns/reduction_process
A description of the process used to reduce the intensity data
into structure-factor magnitudes.
XmlmmCIF equivalent: diffrn_reflns/theta_max
Maximum theta angle in degrees for the measured diffraction
intensities.
XmlmmCIF equivalent: diffrn_reflns/theta_min
Minimum theta angle in degrees for the measured diffraction
intensities.
XmlmmCIF equivalent: diffrn_reflns/transf_matrix11
The [1][1] element of the 3x3 matrix used to transform Miller
indices in the DIFFRN_REFLN category into the Miller indices in
the REFLN category.
XmlmmCIF equivalent: diffrn_reflns/transf_matrix12
The [1][2] element of the 3x3 matrix used to transform Miller
indices in the DIFFRN_REFLN category into the Miller indices in
the REFLN category.
XmlmmCIF equivalent: diffrn_reflns/transf_matrix13
The [1][3] element of the 3x3 matrix used to transform Miller
indices in the DIFFRN_REFLN category into the Miller indices in
the REFLN category.
XmlmmCIF equivalent: diffrn_reflns/transf_matrix21
The [2][1] element of the 3x3 matrix used to transform Miller
indices in the DIFFRN_REFLN category into the Miller indices in
the REFLN category.
XmlmmCIF equivalent: diffrn_reflns/transf_matrix22
The [2][2] element of the 3x3 matrix used to transform Miller
indices in the DIFFRN_REFLN category into the Miller indices in
the REFLN category.
XmlmmCIF equivalent: diffrn_reflns/transf_matrix23
The [2][3] element of the 3x3 matrix used to transform Miller
indices in the DIFFRN_REFLN category into the Miller indices in
the REFLN category.
XmlmmCIF equivalent: diffrn_reflns/transf_matrix31
The [3][1] element of the 3x3 matrix used to transform Miller
indices in the DIFFRN_REFLN category into the Miller indices in
the REFLN category.
XmlmmCIF equivalent: diffrn_reflns/transf_matrix32
The [3][2] element of the 3x3 matrix used to transform Miller
indices in the DIFFRN_REFLN category into the Miller indices in
the REFLN category.
XmlmmCIF equivalent: diffrn_reflns/transf_matrix33
The [3][3] element of the 3x3 matrix used to transform Miller
indices in the DIFFRN_REFLN category into the Miller indices in
the REFLN category.
XmlmmCIF equivalent: diffrn_reflns/diffrn_id
This data item is a pointer to _diffrn.id in the DIFFRN
category.