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Tumchaite |
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Subbotin V V, Merlino S, Pushcharovsky D Y, Pakhomovsky Y A, Ferro O, |
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Bogdanova A N, Voloshin A V, Sorokhtina N V, Zubkova N V |
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American Mineralogist 85 (2000) 1516-1520 |
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Tumchaite Na2(Zr,Sn)Si4O11.2H2O - a new mineral from carbonatites of the |
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Vuoriyarvi alkali-ultrabasic massif, Murmansk Region, Russia |
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_database_code_amcsd 0002590 |
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9.144 8.818 7.537 90 113.22 90 P2_1/c |
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atom x y z occ Uiso |
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Zr 0 .5 0 .8 .0076 |
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Sn 0 .5 0 .2 .0076 |
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Si1 .1669 .1582 .1993 .0093 |
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Si2 .3176 .4421 .4124 .0093 |
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Na .2051 .6884 .7109 .0243 |
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O1 .3148 .2659 .3454 .0129 |
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O2 .1164 .0346 .3187 .0126 |
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O3 .0260 .2676 .0660 .0131 |
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O4 .2471 .0543 .0791 .0131 |
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O5 .2145 .5425 .2299 .0120 |
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O6 .5 0 0 .0157 |
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OW .3709 .6921 .0371 .0317 |
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H1 .498 .684 .075 .05 |
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H2 .352 .602 .090 .05 |
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Cafetite |
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Krivovichev S V, Yakovenchuk V N, Burns P C, Pakhomovsky Y A, Menshikov Y P |
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American Mineralogist 88 (2003) 424-429 |
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Cafetite, Ca[Ti2O5](H2O): Crystal structure and revision of chemical formula |
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Locality: alkaline rocks in the Afrikanda massif, Kola peninsula, Russia. |
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_database_code_amcsd 0002986 |
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4.9436 12.109 15.911 90 98.937 90 P2_1/n |
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atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Ti1 .8280 .69732 .45767 .0081 .0090 .0066 .0076 -.0003 -.0021 .0000 |
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Ti2 .2259 .51318 .43865 .0094 .0102 .0088 .0083 -.0001 -.0016 .0005 |
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Ti3 .9742 .91031 .57249 .0078 .0091 .0074 .0060 .0002 -.0018 .0007 |
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Ti4 .5820 .11252 .54933 .0077 .0091 .0069 .0060 .0001 -.0018 -.0004 |
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Ca1 .5198 .95070 .74009 .0149 .0171 .0154 .0107 -.0022 -.0026 -.0011 |
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Ca2 .5906 .30997 .37755 .0098 .0103 .0085 .0097 .0002 -.0016 -.0011 |
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O1 .9544 .4030 .4588 .0087 .0079 .0103 .0072 .0010 -.0011 -.0010 |
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O2 .6707 .8122 .5478 .0090 .0071 .0091 .0100 -.0013 -.0015 -.0019 |
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O3 .8802 .1926 .5150 .0117 .0139 .0092 .0126 -.0016 .0033 -.0013 |
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O4 .2691 .0043 .5342 .0087 .0107 .0088 .0063 .0001 .0006 .0010 |
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O5 .5430 .6009 .4870 .0107 .0102 .0117 .0089 -.0007 -.0025 -.0006 |
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O6 .4351 .2114 .6174 .0100 .0116 .0102 .0068 .0010 -.0034 -.0010 |
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O7 .7844 .0199 .6331 .0101 .0099 .0120 .0071 .0007 -.0033 -.0007 |
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O8 .1721 .8480 .6616 .0114 .0156 .0104 .0070 .0011 -.0018 -.0001 |
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O9W .2450 .2208 .2645 .0154 .0150 .0220 .0073 .0019 -.0029 .0014 |
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O10W .2148 .1098 .7410 .0153 .0160 .0179 .0112 -.0030 -.0014 -.0001 |
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O11 .3218 .4661 .3440 .0144 .0190 .0129 .0105 .0076 .0008 -.0004 |
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O12 .9673 .6219 .3763 .0126 .0140 .0139 .0096 .0048 -.0008 .0011 |
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H1 .069 .211 .282 .0430 |
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H2 .079 .083 .696 .0430 |
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H3 .167 .246 .209 .0430 |
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H4 .302 .162 .709 .0430 |
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Shafranovskite |
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Krivovichev S V, Yakovenchuk V N, Armbruster T, Pakhomovsky Y A, |
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Weber H-P, Depmeier W |
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American Mineralogist 89 (2004) 1816-1821 |
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Synchrotron X-ray diffraction study of the structure of shafranovskite, |
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K2Na3(Mn,Fe,Na)4[Si9(O,OH)27].nH2O, a rare manganese silicate |
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from Kola peninsula, Russia |
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Locality: Kola peninsula, Russia |
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_database_code_amcsd 0003660 |
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14.519 14.519 21.062 90 90 120 P31c |
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atom x y z occ Uiso |
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Na1 .0681 .5602 .7052 .043 |
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Na2 .2252 .8230 .7248 .043 |
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Na3 .9206 .4395 .4498 .096 |
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K1 .1909 .7494 .4561 .081 |
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K2 .1464 .9166 .9865 .90 .068 |
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Mn1 .9629 .7169 .71758 .033 |
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Mn2 .9150 .2978 .71055 .030 |
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Mn3 .8563 .8767 .7376 .82 .041 |
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Mn4 .8092 .4569 .69027 .80 .028 |
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Si1 .9527 .6271 .5734 .0353 |
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Si2 0 0 .6080 .033 |
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Si3 .9511 .8083 .8625 .051 |
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Si4 .0546 .6703 .8464 .0411 |
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Si5 .0996 .8621 .5978 .0353 |
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Si6 .7082 .5229 .5676 .0353 |
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Si7 .9916 .2923 .8547 .043 |
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Si8 .8978 .4320 .8288 .0393 |
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Si9 .0563 .3964 .5849 .0343 |
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Si10 2/3 1/3 .8197 .038 |
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Si11 2/3 1/3 .4923 .72 .035 |
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O1 .0964 .8446 .6737 .041 |
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O2 .9496 .6004 .6452 .043 |
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O3 .0464 .3989 .6572 .044 |
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OH4 .8408 .7411 .6739 .051 |
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O5 .8824 .9240 .5775 .033 |
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O6 .6627 .6002 .5506 .050 |
