Grimselite
Li Y, Burns P C
The Canadian Mineralogist 39 (2001) 1147-1151
The crystal structure of synthetic grimselite, K3Na[(UO2)(CO3)3](H2O)
_database_code_amcsd 0005731
9.302 9.302 8.260 90 90 120 P-62c
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
U 2/3 1/3 3/4 .018 .018 .018 .017 .009 0 0
K .2921 0 0 .037 .042 .037 .031 .019 .004 .008
Na 1/3 2/3 3/4 .031 .037 .037 .019 .018 0 0
O1 .9694 .4797 3/4 .029 .025 .026 .041 .017 0 0
O2 .8485 .6315 3/4 .030 .022 .028 .038 .012 0 0
O3 2/3 1/3 .9673 .031 .038 .038 .016 .019 0 0
O4 .1274 .7571 3/4 .036 .024 .025 .048 .005 0 0
Wat5 0 0 .1277 .5 .063 .057 .057 .075 .028 0 0
C .9883 .6282 3/4 .023 .016 .027 .017 .004 0 0
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Grimselite
Plasil J, Fejfarova K, Skala R, Skoda R, Meisser N, Hlousek J, Cisarova I,
Dusek M, Veselovsky F, Cejka J, Sejkora J, Ondrus P
Mineralogical Magazine 76 (2012) 443-453
The crystal chemistry of the uranyl carbonate mineral grimselite,
(K,Na)3Na[(UO2)(CO3)3](H2O), from Jachymov, Czech Republic
Note: Sample A
Locality: Jachymov, Czech Republic
_database_code_amcsd 0018908
9.2507 9.2507 8.1788 90 90 120 P-62c
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
K1 .2897 0 0 .821 .0355 .0420 .0335 .0282 .0168 .0047 .0095
Na1 .2897 0 0 .179 .0355 .0420 .0335 .0282 .0168 .0047 .0095
Na2 1/3 2/3 .75 .0283 .0347 .0347 .0154 .0173 0 0
U 2/3 1/3 .75 .01364 .01371 .01371 .01350 0 .00685 0
C .9887 .6296 .75 .024 .019 .021 .032 .010 0 0
O1 .9697 .4800 .75 .0282 .0154 .021 .0499 .011 0 0
O2 .8497 .6324 .75 .0314 .022 .025 .050 .0138 0 0
O3 2/3 1/3 .9686 .0352 .0451 .0451 .0155 .0226 0 0
O4 .1293 .7588 .75 .0341 .0208 .022 .051 .0045 0 0
Wat5 0 0 .122 .5 .090 .093 .093 .084 .046 0 0
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Grimselite
Plasil J, Fejfarova K, Skala R, Skoda R, Meisser N, Hlousek J, Cisarova I,
Dusek M, Veselovsky F, Cejka J, Sejkora J, Ondrus P
Mineralogical Magazine 76 (2012) 443-453
The crystal chemistry of the uranyl carbonate mineral grimselite,
(K,Na)3Na[(UO2)(CO3)3](H2O), from Jachymov, Czech Republic
Note: Sample B
Locality: Jachymov, Czech Republic
_database_code_amcsd 0018909
9.3000 9.3000 8.2940 90 90 120 P-62c
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
K .2922 0 0 .0368 .0420 .036 .031 .0178 .0043 .009
Na 1/3 2/3 .75 .027 .029 .029 .022 .0143 0 0
U 2/3 1/3 .75 .0165 .0149 .0149 .0197 .0075 0 0
C .989 .632 .75 .022 .021 .016 .028 .009 0 0
O1 .9677 .478 .75 .026 .010 .020 .048 .008 0 0
O2 .8475 .6299 .75 .023 .018 .036 .035 .017 0 0
O3 2/3 1/3 .965 .031 .030 .030 .034 .015 0 0
O4 .1281 .759 .75 .026 .023 .024 .050 .008 0 0
Wat5 0 0 .130 .5 .071 .083 .083 .05 .04 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 )
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