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Jinshajiangite |
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Sokolova E, Camara F, Hawthorne F C, Abdu Y |
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European Journal of Mineralogy 21 (2009) 871-883 |
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From structure topology to chemical composition. VII. Titanium silicates: |
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the crystal structure and crystal chemistry of jinshajiangite |
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Locality: Norra Karr, Tonkoping province, Sweden |
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_database_code_amcsd 0007327 |
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10.6785 13.786 20.700 90 94.937 90 C2/m |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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FeMO(1) .12348 0 .74395 .0076 .0046 .0090 .0094 0 .0012 0 |
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FeMO(2) .37436 0 .25460 .90 .0079 .0054 .0083 .0101 0 .0006 0 |
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MgMO(2) .37436 0 .25460 .10 .0079 .0054 .0083 .0101 0 .0006 0 |
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FeMO(3) .37433 .12400 .75126 .95 .0091 .0057 .0082 .0135 .0011 .0016 -.0001 |
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MgMO(3) .37433 .12400 .75126 .05 .0091 .0057 .0082 .0135 .0011 .0016 -.0001 |
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FeMO(4) .37424 .24820 .24466 .77 .0087 .0049 .0083 .01291 .0000 .0012 .0001 |
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MnMO(4) .37424 .24820 .24466 .23 .0087 .0049 .0083 .01291 .0000 .0012 .0001 |
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FeMO(5) .12389 .12619 .25122 .49 .0115 .0064 .0120 .0169 -.0031 .0049 -.0040 |
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MnMO(5) .12389 .12619 .25122 .40 .0115 .0064 .0120 .0169 -.0031 .0049 -.0040 |
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ZrMO(5) .12389 .12619 .25122 .04 .0115 .0064 .0120 .0169 -.0031 .0049 -.0040 |
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NaMO(5) .12389 .12619 .25122 .07 .0115 .0064 .0120 .0169 -.0031 .0049 -.0040 |
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TiMH(1) .26682 0 .60285 .0474 .0011 .130 .0105 0 -.0009 0 |
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TiMH(2) .23339 0 .39818 .0449 .0009 .122 .0111 0 -.0014 0 |
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TiMH(3) .48335 .23021 .89798 .0022 .0017 .0017 .0033 -.0003 .0005 .0004 |
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Si(1) .01953 .14135 .61950 .0136 .0236 .0087 .0085 -.0008 .0014 .0004 |
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Si(2) .25761 .10891 .11917 .0050 .0017 .0049 .0081 .0006 -.0003 .0000 |
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Si(3) .21756 .10937 .88055 .0048 .0016 .0043 .0084 -.0002 .0004 .0000 |
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Si(4) .47947 .13996 .37992 .0133 .0226 .0086 .0085 -.0007 .0009 -.0006 |
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BaAP(1) .5 0 0 .0055 .0048 .0066 .0052 0 .0003 0 |
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BaAP(2) .25 .25 .5 .52 .0203 .0123 .0331 .0154 -.0006 .0000 -.0004 |
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KAP(2) .25 .25 .5 .36 .0203 .0123 .0331 .0154 -.0006 .0000 -.0004 |
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KAP(3) 0 .0382 0 .36 .0285 .0217 .0389 .0252 0 .0035 0 |
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BaAP(3) 0 .0382 0 .14 .0285 .0217 .0389 .0252 0 .0035 0 |
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NaBP(1) .5 0 .5 .60 .0271 .031 .032 .018 0 .0013 0 |
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CaBP(1) .5 0 .5 .40 .0271 .031 .032 .018 0 .0013 0 |
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NaBP(2) 0 0 .5 .60 .0245 .029 .028 .017 0 .0014 0 |
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CaBP(2) 0 0 .5 .40 .0245 .029 .028 .017 0 .0014 0 |
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NaBP(3) .25 .25 0 .60 .0192 .0234 .0217 .0123 -.0103 -.0004 .0001 |
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CaBP(3) .25 .25 0 .40 .0192 .0234 .0217 .0123 -.0103 -.0004 .0001 |
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O(1) .2081 0 .0991 .0083 .008 .004 .013 0 .001 0 |
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O(2) .3590 .1254 .9123 .0070 .004 .0050 .011 -.0023 -.0036 .0024 |
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O(3) .1489 .1787 .0869 .0080 .007 .005 .012 .0008 -.0002 .0012 |
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O(4) .1738 0 .8990 .0060 |
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O(5) .3879 .1252 .0872 .0081 |
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O(6) .1201 .1783 .9138 .0069 .0049 .0024 .013 .0005 -.0006 -.0012 |
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O(7) .2749 .1193 .1973 .0111 .002 .018 .014 -.0038 -.0007 -.0001 |
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O(8) .2128 .1207 .8025 .0147 .009 .021 .014 .0012 .0020 -.001 |
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O(9) .0355 .1304 .6984 .0085 .014 .006 .005 -.0003 -.0009 .0003 |
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O(10) .4615 .1279 .3012 .0075 .013 .004 .0047 .0001 -.0006 -.0009 |