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OH7 .8156 .5869 .7518 .043 |
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OH8 .1314 .5110 .5521 .060 |
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O9 .2125 .8924 .5651 .037 |
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OH10 .0893 .3668 .8974 .075 |
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O11 .0655 .6929 .7722 .039 |
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O12 .7980 .3095 .6395 .067 |
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O13 .8262 .7504 .8825 .060 |
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OH14 .1570 .7087 .8844 .065 |
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OH15 2/3 1/3 .4164 .72 .055 |
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O16 .9745 .8456 .7891 .068 |
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O17 .7149 .7277 .7802 .044 |
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O18 0 0 .6826 .041 |
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OH19 .0100 .9045 .9110 .069 |
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OH20 .0076 .5850 .5232 .045 |
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O21 .0892 .4307 .3646 .046 |
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O22 .6471 .4233 .5196 .048 |
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O23 .9856 .7203 .8785 .059 |
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O24 .7546 .1695 .5481 .046 |
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Wat25 .4569 .7811 .6385 .086 |
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O26 .0096 .7536 .5616 .040 |
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O27 2/3 1/3 .7425 .044 |
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O28 .9087 .4267 .7557 .040 |
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O29 .9853 .5450 .8638 .045 |
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Wat30 .3500 .7967 .7853 .080 |
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O31 .7811 .4129 .8491 .049 |
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Wat32 1/3 2/3 .4932 .174 |
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|
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|
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Chivruaiite |
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Men'shikov Y P, Krivovichev S V, Pakhomovsky Y A, Yakovenchuk V N, |
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Ivanyuk G Yu, Mikhailova J A, Armbruster T, Selivanova E A |
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American Mineralogist 91 (2006) 922-928 |
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Chivruaiite, Ca4(Ti,Nb)5[(Si6O17)2|(OH,O)5]·13-14H2O, a new mineral |
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from hydrothermal veins of Khibiny and Lovozero alkaline massifs |
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Locality: Chivruai River valley, Kola peninsula, Russia |
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_database_code_amcsd 0004161 |
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7.1918 23.166 6.9472 90 90 90 Cmmm |
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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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Ca1 0 .13883 .2145 .35 .0320 .0165 .0247 .055 0 0 .014 |
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Sr1 0 .13883 .2145 .025 .0320 .0165 .0247 .055 0 0 .014 |
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Mn2 .25 .25 .5 .10 .024 .023 .037 .012 .008 0 0 |
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Ca2 .25 .25 .5 .075 .024 .023 .037 .012 .008 0 0 |
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K -.856 .5 .5 .05 .120 |
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Ba -.856 .5 .5 .025 .120 |
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Ti1 .25 .25 0 .78 .0172 .0224 .0156 .0137 .0067 0 0 |
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Nb1 .25 .25 0 .22 .0172 .0224 .0156 .0137 .0067 0 0 |
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Ti2 -.5 .5 .0319 .25 .020 .0171 .0106 .033 0 0 0 |
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Si1 0 .33852 .27054 .0143 .0173 .0161 .0096 0 0 -.0002 |
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Si2 .0962 .43567 0 .50 .0155 .0152 .0101 .0211 -.0007 0 0 |
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O1 0 .5 0 .0235 .024 .011 .035 0 0 0 |
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O2 0 .3454 .5 .0351 .068 .028 .010 0 0 0 |
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O3 0 .21976 0 .696 .0192 .014 .016 .028 0 0 0 |
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OH3 0 .21976 0 .304 .0192 .014 .016 .028 0 0 0 |
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O4 .1851 .30653 .2009 .0341 .0191 .0407 .043 .0071 -.004 -.027 |
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O5 0 .40438 .1893 .0350 .067 .0182 .020 0 0 .003 |
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Wat6 0 .1986 .5 .072 .090 .071 .056 0 0 0 |
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O7 .3179 .4387 .0420 .25 .024 .013 .020 .040 -.001 .000 .000 |
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Wat8 -.5 .5 .414 .30 .064 |
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O9 -.5 .5 .267 .174 .042 |
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OH9 -.5 .5 .267 .076 .042 |
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Wat10 0 .5 .5 .34 .13 |
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Wat11 -.5 .5783 .5 .29 .080 |
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Wat12 .413 .411 0 .12 .080 |
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Wat13 -.340 .5686 .425 .19 .080 |
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Wat14 0 .099 .166 .11 .080 |
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|
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|
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Armbrusterite |
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Yakovenchuk V N, Krivovichev S K, Pakhomovsky Y A, Ivanyuk G Y, Selivanova E A, |
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Menshikov Y P, Britvin S N |
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American Mineralogist 92 (2007) 416-423 |
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Armbrusterite, K5Na6Mn3+Mn2+14[Si9O22]4(OH)10*4H2O, a new Mn hydrous |
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heterophyllosilicate from the Khibiny alkaline massif, Kola Peninsula, Russia |
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Locality: Khibiny alkaline massif, Kola Peninsula, Russia |
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_database_code_amcsd 0004282 |
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17.333 23.539 13.4895 90 115.069 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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K1 .210 .9513 .4905 .30 .090 |
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K2 .505 0 .6035 .28 .072 |
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K3 0 0 .5 .16 .042 |
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K5 .9725 .6967 .495 .20 .1 |
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K6 .815 .6705 .490 .17 .1 |
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K7 .854 .7263 .479 .17 .1 |
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K10 .824 .560 .477 .11 .1 |
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K11 .398 .0665 .485 .12 .1 |
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Na1 .8465 .14408 .0470 .0294 .0225 .0192 .047 -.0010 .0151 .001 |
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Na2 .5 .8511 0 .031 .026 .026 .048 0 .024 0 |
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Mn2+1 0 .06931 0 .0223 .0162 .0150 .0381 0 .0139 0 |
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Mn2+2 0 .21062 0 .0219 .0153 .0170 .0355 0 .0127 0 |
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Mn2+3 .32397 .07102 .96233 .0223 .0168 .0157 .0388 -.0003 .0160 -.0005 |
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Mn2+4 .84790 0 .04652 .0229 .0155 .0178 .0380 0 .0141 0 |
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Mn3+5 .5 0 0 .0214 .0137 .0181 .0351 0 .0129 0 |
