American Mineralogist Crystal Structure Database

2 matching records for this search.

HgBa2CaCu2O6+delta
 
Finger L W, Hazen R M, Downs R T, Meng R L, Chu C W
 
Physica C 226 (1994) 216-221
Crystal chemistry of HgBa2CaCu2O8+d and HgBa2Ca2Cu3O8+d
Single-crystal X-ray diffraction results
Sample: Hg-1212 superconductor
_database_code_amcsd 0015065
3.8564 3.8564 12.682 90 90 90 P4/mmm
atom  x   y     z occ Biso
Hg    0   0     0 .87 1.15
Cu    0   0     0 .13 1.15
Ba   .5  .5 .2205      .65
Ca   .5  .5    .5      .49
Cu    0   0 .3765      .46
O1    0  .5 .3758       .4
O2    0   0 .1553      1.0
O3   .5 .40     0 .10   .8
O4   .5   0     0 .12   .8
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
HgBa2Ca2Cu3O8+delta
 
Finger L W, Hazen R M, Downs R T, Meng R L, Chu C W
 
Physica C 226 (1994) 216-221
Crystal chemistry of HgBa2CaCu2O8+d and HgBa2Ca2Cu3O8+d
Single-crystal X-ray diffraction results
Sample: Hg-1223 superconductor
_database_code_amcsd 0015066
3.842 3.842 15.832 90 90 90 P4/mmm
atom  x   y      z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Hg    0   0      0 .82 1.69 .02588 .02588 .00202      0      0      0
Cu    0   0      0 .18 1.69 .02588 .02588 .00202      0      0      0
Ba   .5  .5 .17491      .48 .00772 .00772 .00052      0      0      0
Ca   .5  .5 .39758      .27 .00397 .00397 .00033      0      0      0
Cu1   0   0     .5      .20 .00115 .00115 .00046      0      0      0
Cu2   0   0 .30068      .19 .00053 .00053 .00051      0      0      0
O1    0  .5     .5     1.32 .01690 .01690 .00196      0      0      0
O2   .5   0  .3060      .46 .00756 .00756 .00050      0      0      0
O3    0   0  .1228     1.72 .02138 .02138 .00263      0      0      0
O4   .5 .36      0 .00   .8
O5   .5  .5      0 .13   .8
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
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Total number of retrieved datasets: 2
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