American Mineralogist Crystal Structure Database

2 matching records for this search.

SrMgP2O7
 
Tahiri A A, Bali B E, Lachkar M, Ouarsal R, Zavalij P Y
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=1600-5368&volume=58&spage=9
Acta Crystallographica E58 (2002) i9-i11
SrMgP2O7
_database_code_amcsd 0010374
5.3046 8.3053 12.700 90 90.502 90 P2_1/n
atom      x      y      z   Uiso U(1,1) U(2,2) U(3,3) U(1,2)  U(1,3) U(2,3)
Sr1  .21537 .33976 .72107 .01000  .0081  .0104  .0116 .00044 -.00060 -.0011
Mg1   .6784  .1493 .89100  .0096  .0097  .0093  .0098 -.0003  -.0019  .0002
P1    .7459 .03570 .66719  .0076  .0081  .0076  .0071  .0004   .0000 -.0002
P2    .6868 .29990 .51986  .0076  .0072  .0086  .0070 -.0001   .0008  .0003
O1    .7331  .1157  .5530  .0107  .0151  .0086  .0085  .0024   .0021 -.0006
O2    .6831 -.1393  .6533  .0105  .0128  .0072  .0115  .0012   .0003  .0000
O3    .0063  .0652  .7126  .0152  .0099  .0160  .0196 -.0012  -.0059  .0007
O4    .5471  .1158  .7348  .0103  .0111  .0116  .0081  .0003   .0016 -.0022
O5    .8049  .3115  .4118  .0111  .0091  .0172  .0070 -.0005   .0036  .0002
O7    .4046  .3309  .5233  .0111  .0082  .0127  .0123  .0016  -.0006  .0013
O6    .8275  .4043  .6000  .0105  .0125  .0093  .0096 -.0010  -.0024 -.0006
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View JMOL 3-D Structure (permalink)
 
Co2P2O7
 
Bali B E, Bolte M
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=1600-5368&volume=58&spage=32
Acta Crystallographica E58 (2002) i32-i33
Rerefinement of cobalt diphosphate against new intensity data
_database_code_amcsd 0010375
7.0022 8.3634 9.0114 90 113.600 90 P2_1/c
atom      x      y      z   Uiso U(1,1) U(2,2) U(3,3)  U(1,2) U(1,3)  U(2,3)
Co1  .23247 .92882 .10884 .00799 .00769 .00809 .00812  .00033 .00307  .00007
Co2  .69933 .44157 .82475 .00860 .00846 .00823 .00975 -.00018 .00431  .00030
P1   .94042 .76797 .75824 .00746 .00673 .00807 .00767 -.00038 .00298 -.00058
P2   .53170 .77429 .46771 .00713 .00668 .00790 .00660 -.00011 .00244 -.00014
O1   .74908 .82989 .60005  .0110  .0080  .0128  .0092   .0003  .0004  -.0007
O2   .37848 .76488 .54938  .0096  .0098  .0102  .0102  -.0013  .0054  -.0008
O3   .11902 .75915 .70267  .0093  .0083  .0101  .0102  -.0003  .0044  -.0001
O4   .97662 .90145 .88165  .0095  .0097  .0103  .0083   .0010  .0034  -.0016
O5   .88706 .61064 .81112  .0126  .0137  .0099  .0166  -.0018  .0085  -.0004
O6   .48086 .90934 .34431  .0092  .0096  .0091  .0083  -.0007  .0031   .0013
O7   .55344 .61280 .39749  .0097  .0100  .0090  .0095   .0008  .0032  -.0012
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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