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Mn2+6 .67138 .78453 .01290 .0230 .0174 .0173 .0395 .0008 .0170 .0011 |
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Si1 .28669 .06392 .1804 .0203 .0150 .0156 .0345 -.0001 .0144 .0009 |
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Si2 .85334 .86802 .7929 .0205 .0135 .0166 .0342 .0018 .0128 -.0003 |
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Si3 .39902 .06387 .7713 .0213 .0138 .0181 .0354 -.0004 .0139 .0000 |
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Si4 .85790 .74466 .7667 .0222 .0148 .0186 .0346 -.0014 .0117 -.0010 |
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Si5 .01462 .06473 .2525 .0206 .0167 .0133 .0363 .0009 .0156 .0000 |
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Si6 .02831 .75457 .7661 .0221 .0165 .0180 .0359 -.0014 .0151 .0008 |
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Si7 .25042 .85840 .7343 .0209 .0130 .0170 .0340 .0005 .0113 .0006 |
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Si8 .05700 .14539 .6269 .0206 .0125 .0198 .0319 -.0001 .0117 -.0015 |
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Si9 .43999 .13157 .2007 .0201 .0124 .0150 .0354 -.0013 .0124 -.0004 |
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O3 .2454 .0672 .0507 .0234 .018 .016 .041 -.001 .016 -.001 |
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O5 .4031 .1383 .0717 .0243 .016 .018 .038 .002 .011 -.003 |
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O6 .2603 .8580 .8579 .0269 .022 .028 .032 -.003 .012 -.002 |
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O7 .9042 .7291 .8946 .0250 .018 .027 .033 -.004 .014 -.003 |
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O8 .9465 .0659 .1274 .0238 .022 .016 .037 -.006 .016 -.004 |
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O9 .9156 .8623 .9180 .0231 .016 .018 .037 -.001 .014 .001 |
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O10 .4251 .0613 .8999 .0242 .016 .022 .039 .002 .017 -.001 |
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O11 .0479 0 .2970 .0255 .025 .014 .044 0 .021 0 |
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O12 .9007 .8973 .7236 .0271 .026 .020 .040 -.004 .019 -.003 |
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O13 .8129 .8070 .7384 .0237 .019 .012 .038 -.004 .009 .000 |
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O14 .4644 .1037 .7424 .0244 .023 .017 .035 -.003 .014 .001 |
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O15 .0671 .7719 .8922 .0259 .019 .028 .032 .002 .012 -.002 |
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O16 .0597 .6928 .7419 .0236 .022 .021 .033 .002 .017 .003 |
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O17 .3033 .9103 .7082 .0245 .015 .021 .041 -.002 .015 -.001 |
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O18 0 .1576 .5 .032 .022 .040 .035 0 .013 0 |
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O19 .7830 .7004 .6985 .0252 .018 .017 .039 -.004 .011 .002 |
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O20 .2999 0 .2285 .027 .031 .013 .039 0 .017 0 |
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O21 .1529 .1329 .6433 .0274 .016 .030 .042 -.001 .017 -.005 |
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O22 .0547 .1999 .6958 .0315 .030 .025 .044 .002 .021 -.005 |
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O23 .3814 .0906 .2391 .0290 .018 .033 .035 -.010 .010 .000 |
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O24 .3989 0 .7223 .0238 .023 .019 .037 0 .020 0 |
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O26 .9254 .7478 .7106 .0284 .014 .038 .033 -.004 .010 -.002 |
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O27 .7697 .9067 .7654 .0293 .022 .030 .035 .012 .012 .001 |
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O28 .9767 .0893 .3356 .0284 .023 .022 .051 -.004 .027 -.001 |
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OH1 .2409 0 .8736 .0265 .023 .022 .040 0 .018 0 |
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OH2 .4119 0 .0649 .029 .021 .023 .049 0 .019 0 |
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OH4 .0899 0 .0692 .027 .024 .022 .038 0 .016 0 |
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OH25 .7508 .7120 .0734 .0270 .018 .024 .042 .002 .016 .003 |
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Wat1 0 .652 .5 .35 .1 |
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Wat2 0 .586 .5 .34 .1 |
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Wat3 .878 .683 .434 .26 .1 |
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Wat4 .824 .613 .478 .29 .1 |
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Wat5 .243 0 .413 .26 .1 |
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Wat6 .218 0 .509 .26 .1 |
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Wat7 .8609 0 .3821 .70 .1 |
|
|
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|
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Yakovenchukite-(Y) |
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Krivovichev S V, Pakhomovsky Y A, Ivanyuk G Y, Mikhailova J A, Men'shikov Y P, |
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Armbruster T, Selivanova E A, Meisser N |
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American Mineralogist 92 (2007) 1525-1530 |
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Yakovenchukite-(Y), K3NaCaY2(Si12O30)(H2O)4, a new mineral from the Khibiny |
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massif, Kola Peninsula, Russia: a novel type of octahedral-tetrahedral |
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open-framework structure |
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Locality: Khibiny massif, Kola Peninsula, Russia |
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_database_code_amcsd 0004453 |
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14.972 14.137 14.594 90 90 90 Pcca |
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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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K1 .5 .2677 .25 .88 .041 .0308 .026 .065 .000 .026 0 |
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K2 .0896 .2619 .1022 .94 .0384 .0180 .037 .061 .0046 .0013 .0041 |
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Na .25 .5 .0128 .042 .047 .053 .027 -.014 0 0 |
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Ca1 .25 0 .0300 .0157 .0096 .020 .017 .0040 0 0 |
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Ca2 .0392 .244 .006 .06 .013 |
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Y1 0 .5 .5 .84 .0137 .0103 .0159 .0151 -.0002 .0008 .0006 |
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Yb1 0 .5 .5 .16 .0137 .0103 .0159 .0151 -.0002 .0008 .0006 |
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Y2 0 0 .5 .82 .0143 .0099 .0176 .0154 .0008 .0014 .0013 |
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Yb2 0 0 .5 .18 .0143 .0099 .0176 .0154 .0008 .0014 .0013 |
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Si1 .1252 .3588 .3440 .0149 .010 .011 .024 -.0004 -.0027 -.0027 |
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Si2 .1215 .1434 .3510 .0161 .014 .019 .015 -.0007 .0012 -.0013 |
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Si3 .1699 .6402 .3768 .0169 .0121 .019 .020 -.0023 .0013 -.0023 |
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Si4 .1759 -.1359 .3717 .0141 .0120 .011 .020 .0003 -.0002 -.0021 |
|
Si5 .0972 -.0264 .2175 .0158 .0144 .017 .016 -.0007 .0003 .0015 |
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Si6 .1452 .5182 .2019 .0207 .0159 .026 .020 .0008 .0001 -.0009 |
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O1 0 -.0642 .25 .022 .013 .022 .030 0 -.005 0 |
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O2 .1407 .6031 .2768 .025 .027 .025 .024 .000 -.004 -.007 |
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O3 .1150 .0775 .2608 .019 .029 .015 .013 .005 -.005 .007 |
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O4 .1142 .4183 .2503 .025 .019 .024 .031 -.003 -.008 .006 |
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O5 .1667 -.1019 .2656 .017 .015 .026 .009 .003 .000 -.006 |
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O6 .2233 .3810 .3887 .020 .016 .023 .020 -.004 .004 -.009 |
|
O7 .1234 .2500 .3074 .020 .019 .015 .025 -.005 .006 -.004 |
|
O8 .2185 .1219 .4007 .019 .005 .023 .030 -.003 -.003 .000 |
|
