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Clinoptilolite-Ca |
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Koyama K, Takeuchi Y |
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Zeitschrift fur Kristallographie 145 (1977) 216-239 |
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Clinoptilolite: The distribution of potassium atoms |
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and its role in thermal stability |
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Locality: Kuruma Pass, Fukushima Prefecture, Japan |
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Note: z(Wat7) corrected |
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_database_code_amcsd 0010792 |
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17.6600 17.963 7.400 90 116.47 90 C2/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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Na1 .1427 0 .667 .36 .0042 .0012 .0259 0 .0033 0 |
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Ca1 .1427 0 .667 .24 .0042 .0012 .0259 0 .0033 0 |
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Na2 .0392 .5 .208 .20 .0012 .0022 .0322 0 .0011 0 |
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Ca2 .0392 .5 .208 .26 .0012 .0022 .0322 0 .0011 0 |
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K3 .2562 .5 .084 .37 .0038 .0005 .0257 0 .0051 0 |
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Mg4 0 0 .5 .04 18.6 |
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Si1 .1792 .1695 .0942 .80 .00042 .00121 .0120 -.00003 .0010 .0003 |
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Al1 .1792 .1695 .0942 .20 .00042 .00121 .0120 -.00003 .0010 .0003 |
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Si2 .2122 .4107 .5029 .58 .00083 .00089 .0126 .0 .0015 .0002 |
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Al2 .2122 .4107 .5029 .42 .00083 .00089 .0126 .0 .0015 .0002 |
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Si3 .2084 .1911 .7145 .91 .00063 .00100 .0113 .00004 .0013 .0 |
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Al3 .2084 .1911 .7145 .09 .00063 .00100 .0113 .00004 .0013 .0 |
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Si4 .0656 .2986 .4134 .94 .00050 .00109 .0102 -.00012 .0008 -.0001 |
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Al4 .0656 .2986 .4134 .06 .00050 .00109 .0102 -.00012 .0008 -.0001 |
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Si5 0 .2156 0 .86 .00060 .00111 .0114 0 .0012 0 |
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Al5 0 .2156 0 .14 .00060 .00111 .0114 0 .0012 0 |
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O1 .1975 .5 .4564 .0029 .0014 .0185 0 .0030 0 |
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O2 .2329 .1224 .6109 .0026 .0020 .0203 -.0001 .0047 -.0019 |
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O3 .1835 .1560 .8810 .0028 .0020 .0169 -.0003 .0040 .0001 |
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O4 .2357 .1056 .2489 .0022 .0021 .0148 .0011 .0021 .0022 |
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O5 0 .3214 .5 .0031 .0024 .0222 0 .0065 0 |
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O6 .0815 .1614 .0588 .0008 .0016 .0212 .0001 .0022 .0004 |
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O7 .1273 .2331 .5461 .0025 .0024 .0174 .0009 .0005 .0025 |
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O8 .0117 .2688 .1854 .0018 .0024 .0111 .0 -.0003 -.0026 |
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O9 .2126 .2525 .1837 .0014 .0019 .0200 -.0006 .0022 -.0017 |
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O10 .1160 .3720 .4108 .0015 .0018 .0233 -.0008 .0021 -.0003 |
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Wat1 .218 .5 -.005 .75 4.4 |
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Wat2 .087 0 .897 .45 8.8 |
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Wat3 .0787 .4198 .964 8.1 |
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Wat4 0 .5 .5 7.0 |
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Wat5 0 .088 .5 .74 16.4 |
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Wat6 .083 0 .267 .91 17.7 |
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Wat7 .094 0 .740 .34 17.5 |
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Clinoptilolite-Ca |
| |
Koyama K, Takeuchi Y |
|
Zeitschrift fur Kristallographie 145 (1977) 216-239 |
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Clinoptilolite: The distribution of potassium atoms |
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and its role in thermal stability |
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Locality: Agoura, California, USA |
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Note: z(O3) corrected |
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_database_code_amcsd 0010793 |
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17.6620 17.911 7.407 90 116.40 90 C2/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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Na1 .1428 0 .667 .36 .0083 .0015 .0358 0 .0079 0 |
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Ca1 .1428 0 .667 .06 .0083 .0015 .0358 0 .0079 0 |
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Na2 .0393 .5 .210 .10 .0020 .0019 .0235 0 .0015 0 |
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Ca2 .0393 .5 .210 .25 .0020 .0019 .0235 0 .0015 0 |
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K3 .2413 .5 .049 .44 .0085 .0019 .0395 0 .0138 0 |
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Mg4 0 0 .5 .10 1.1 |
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Si1 .17906 .16943 .0963 .83 .00106 .00103 .0060 .00001 .00160 .00032 |
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Al1 .17906 .16943 .0963 .17 .00106 .00103 .0060 .00001 .00160 .00032 |
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Si2 .21334 .41099 .5040 .69 .00126 .00073 .0070 .00003 .00162 .00008 |
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Al2 .21334 .41099 .5040 .31 .00126 .00073 .0070 .00003 .00162 .00008 |
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Si3 .20846 .19034 .7153 .87 .00122 .00087 .0055 .00007 .00176 .00005 |
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Al3 .20846 .19034 .7153 .13 .00122 .00087 .0055 .00007 .00176 .00005 |
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Si4 .06623 .29837 .4148 .89 .00108 .00100 .0061 -.00015 .00152 -.00002 |
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Al4 .06623 .29837 .4148 .11 .00108 .00100 .0061 -.00015 .00152 -.00002 |
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Si5 0 .21651 0 .90 .00113 .00101 .0058 0 .0014 0 |
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Al5 0 .21651 0 .10 .00113 .00101 .0058 0 .0014 0 |
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O1 .1959 .5 .4574 .0032 .0011 .0146 0 .0031 0 |
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O2 .2336 .1204 .6144 .0032 .0018 .0165 .0 .0054 -.0012 |
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O3 .1850 .1551 .8859 .0041 .0019 .0133 -.0002 .0055 .0002 |
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O4 .2333 .1041 .2509 .0027 .0020 .0092 .0008 .0018 .0005 |
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O5 0 .3232 .5 .0030 .0024 .0169 0 .0056 0 |
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O6 .0808 .1627 .0555 .0014 .0015 .0152 .0 .0024 .0001 |
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O7 .1268 .2317 .5492 .0030 .0021 .0159 .0010 .0017 .0024 |
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O8 .0122 .2702 .1856 .0022 .0023 .0103 .0001 .0011 -.0021 |
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O9 .2123 .2520 .1860 .0017 .0016 .0178 -.0006 .0025 -.0018 |
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O10 .1188 .3718 .4148 .0022 .0016 .0176 -.0006 .0030 -.0001 |
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Wat1 .211 .5 -.033 .38 6.2 |
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Wat2 .084 0 .888 .44 14.6 |
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Wat3 .0777 .4206 .964 9.5 |
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Wat4 0 .5 .5 7.4 |
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Wat5 0 .095 .5 .76 22.1 |
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Wat6 .073 0 .249 .83 19.1 |
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Wat7 .096 0 .756 .42 10.2 |
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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
|
| |
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