American Mineralogist Crystal Structure Database

1 matching records for this search.

Hydroxyl-herderite
Download hom/hydroxylherderite.pdf
Lager G A, Gibbs G V
American Mineralogist 59 (1974) 919-925
A refinement of the crystal structure of herderite, CaBePO4OH
_database_code_amcsd 0000412
9.789 7.661 4.804 90 90.02 90 P2_1/a
atom     x     y     z B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Ca   .3309 .1116 .9974 0.0010 0.0019 0.0054 -.0000  .0004 -.0007
P    .0815 .2710 .4708 0.0005 0.0009 0.0035 -.0000  .0002  .0003
Be   .3398 .4141 .5370 0.0016 0.0013 0.0051 -.0000 -.0003  .0006
O1   .0396 .3988 .2466 0.0013 0.0026 0.0070  .0000 -.0003  .0013
O2   .4585 .2835 .6521 0.0007 0.0025 0.0067  .0003  .0011  .0010
O3   .1935 .3445 .6669 0.0008 0.0033 0.0054 -.0008 -.0002 -.0005
O4   .1428 .1059 .3305 0.0017 0.0016 0.0077  .0004  .0018 -.0000
OH   .3332 .4123 .2039 0.0012 0.0031 0.0041  .0003 -.0003  .0002
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: 1
View in html, download in amc

Return to AMCSD Home Page