O9 .0445 .1289 .4250 .021 .016 .020 .027 -.005 .006 .004 |
|
O10 .0499 .3799 .4176 .020 .015 .030 .016 -.007 .002 -.003 |
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O11 .1508 .7520 .3767 .022 .013 .019 .035 .003 .003 .004 |
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O12 .0906 .5452 .1147 .028 .025 .039 .020 -.007 -.007 .002 |
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O13 .1075 -.0264 .1103 .024 .031 .032 .010 .005 -.004 .005 |
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O14 .1188 .5910 .4586 .023 .022 .022 .024 -.002 .003 .007 |
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O15 .25 .5 .1732 .028 .021 .048 .017 -.002 0 0 |
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O16 .1198 -.0744 .4401 .020 .015 .025 .018 .007 .002 -.005 |
|
Wat17 .4059 .2524 .0825 .057 .069 .038 .064 .008 .002 .009 |
|
Wat18 .2429 .1640 .1046 .041 .035 .059 .030 .020 -.006 .003 |
|
|
| Download AMC data (View Text File)
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|
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Eliseevite |
| |
Yakovenchuk V N, Ivanyuk G Y, Krivovichev S V, Pakhomovsky Y A, Selivanova E A, |
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Korchak J A, Men'shikov Y P, Drogobuzhskaya S V, Zalkind O A |
| |
American Mineralogist 96 (2011) 1624-1629 |
|
Eliseevite, Na1.5Li[Ti2Si4O12.5(OH)1.5]*2H2O, a new microporous titanosilicate |
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from the Lovozero alkaline massif (Kola Peninsula, Russia) |
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Locality: the Lovozero alkaline massif, Kola Peninsula, Russia |
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Note y-coordinate for O3 changed from .218 to reproduce reported bond lengths |
|
_database_code_amcsd 0018483 |
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27.483 8.669 5.246 90 90.782 90 C2/c |
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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) |
|
Na .1655 .1972 -.3797 .75 .0252 .034 .0204 .0211 .0038 .0062 -.0032 |
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Li 0 .3675 .25 .009 .002 .007 .019 0 .005 0 |
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Ti .1641 .4057 .1256 .0140 .0177 .0129 .0113 .0002 -.0001 .0007 |
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Si1 .2659 .5897 .2901 .0124 .0172 .0114 .0087 .0001 -.0003 -.0001 |
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Si2 .0910 .0990 .0307 .0259 .0234 .0197 .0347 -.0012 -.0006 .0006 |
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O1 .2070 .5773 .2890 .0148 .020 .015 .0096 -.0013 -.0004 .0002 |
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O2 .2873 .7602 .2663 .0170 .024 .014 .013 -.0029 -.0039 -.0011 |
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O3 .1049 .0218 .3022 .048 .036 .044 .065 .001 -.007 .034 |
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O4 .1331 .4340 .4235 .0165 .019 .020 .010 -.0022 .0024 -.0019 |
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O5 .2873 .4920 .0490 .0148 .016 .019 .0096 -.0012 .0005 -.0035 |
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O6 .1219 .2514 -.0083 .021 .030 .019 .015 -.0055 .0008 -.0012 |
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OH7 .0329 .1310 .0142 .75 .041 .028 .055 .041 .013 .000 .010 |
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O7 .0329 .1310 .0142 .25 .041 .028 .055 .041 .013 .000 .010 |
|
Wat8 -.0376 .3854 -.049 .144 .106 .105 .222 -.027 .105 -.045 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
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Ivanyukite-Na-T |
| |
Yakovenchuk V N, Nikolaev A P, Selivanova E A, Pakhomovsky Y A, |
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Korchak J A, Spiridonova D V, Zalkind O A, Krivovichev S V |
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American Mineralogist 94 (2009) 1450-1458 |
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Ivanyukite-Na-T, ivanyukite-Na-C, ivanyukite-K, and ivanyukite-Cu: |
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New microporous titanosilicates from the Khibiny massif |
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(Kola Peninsula, Russia) and crystal structure of ivanyukite-Na-T |
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Locality: Koashva Mountain, Khibiny Massif, Kola Peninsula, Russia |
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_database_code_amcsd 0004993 |
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10.921 10.921 13.885 90 90 120 R3m |
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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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Ti1 .4793 .2397 .3529 .026 .025 .0233 .029 .0126 .0023 .0011 |
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Ti2 2/3 1/3 .1747 .033 .027 .027 .045 .0134 .000 .000 |
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Si .3323 .1661 .1461 .031 .027 .026 .041 .0134 -.014 -.0068 |
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K 2/3 1/3 .6181 .52 .038 |
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Na .1974 .3949 .2062 .48 .029 |
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O1 .3317 .1658 .2665 .037 .012 .044 .045 .006 -.012 -.006 |
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O2 .2616 .0061 .1036 .033 .034 .026 .035 .013 -.007 -.004 |
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O3 .4934 .2467 .1031 .030 .027 .020 .045 .013 -.024 -.012 |
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O4 2/3 1/3 .426 .030 .027 .027 .036 .013 .000 .000 |
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O5 .5900 .4100 .2750 .038 .039 .039 .041 .023 -.002 .002 |
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Wat6 .140 .280 .352 .092 |
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Wat7 .098 .5491 .238 .072 |
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Henrymeyerite |
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Mitchell R H, Yakovenchuk V N, Chakhmouradian A R, Burns P C, |
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Pakhomovsky Y A |
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The Canadian Mineralogist 38 (2000) 617-626 |
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Henrymeyerite, a new hollandite-type Ba-Fe titanate from the |
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Kovdor Complex, Russia |
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Locality: Kovdor Complex, Russia |
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_database_code_amcsd 0005647 |
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10.219 10.219 2.963 90 90 90 I4/m |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Ba 0 0 .5 .86 .0290 .0290 .0310 0 0 0 |
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Na 0 0 .5 .09 .0290 .0290 .0310 0 0 0 |
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K 0 0 .5 .01 .0290 .0290 .0310 0 0 0 |
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La 0 0 .5 .02 .0290 .0290 .0310 0 0 0 |
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Ce 0 0 .5 .02 .0290 .0290 .0310 0 0 0 |
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Ti .34985 .16604 0 .86 .0090 .0121 .0060 .0021 0 0 |
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Fe .34985 .16604 0 .13 .0090 .0121 .0060 .0021 0 0 |
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O1 .1558 .2037 0 .010 .015 .009 .000 0 0 |
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O2 .5390 .1672 0 .010 .013 .013 .000 0 0 |
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Bakhchisaraitsevite |
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Yakubovich O V, Massa W, Liferovich R P, Pakhomovsky Y A |
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The Canadian Mineralogist 38 (2000) 831-838 |
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The crystal structure of bakhchisaraitsevite, |
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[Na2(H2O)2]{(Mg4.5Fe0.5)(PO4)4(H2O)5}, a new mineral species of |
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hydrothermal origin from the Kovdor phoscorite - carbonatite complex, Russia |
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Locality: Kovdor phoscorite - carbonatite complex, Russia |
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_database_code_amcsd 0005687 |
