Ba2 Cu3 O6.91 Y Francois M, Junod A, Yvon K, Hewat A, Capponi J, Strobel P, Marezio M, Fischer P Solid State Communications 66 (1988) 1117-1125 A study of the Cu-O chains in the high Tc superconductor Y Ba2 Cu3 O7 by high resolution neutron powder diffraction _cod_database_code 1008399 _database_code_amcsd 0016308 3.8093 3.8787 11.6376 90 90 90 Pmmm atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) Ba1 .5 .5 .1841 .25 .25 .25 0 0 0 Y1 .5 .5 .5 .22 .22 .22 0 0 0 Cu1 0 0 0 .28 .28 .28 0 0 0 Cu2 0 0 .3548 .23 .23 .23 0 0 0 O1 0 0 .1595 .44 .44 .44 0 0 0 O2 .5 0 .3781 .35 .35 .35 0 0 0 O3 0 .5 .3774 .35 .35 .35 0 0 0 O4 0 .5 0 .91 .91 .18 .29 0 0 0