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O(11) .1056 .0961 .4141 .078 .006 .212 .016 .028 .003 -.001 |
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O(12A) .4254 .2497 .4004 .5 .0099 .011 .005 .012 -.000 -.007 .000 |
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O(12B) .4552 .2488 .6002 .5 .0099 .011 .005 .012 -.000 -.007 .000 |
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O(13) .1353 .0979 .5866 .084 .009 .230 .013 .031 .007 .002 |
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O(14) .3652 .0973 .4144 .080 .010 .215 .015 -.030 .007 -.006 |
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O(15) .3942 .0953 .5876 .087 .008 .238 .017 -.034 .002 .002 |
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O(16) .4744 .2382 .8126 .0090 .005 .012 .010 .0057 .0009 .0047 |
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O(17) .2174 0 .3112 .0188 .008 .038 .010 0 .001 0 |
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O(18) .2811 0 .6903 .0186 .008 .040 .008 0 .002 0 |
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OHXOA1 .2910 .2484 .7067 .0075 .007 .013 .0023 .0013 -.0024 -.0001 |
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OHXOA2 .4648 0 .7943 .0189 .008 .019 .030 0 .003 0 |
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OHXOA3 .0350 0 .2082 .0154 .006 .013 .027 0 .003 0 |
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OHXPM .2496 0 .5004 .64 .052 .001 .151 .004 0 .001 0 |
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FXPM .2496 0 .5004 .36 .052 .001 .151 .004 0 .001 0 |
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F .5 .2257 0 .0079 .010 .010 .003 0 -.0003 0 |
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| 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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Jinshajiangite |
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Rastsvetaeva R K, Chukanov N V, Rozenberg K |
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Crystallography Reports 53 (2008) 553-556 |
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A crystal structure of jinshajiangite from the Norra Karr complex (Sweden) |
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Locality: Norra Karr alkaline complex, Sweden |
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_database_code_amcsd 0012410 |
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5.350 6.909 20.96 90 99.83 90 P2/m |
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atom x y z occ Biso |
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BaBa 0 .5 .5 .8 1.8 |
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KBa 0 .5 .5 .2 1.8 |
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Na .5 0 .5 3.8 |
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KK 0 0 0 .6 2.3 |
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BaK 0 0 0 .4 2.3 |
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CaCa .5 .5 0 .76 2.5 |
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BaCa .5 .5 0 .24 2.5 |
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Si1 .5809 .2246 .1182 1.4 |
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Si2 .424 .292 .3792 1.3 |
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Ti1 .924 0 .3966 1.4 |
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TiTi2 .0609 .5 .1013 .8 2.0 |
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NbTi2 .0609 .5 .1013 .1 2.0 |
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ZrTi2 .0609 .5 .1013 .1 2.0 |
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FeFe1 .0010 .2542 .2491 .75 1.4 |
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MnFe1 .0010 .2542 .2491 .25 1.4 |
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FeFe2 .5053 .5 .2463 .75 1.1 |
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MgFe2 .5053 .5 .2463 .25 1.1 |
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FeFe3 .5126 0 .2570 .75 1.0 |
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MnFe3 .5126 0 .2570 .25 1.0 |
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O1 .633 .260 .2004 .5 |
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OH2 .143 0 .2053 2.1 |
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OH3 .5 .5 .5 3.2 |
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OH4 .884 .5 .2900 1.2 |
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O5 .368 .284 .3052 1.3 |
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O6 .862 0 .312 2.3 |
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O7 .319 .262 .0829 1.6 |
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OH8 0 .5 0 1.4 |
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O9 .806 .299 .0879 1.1 |
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O10 .488 0 .1023 2.5 |
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O11 .317 .5 .4032 1.7 |
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O12 .688 .154 .4091 4.9 |
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O13 .241 .160 .415 5.3 |
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OH14 0 0 .5 5.9 |
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OH15 .5 0 0 5.6 |
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F .131 .5 .1878 1.8 |
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| 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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