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8.3086 12.906 17.486 90 102.01 90 P2_1/c |
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atom x y z occ Uiso |
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Mg1 -.13637 -.07430 .44872 .767 .0067 |
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Fe1 -.13637 -.07430 .44872 .233 .0067 |
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Mg2 .21678 -.08847 .26602 .883 .0062 |
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Fe2 .21678 -.08847 .26602 .117 .0062 |
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Mg3 .31471 .17700 .26855 .910 .0060 |
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Fe3 .31471 .17700 .26855 .090 .0060 |
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Mg4 .30351 -.31843 .25206 .943 .0054 |
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Fe4 .30351 -.31843 .25206 .057 .0054 |
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Mg5 -.18402 -.09404 .24526 .969 .0058 |
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Fe5 -.18402 -.09404 .24526 .031 .0058 |
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P1 .04373 .07984 .35341 .0049 |
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P2 .03566 -.25540 .35853 .0051 |
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P3 .55106 .34764 .36123 .0079 |
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P4 -.42473 .00711 .35771 .0066 |
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Na1 .16505 .70359 .05837 .0221 |
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Na2 -.40446 .14046 .53562 .0304 |
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O1 .02926 -.18673 .42911 .0102 |
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O2 -.34867 .03660 .44224 .0131 |
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O3 .02394 .04749 .43601 .0074 |
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O4 -.28976 -.06189 .33479 .0103 |
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O5 .55835 .46566 .37550 .0108 |
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O6 .02633 -.01600 .30043 .0068 |
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O7 .18998 -.22723 .32508 .0076 |
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O8 .59606 .29045 .43881 .0142 |
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O9 .67195 .32070 .30722 .0085 |
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O10 .04596 -.37083 .38160 .0084 |
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O11 -.58065 -.05757 .34911 .0126 |
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O12 -.45943 .10304 .30425 .0078 |
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O13 -.11993 -.23818 .29423 .0075 |
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O14 .37649 .31992 .31694 .0077 |
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O15 -.09132 .15944 .32326 .0075 |
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O16 .21202 .13008 .35773 .0083 |
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OW1 .23229 .04585 .19733 .0079 |
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H1 .295 .025 .168 .028 |
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H2 .141 .066 .170 .028 |
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OW2 -.01579 -.13758 .17512 .0093 |
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H3 .012 -.203 .178 .026 |
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H4 -.023 -.116 .129 .026 |
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OW3 .45950 .22384 .17696 .0099 |
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H5 .450 .193 .133 .036 |
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H6 .444 .288 .169 .036 |
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OW4 .26955 -.45535 .31726 .0081 |
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H7 .206 -.428 .344 .037 |
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H8 .361 -.480 .341 .037 |
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OW5 .29515 .17696 .50720 .0164 |
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H9 .300 .242 .512 .041 |
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H10 .288 .167 .458 .041 |
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OW6 .58900 .62982 .46553 .0268 |
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H11 .524 .651 .494 .059 |
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H12 .568 .568 .449 .059 |
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H13 .665 .600 .498 .059 |
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OW7a -.0410 .8835 .0259 .43 .0286 |
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H14 .018 .887 -.012 .069 |
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OW7b .0697 .8956 .0370 .57 .0286 |
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H15 -.139 .903 .008 .43 .069 |
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H16 .167 .920 .047 .57 .069 |
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Cerite-(La) |
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Pakhomovsky Y A, Men'shikov Y P, Yakovenchuk V N, Ivanyuk G Y, |
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Krivovichev S V, Burns P C |
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The Canadian Mineralogist 40 (2002) 1177-1184 |
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Cerite-(La), (La,Ce,Ca)9(Fe,Ca,Mg)(SiO4)3[SiO3(OH)]4(OH)3, a new mineral |
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from the Khibiny Alkaline Massif: Occurrence and crystal structure |
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Locality: Khibina alkaline massif, Kola Peninsula, Russia |
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_database_code_amcsd 0005786 |
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10.7493 10.7493 38.318 90 90 120 R3c |
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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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La(1) .25867 .13428 .068094 .47 .0139 .0160 .0150 .0120 .0086 .0000 -.0009 |
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Ce(1) .25867 .13428 .068094 .29 .0139 .0160 .0150 .0120 .0086 .0000 -.0009 |
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Ca(1) .25867 .13428 .068094 .15 .0139 .0160 .0150 .0120 .0086 .0000 -.0009 |
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Sr(1) .25867 .13428 .068094 .04 .0139 .0160 .0150 .0120 .0086 .0000 -.0009 |
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Nd(1) .25867 .13428 .068094 .02 .0139 .0160 .0150 .0120 .0086 .0000 -.0009 |
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Pr(1) .25867 .13428 .068094 .01 .0139 .0160 .0150 .0120 .0086 .0000 -.0009 |
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La(2) .14209 .26126 .43210 .47 .0195 .0164 .0269 .0183 .0131 .0036 .0087 |
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Ce(2) .14209 .26126 .43210 .29 .0195 .0164 .0269 .0183 .0131 .0036 .0087 |
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Ca(2) .14209 .26126 .43210 .15 .0195 .0164 .0269 .0183 .0131 .0036 .0087 |
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Sr(2) .14209 .26126 .43210 .04 .0195 .0164 .0269 .0183 .0131 .0036 .0087 |
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Nd(2) .14209 .26126 .43210 .02 .0195 .0164 .0269 .0183 .0131 .0036 .0087 |
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Pr(2) .14209 .26126 .43210 .01 .0195 .0164 .0269 .0183 .0131 .0036 .0087 |
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La(3) .25878 .13436 .17585 .47 .0187 .0229 .0184 .0184 .0130 -.0045 -.0048 |
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Ce(3) .25878 .13436 .17585 .29 .0187 .0229 .0184 .0184 .0130 -.0045 -.0048 |
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Ca(3) .25878 .13436 .17585 .15 .0187 .0229 .0184 .0184 .0130 -.0045 -.0048 |
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Sr(3) .25878 .13436 .17585 .04 .0187 .0229 .0184 .0184 .0130 -.0045 -.0048 |
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Nd(3) .25878 .13436 .17585 .02 .0187 .0229 .0184 .0184 .0130 -.0045 -.0048 |
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Pr(3) .25878 .13436 .17585 .01 .0187 .0229 .0184 .0184 .0130 -.0045 -.0048 |
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Si(1) .3184 .1485 .36239 .0129 .0073 .0160 .0140 .0051 -.0002 .0001 |
