American Mineralogist Crystal Structure Database

2 matching records for this search.

Ba9N12Nb2
 
Clarke S J, DiSalvo F J
 
Zeitschrift fur Kristallographie 212 (1997) 309-310
Crystal structure of nonabarium bis(tetranitridoniobate)nitride azide, Ba9[NbN4]2N[N3]
_database_code_amcsd 0011071
7.9979 9.6273 12.6441 75.867 85.690 87.868 P-1
atom      x      y      z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ba1  .49877 .31963 .42215  .0154  .0126  .0087  .0029 -.0023  .0020
Ba2  .47032 .62082 .12846  .0141  .0114  .0089  .0016 -.0017  .0017
Ba3  .03505 .23792 .38091  .0160  .0130  .0095 -.0013 -.0019  .0019
Ba4  .25404 .01183 .00081  .0244  .0129  .0087 -.0011 -.0029  .0028
Ba5  .17130 .58103 .38265  .0130  .0138  .0173  .0017 -.0030  .0039
Ba6  .46039 .93085 .27294  .0151  .0116  .0097  .0020 -.0014  .0028
Ba7  .01646 .07014 .72210  .0155  .0109  .0124  .0012 -.0038  .0011
Ba8  .00770 .38349 .89294  .0142  .0143  .0100  .0013 -.0016 -.0007
Ba9  .26964 .70884 .83999  .0170  .0105  .0089  .0013 -.0030  .0024
Nb1   .2689 .29598 .12013  .0109  .0087  .0048  .0009 -.0021  .0031
Nb2   .2703 .36480 .66384  .0122  .0084  .0051  .0019 -.0020  .0041
N1    .1930  .5478  .6991
N2    .2951  .3632  .2527
N3    .0587  .1914  .1248
N4    .2161  .7989  .1795
N5    .1447  .3267  .5452
N6    .2435  .2046  .7944
N7    .4925  .6326  .3771
N8    .2611  .4675  .0016
N9    .4567  .1682  .0829
N10   .2107  .9435  .4439
N11   .3002  .9274  .6286
N12   .2596  .9439  .5324
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Ni5.72 Sb Se2
 
Reynolds T K, Bales J G, DiSalvo F J
 
Chemistry of Materials 14 (2002) 4746-4751
Synthesis and Properties of a New Metal-Rich Nickel Antimonide
Telluride or Selenide: Ni7-SbX2 (X = Se or Te)
_cod_database_code 1200020
_database_code_amcsd 0018292
3.7021 3.7021 18.593 90.00 90.00 90.00 I4/mmm
atom x  y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Se1  0  0 .18100      .0159  .0108  .0108  .0261   .000   .000   .000
Sb1  0  0     .5      .0150  .0085  .0085  .0280   .000   .000   .000
Ni1  0  0      0      .0158  .0109  .0109   .026   .000   .000   .000
Ni2  0 .5 .10009      .0163  .0125  .0097  .0266   .000   .000   .000
Ni3  0  0  .3020 .359  .022   .021   .021   .024   .000   .000   .000
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Download in:

Multiple datasets can be concatenated into a single downloadable file by selecting the datasets and then clicking

Multiple datasets can be downloaded as individual files inside a ZIP archive by selecting the datasets and then clicking

Total number of retrieved datasets: 2
View in amc, download in amc

Return to AMCSD Home Page