#------------------------------------------------------------------------------
#$Date: 2008-03-10 09:25:41 +0100 (Mon, 10 Mar 2008) $
#$Revision: 255 $
#$URL: svn://www.crystallography.net/cod/cif/9/9010010.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_9010010
loop_
_publ_author_name
'Sitepu H'
'Schmahl W W'
'Stalick J K'
_publ_section_title
;
 Correction of intensities for preferred orientation in neutron-diffraction
 data of NiTi shape-memory alloy using the generalized spherical-harmonic description
;
_journal_name_full               'Applied Physics'
_journal_page_first              S1719
_journal_page_last               S1721
_journal_volume                  A74
_journal_year                    2002
_chemical_formula_sum            'Ti Ni'
_chemical_name_mineral           NiTi
_symmetry_space_group_name_H-M   'P 1 1 21/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                97.938
_cell_length_a                   2.8837
_cell_length_b                   4.6674
_cell_length_c                   4.1062
_cell_volume                     54.737
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,1/2+z
x,y,1/2-z
-x,-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
Ti 0.58870 0.28160 0.25000 0.00268
Ni 0.03870 0.17480 0.75000 0.00064