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O(1) .2562 .0915 .3228 .0330 .0280 .0560 .0110 .0180 -.0040 -.0120 |
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O(2) .2781 .0026 .3850 .0160 .0120 .0160 .0190 .0060 .0040 .0020 |
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O(3) .2625 .2513 .3784 .0200 .0150 .0200 .0220 .0060 .0070 .0050 |
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O(4) .0817 .1730 .0295 .0167 .0160 .0160 .0230 .0110 .0000 -.0030 |
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Si(2) .1504 .3257 .13689 .0173 .0150 .0234 .0126 .0089 -.0003 .0005 |
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O(5) .2448 .2711 .1162 .0240 .0220 .0310 .0220 .0150 .0010 -.0100 |
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O(6) -.0105 .2701 .1224 .0210 .0240 .0250 .0130 .0110 -.0030 .0000 |
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O(7) .1668 .0742 .4664 .0168 .0140 .0160 .0200 .0080 .0010 .0010 |
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O(8) .1375 .2815 .1782 .0212 .0240 .0230 .0120 .0080 -.0030 .0000 |
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FeM 0 0 -.00168 .32 .0137 .0135 .0135 .0140 .0068 0 0 |
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CaM 0 0 -.00168 .30 .0137 .0135 .0135 .0140 .0068 0 0 |
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MgM 0 0 -.00168 .23 .0137 .0135 .0135 .0140 .0068 0 0 |
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Si(3) 0 0 .2520 .90 .0125 .0111 .0111 .0150 .0055 0 0 |
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O(9) .1597 .0338 .2400 .0300 .0180 .0420 .0310 .0160 -.0040 -.0110 |
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OH(10) 0 0 .2961 .0100 |
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OH(11) 0 0 .0897 .0160 .0700 .0070 .0330 .0040 0 0 |
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OH(12) 0 0 .1600 .0210 .0120 .0120 .0390 .0060 0 0 |
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OH(13) 0 0 .4090 .0350 .0290 .0290 .0450 .0150 0 0 |
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Ca 0 0 .3092 .10 .0100 |
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Chlorbartonite |
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Yakovenchuk V N, Pakhomovsky Y A, Men'shikov Y P, Ivanyuk G Y, |
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Krivovichev S V, Burns P C |
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The Canadian Mineralogist 41 (2003) 503-511 |
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Chlorbartonite, K6Fe24S26(Cl,S), a new mineral species from a hydrothermal |
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vein in the Khibina Massif, Kola Peninsula, Russia: Description and |
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crystal structure |
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Locality: Khibina Massif, Kola Peninsula, Russia |
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_database_code_amcsd 0005834 |
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10.3810 10.3810 20.614 90 90 90 I4/mmm |
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atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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K1 .29581 0 0 .0233 .021 .026 .023 0 0 0 |
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K2 0 0 .15318 .0235 .0241 .0241 .022 0 0 0 |
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Fe1 .13076 .36801 .18394 .0159 .0174 .0161 .0143 .0000 -.0004 -.0005 |
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Fe2 .36856 .36856 .06625 .0161 .0160 .0160 .0164 -.0001 -.0001 -.0001 |
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S1 .22763 .22763 .11387 .0160 .0162 .0162 .0154 .0009 .0011 .0011 |
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S2 0 .24716 .25142 .0158 .0166 .0164 .0146 0 0 -.0006 |
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S3 .24677 1/2 0 .0157 .016 .017 .014 0 0 0 |
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S4 0 1/2 .12252 .0158 .016 .016 .015 0 0 0 |
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S5 0 0 .37261 .0161 .0170 .0170 .014 0 0 0 |
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Cl 0 0 0 .0217 .021 .021 .024 0 0 0 |
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Strontiofluorite |
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Yakovenchuk V N, Ivanyuk G Y, Pakhomovsky Y A, |
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Selivanova E A, Korchak J A, Nikolaev A P |
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The Canadian Mineralogist 48 (2010) 1487-1492 |
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Strontiofluorite, SrF2, a new mineral species from |
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the Khibiny Massif, Kola Peninsula, Russia |
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Locality: Khibiny Massif, Kola Peninsula, Russia |
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_database_code_amcsd 0018325 |
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5.713 5.713 5.713 90 90 90 Fm3m |
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atom x y z |
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Sr 0 0 0 |
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F .25 .25 .25 |
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| Download AMC data (View Text File)
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Ellingsenite |
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Yakovenchuk V N, Ivanyuk G Y, Pakhomovsky Y A, Selivanova E A, Mikhailova J A, |
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Krivovichev S V, Zolotarev A A, Zalkind O A |
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The Canadian Mineralogist 49 (2011) 1165-1173 |
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Ellingsenite, Na5Ca6Si18O38(OH)13*6H2O, a new martinite-related mineral species |
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from phonolite of the Aris alkaline complex, Namibia |
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Locality: Ariskop quarry, Aris alkaline complex, Namibia |
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Note: This is reported as an incomplete structure |
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_database_code_amcsd 0018739 |
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9.576 9.577 16.438 85.85 75.23 60.142 P-1 |
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atom x y z occ Uiso |
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Na1 .5 0 .5 .021 |
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Na2 .8448 -.2128 .7107 .86 .017 |
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Ca1 .3564 -.2907 -.5025 .0152 |
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Ca2 .0818 -.8582 -.5130 .0125 |
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Ca3 .7756 -.4159 -.4942 .55 .018 |
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Na3 .7756 -.4159 -.4942 .45 .018 |
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Si1 .4595 -.4440 -.2301 .0166 |
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Si2 .8056 -.6630 -.3328 .0125 |
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Si3 .2987 .4577 -.3268 .0139 |
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Si4 .0501 -.0324 -.3309 .0114 |
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Si5 .9247 -.4153 -.3246 .0147 |
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Si6 .4183 -.1603 -.3312 .0128 |
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Si7 .5453 .0888 -.3254 .0135 |
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Si8 .7899 -.1100 -.2225 .0161 |
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O1 .085 -.0778 -.4272 .015 |
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O2 .930 -.365 -.4182 .033 |
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O3 .664 .067 -.4171 .019 |
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O4 .370 .479 -.4222 .021 |
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O5 .815 -.6616 -.4293 .015 |
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O6 .7816 -.1980 -.5624 .013 |
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O7 .392 .271 -.3022 .021 |
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O8 .757 -.091 -.1237 .042 |
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O9 .870 -.550 -.3030 .021 |
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O10 .932 -.841 -.3092 .018 |
