Malayaite
Zhang M, Meyer H W, Groat L A, Bismayer U, Salje E K H, Adiwidjaja G
Physics and Chemistry of Minerals 26 (1999) 546-553
An infrared spectroscopic and single-crystal X-ray study
of malayaite, CaSnSiO5
Sample: T = 550 K
Note: U33 for O1 has been altered by personal communication with authors, Dec 2003
_database_code_amcsd 0008235
7.166 8.903 6.678 90 113.39 90 A2/a
atom     x      y     z  Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3) U(2,3)
Ca     .25 .66304    .5 .0303 .05306 .00964 .01404       0 -.00152      0
Sn      .5     .5     0 .0081 .00679 .00896 .00781 -.00039  .00271 .00000
Si     3/4 .68153    .5 .0085 .00834 .00920 .00731       0  .00268      0
O1     3/4  .5861     0 .0143 .00912 .01030 .02477       0  .00877      0
O2   .9122  .5682 .6752 .0150 .01686 .01533 .00975  .00502  .00278 .00244
O3   .3716 .71211 .8906 .0134 .01688 .01137 .01309  .00457  .00771 .00123