Important Update News

The RRUFF Project is being updated to improve its interface and content. The beta version of the update is accessible to the public at RRUFF.net. New data is only being added to the beta site. Please note that it is in development, and some components are not functional. Existing RRUFF.info links will resolve to the new site after RRUFF.net is officially released.

We are grateful to NASA for the funding of this effort.

American Mineralogist Crystal Structure Database

2 matching records for this search.

Orientite
Download hom/orientite.pdf
Moore P B, Shen J, Araki T
Download am/vol70/AM70_171.pdf
American Mineralogist 70 (1985) 171-181
Crystal chemistry of the (M2)3+ phi2 sheet: Structural principles and crystal
structures of ruizite, macfallite and orientite
Locality: Lake Manganese, Copper Harbor, Keweenaw County, Michigan, USA
_database_code_amcsd 0000965
9.074 19.130 6.121 90 90 90 Bbmm
atom     x     y     z occ U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3)  U(2,3)
Mn1    .25     0   .25     .00300 .00055 .00535  .00001 -.00000 -.00004
Mn2  .4549   .25 .2499  .5 .01386 .00191 .02308       0  .00135       0
Ca   .6978 .1585     0     .00871 .00053 .00713  .00017       0       0
Si1  .1057   .25     0  .5 .00934 .00104 .01450       0       0       0
O1   .9833 .1808     0     .00835 .00042 .00835  .00034       0       0
O2   .2049   .25 .2245     .00520 .00063 .01077       0 -.00005       0
Si2  .0301  .097     0     .00373 .00043 .00605  .00006       0       0
O3   .1294 .0812 .2164     .00327 .00076 .00886  .00018  .00066 -.00021
O4   .8729 .0584     0     .00333 .00104 .00681  .00004       0       0
OH5  .3677 .0308     0     .00374 .00078 .00950 -.00006       0       0
OH6  .4325 .1766     0  .5 .01277 .00145 .02100 -.00061       0       0
OH7  .4325 .1766     0  .5 .01277 .00145 .02100 -.00061       0       0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Orientite
Download hom/orientite.pdf
Mellini M, Merlino S, Pasero M
Download am/vol71/AM71_176.pdf
American Mineralogist 71 (1986) 176-187
X-ray and HRTEM structure analysis of orientite
_database_code_amcsd 0001007
9.044 6.091 19.031 90 90 90 P2mm
atom      x     y      z occ Biso
Ca1   .2876    .5  .1608      .39
Ca2   .8136     0  .1569      .75
Ca3   .7093    .5  .6571     1.38
Ca4   .1836     0  .6578      .36
Mn1   .2560 .2511  .0018      .19
Mn2   .5507 .2488    .25 .84  .06
Mn3   .7511 .2591 -.0028      .47
Si1  -.0256    .5  .0934     1.12
Si2   .4763     0  .1006      .06
Si3  -.1026    .5    .25 .84  .06
Si4   .1949     0    .25 .84  .37
Si5   .0454    .5  .5963      .06
Si6   .5258     0  .5971      .25
Si7   .1197    .5    .75      .42
Si8   .6029     0    .75 .68 4.38
Mn2A  .0691 .2295    .25 .16 1.41
Si3A  .3929     0    .25 .16  .06
Si4A  .6936    .5    .25 .16  .06
Mn2B  .4615 .2534    .75 .32  .49
Si4B  .7956     0    .75 .32 1.00
O1    .3788 .2143  .0791      .62
O2    .8691 .2886  .0781      .30
O3    .1394    .5  .0616     1.25
O4    .6301     0  .0579      .06
O5    .2932 .2383    .25     1.64
O6    .7910 .2840    .25      .74
O7    .5599     0  .1779      .36
O8    .0110    .5  .1810     1.02
OH9   .0694     0  .1799     1.62
OH10  .1301     0  .0247      .56
O11   .6409    .5  .0292      .06
OH12  .5284    .5  .1806     2.14
O13   .6270 .2137  .5877      .19
O14   .1289 .2615  .5807     1.07
O15  -.1165    .5  .5604     1.08
O16   .3778     0  .5515      .42
O17   .1954 .2537    .75      .93
O18   .4813     0  .6834      .06
O19   .0060    .5  .6768      .40
OH20  .8617     0  .5410      .06
OH21  .3773    .5  .5268     1.10
O22   .7054 .2104    .75      .05
OH23 -.0782     0  .6799     2.01
OH24  .4300    .5  .6771      .72
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