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O11 .638 .044 -.2506 .018 |
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O12 .109 .496 -.3075 .021 |
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O13 .495 -.231 -.4249 .017 |
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O14 .308 -.438 -.2593 .019 |
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O15 .963 -.121 -.2697 .020 |
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O16 .625 -.606 -.2730 .023 |
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O17 .454 -.018 -.3154 .018 |
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O18 .214 -.072 -.3035 .019 |
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O19 .482 -.291 -.2622 .020 |
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O20 .802 -.272 -.2505 .023 |
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O21 .421 -.440 -.1317 .041 |
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Wat22 .385 .084 -.187 .25 .05 |
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Wat23 .915 -.222 -.857 .73 .05 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
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Punkaruaivite |
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Yakovenchuk V N, Ivanyuk G Y, Pakhomovsky Y A, Selivanova E A, Men'shikov Y P, |
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Korchak J A, Krivovichev S V, Spiridonova D V, Zalkind O A |
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The Canadian Mineralogist 48 (2010) 41-50 |
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Punkaruaivite, LiTi2[Si4O11(OH)]2*H2O, a new mineral species from hydrothermal |
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assemblages, Khibiny and Lovozero alkaline massifs, Kola Peninsula, Russia |
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Locality: Khibiny and Lovozero alkaline massifs, Kola Peninsula, Russia |
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_database_code_amcsd 0006314 |
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26.688 8.7568 5.2188 90 91.189 90 C2/c |
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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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Li 0 .518 .25 .090 .0158 .0153 .0131 .0005 .0002 .0035 |
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Ti .16618 .10480 .8920 .0147 |
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Si1 .08868 .6008 .5131 .0492 .0467 .0424 .058 -.0087 .0012 .0025 |
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Si2 .26853 .08447 .2283 .0110 .0147 .0107 .0077 -.0009 00009 .0002 |
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O1 .20759 .0690 .2160 .0124 .015 .0130 00099 -.0003 .0011 .0012 |
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OH2 .12949 .0614 .5811 .0180 .018 .020 .016 .0024 -.0013 -.0047 |
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O3 .28699 .2594 .2216 .0166 .023 .014 .013 -.0027 -.0006 .0013 |
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O4 .29072 -.0061 -.0141 .0147 .016 .019 .0093 .0010 .0012 -.0036 |
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O5 .1214 .7493 .5087 .0289 .030 .025 .032 -.006 .007 .006 |
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O6 .0314 .6339 .507 .5 .112 .048 .092 .196 -.009 .018 -.002 |
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Wat6 .0314 .6339 .507 .5 .112 .048 .092 .196 -.009 .018 -.002 |
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O7 .1012 .5048 .767 .101 .112 .089 .104 .005 .015 .049 |
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Wat8 .0323 .109 .520 .5 .141 |
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| Download AMC data (View Text File)
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Lamprophyllite |
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Krivovichev S V, Armbruster T, Yakovenchuk V N, Pakhomovsky Y A, Men'shikov Y P |
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European Journal of Mineralogy 15 (2003) 711-718 |
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Crystal structures of lamprophyllite-2M and lamprophyllite-2O |
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from the Lovozero alkaline massif, Kola peninsula, Russia |
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Note: displacement factors have been altered by Krivovichev, November 2003 |
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Locality: Lovozero alkaline massif, Kola peninsula, Russia |
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_database_code_amcsd 0007012 |
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19.215 7.061 5.3719 90 96.797 90 C2/m |
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atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Ti(1) .15057 0 .70775 .0056 .0074 .0046 .0045 0 0 0 |
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Ti(2) 0 1/2 0 .0246 .0288 .0050 .0339 0 -.0222 0 |
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Si .14390 .28459 .2049 .0078 .0103 .0051 .0078 .0010 0 .0004 |
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Na(1) 0 .2590 1/2 .0102 .0146 .0077 .0085 0 .0027 0 |
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Na(2) 0 0 0 .0174 .0190 .0170 .0172 0 .0062 0 |
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Sr .28418 0 .26213 .0153 .0214 .0128 .0116 0 .0009 0 |
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O(1) .4425 0 .2758 .0169 .0160 .0140 .0220 0 .0050 0 |
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O(2) .17480 .1889 .4674 .0155 .0155 .0158 .0146 -.0028 -.0005 .0061 |
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O(3) .17532 .1875 .9712 .0143 .0127 .0138 .0166 -.0021 .0028 -.0054 |
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O(4) .1777 .5000 .2200 .0113 .0130 .0050 .0150 0 -.0013 0 |
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O(5) .05951 .2965 .1725 .0127 .0092 .0087 .0198 .0005 -.0001 -.0018 |
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O(6) .0623 0 .6677 .0200 .0120 .0350 .0130 0 .0002 0 |
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|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
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Lamprophyllite |
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Krivovichev S V, Armbruster T, Yakovenchuk V N, Pakhomovsky Y A, Men'shikov Y P |
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European Journal of Mineralogy 15 (2003) 711-718 |
|
Crystal structures of lamprophyllite-2M and lamprophyllite-2O |
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from the Lovozero alkaline massif, Kola peninsula, Russia |
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Note: displacement factors have been altered by Krivovichev, November 2003 |
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Locality: Lovozero alkaline massif, Kola peninsula, Russia |
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_database_code_amcsd 0007013 |
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19.128 7.0799 5.3824 90 90 90 Pnmn |
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atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Ti1 .34914 0 .1442 .0027 .0010 .0023 .0048 0 .0002 0 |
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Ti2 0 0 0 .0254 .0240 .0054 .0470 0 -.0280 0 |
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Si .14413 .2161 .1440 .0041 |
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Na1 .5 .2588 0 .0085 .0090 .0050 .0120 0 -.0024 0 |
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Na2 .5 0 .5 .0110 .0120 .0080 .0130 0 -.0050 0 |
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Sr .21584 0 .6453 .0126 .0135 .0097 .0145 0 -.0001 0 |
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OH1 .0570 0 .702 .0190 |
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O2 .3239 .1864 .3952 .0110 |
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O3 .3250 .1867 .8900 .0097 |
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O4 .1777 0 .1448 .0050 |
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O5 .0593 .2044 .1478 .0102 |
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O6 .4376 0 .141 .0190 |
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|
| Download AMC data (View Text File)
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Clinobarylite |
