Specification of the Crystallographic Information File (CIF)
Hall, S. R.,
Westbrook, J. D.,
Spadaccini, N.,
Brown, I. D.,
Bernstein, H. J. and
McMahon, B.,
International Tables for Crystallography
(2006).
Vol. G,
ch. 2.2,
pp. 20-36
[ doi:10.1107/97809553602060000728 ]
specification of the Crystallographic Information File. Version 1.1 specification
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S. R. Hall, a * N. Spadaccini, c
I.
D.
Brown,
d H. J. Bernstein, e J.
D. Westbrook b and B. McMahon f ...
Definition of terms
Hall, S. R.,
Spadaccini, N.,
Brown, I. D.,
Bernstein, H. J.,
Westbrook, J. D. and
McMahon, B.,
International Tables for Crystallography
(2006).
Vol. G,
Section 2.2.7.1.2,
pp. 25-25
[ doi:10.1107/97809553602060000728 ]
stated, containing either information on a crystallographic experiment or its results (or similar scientific
content), or descriptions of the data identifiers in such a file.
(2.2) A data file is understood to convey information relating ...
[
more
results from section 2.2.7 in volume G]
Intensity of diffracted intensities
Brown, P. J.,
Fox, A. G.,
Maslen, E. N.,
O'Keefe, M. A. and
Willis, B. T. M.,
International Tables for Crystallography
(2006).
Vol. C,
ch. 6.1,
pp. 554-595
[ doi:10.1107/97809553602060000600 ]
2.304 2.406 2.509
6.00 1.327 1.373 1.420 1.470 1.520 1.575 1.635 1.698 1.746 1.835
Element Sb Te
I Xe Cs Ba La Ce Pr Nd
Z ...