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Krivovichev S V, Yakovenchuk V N, Armbruster T, Mikhailova Y, Pakhomovsky Y A |
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Neues Jahrbuch fur Mineralogie, Monatshefte 2004 (2004) 373-384 |
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Clinobarylite, BaBe2Si2O7: Structure refinement, and revision of symmetry and |
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physical properties |
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Locality: Khibina alkaline massif, Kola Peninsula, Russia |
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_database_code_amcsd 0014931 |
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11.650 4.922 4.674 90 90 90 Pmn2_1 |
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atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Ba .5 .2027 .5079 .0127 .01354 .01192 .01256 -.0002 0 0 |
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Be .75195 .1671 -.0147 .0067 |
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Si .6282 .67564 -.0141 .0064 .0044 .00579 .00900 -.0033 .0024 -.0010 |
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O1 .63911 .3521 -.9436 .0044 |
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O2 .77733 .1340 -.3534 .0072 |
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O3 .5 .7741 -.0767 .0144 |
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O4 .63300 .7324 -.3550 .0091 |
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Kuliokite-(Y) |
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Sokolova E V, Egorov-Tismenko Y K, Voloshin A V, Pakhomovsky Y A |
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Soviet Physics Doklady 31 (1986) 601-603 |
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Crystal structure of the new Y-Al silicate kuliokite-(Y), Y4Al[SiO4]2(OH)2F5 |
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Locality: Kola Peninsula, Russia |
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_database_code_amcsd 0015613 |
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8.606 8.672 4.317 102.79 97.94 116.66 P1 |
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atom x y z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Y1 .2938 .4489 .3180 .61 .004565 .001855 .013713 .001841 .003336 .004203 |
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Y2 .2614 .8030 .9857 .64 .004109 .002783 .015237 .002301 .003336 .005884 |
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Y3 .7405 .5424 .7237 .45 .003652 .002319 .013713 .002301 .005004 .005044 |
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Y4 .7098 .1575 .0266 .46 .004565 .003246 .013713 .002301 .005004 .005044 |
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Al 0 0 0 .1 .001370 .001391 .001524 -.000460 .002502 .003362 |
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Si1 .691 .842 .352 .3 .002283 .005101 .031998 .005522 .012511 .016812 |
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Si2 .311 .150 .660 .2 .000913 .000464 .007619 -.000920 -.003336 -.004203 |
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O2 .421 .064 .843 .5 .002739 .004638 .010666 -.000920 .000000 .007566 |
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O4 .562 .898 .168 1.0 .002283 .003246 .021332 -.003681 .001668 .005884 |
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O5 .814 .003 .705 .6 .004109 .004174 .024379 .001380 .002502 .008406 |
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O6 .185 .190 .899 .5 .005022 .004174 .010666 .003221 .012511 .006725 |
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O7 .440 .343 .623 .5 .005935 .002319 .012190 -.004141 -.002502 .010928 |
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O8 .820 .818 .121 .5 .002739 .000928 .048759 .001841 .015013 .002522 |
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O9 .182 .002 .315 .4 .002283 .001391 .003047 -.003681 -.008340 -.006725 |
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O10 .580 .644 .435 .4 .003652 .003246 .010666 .002761 .006672 .010087 |
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OH1 .002 .808 .704 .4 .004565 .002783 .018285 -.004601 -.002502 .000000 |
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OH3 .007 .213 .298 .5 .003652 .004174 .022856 .002301 .012511 .001681 |
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F1 .732 .436 .170 .7 .011413 .001855 .007619 .003221 .001668 -.004203 |
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F2 .261 .704 .461 .6 .005022 .002783 .025903 .005522 .007506 .010928 |
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F3 .277 .532 .848 1.0 .003196 .006956 .018285 -.000920 -.005838 .008406 |
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F4 .716 .249 .572 .7 .005935 .006493 .009142 .004601 .010843 .006725 |
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F5 .001 .558 .910 2.0 .006391 .005565 .068567 -.003681 .003336 .023537 |
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Keiviite-(Yb) |
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Yakubovich O V, Simonov M A, Voloshin A V, Pakhomovsky Y A |
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Soviet Physics Doklady 31 (1986) 930-932 |
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Crystal structure of keivite Yb2[Si2O7] |
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Locality: Kola Peninsula, Russia |
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_database_code_amcsd 0015614 |
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4.715 8.870 6.805 90 102.01 90 A2/m |
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atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Yb 0 .80653 .5 .71 .53 .007523 .001938 .003442 0 .001059 0 |
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Lu 0 .80653 .5 .11 .53 .007523 .001938 .003442 0 .001059 0 |
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Er 0 .80653 .5 .08 .53 .007523 .001938 .003442 0 .001059 0 |
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Tm 0 .80653 .5 .04 .53 .007523 .001938 .003442 0 .001059 0 |
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Y 0 .80653 .5 .03 .53 .007523 .001938 .003442 0 .001059 0 |
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Dy 0 .80653 .5 .02 .53 .007523 .001938 .003442 0 .001059 0 |
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Ho 0 .80653 .5 .01 .53 .007523 .001938 .003442 0 .001059 0 |
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Si .4127 .5 .7188 .76 .007875 .002320 .005079 0 .003095 0 |
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O1 .5 .5 .5 1.5 .018807 .006673 .003386 0 .002443 0 |
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O2 .716 .5 .881 .9 .011754 .002224 .006772 0 .003258 0 |
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O3 .220 .6506 .735 1.1 .015281 .002542 .007900 .001833 .004887 .000423 |
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Ewaldite |
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Voloshin A V, Subbotin V V, Yakovenchuk V N, Pakhomovsky Y A, |
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Men'shikov Y P, Nadezhina T N, Pushcharovsky D Y |
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Zapiski Vsesoyuznogo Mineralogicheskogo Obshchestva 1992 (1992) 56-66 |
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New data on the ewaldite |
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_database_code_amcsd 0015721 |
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5.318 5.318 12.837 90 90 120 P6_3mc |
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atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Ba 1/3 2/3 0 .008250 .008250 .002124 .004125 0 0 |
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Ca 1/3 2/3 .3045 .007543 .007543 .001062 .003772 0 0 |
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C 0 0 .427 .007190 .007190 .002124 .003654 0 0 |
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O1 .139 -.139 .426 .007425 .007425 .005765 .009429 .000423 -.000423 |
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O2 .292 .081 .665 .19 4.2 |
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O3 .532 .062 .151 .12 2.6 |
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O4 .603 .212 .277 .24 2.0 |
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O5 .231 .466 .703 .07 4.9 |
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