American Mineralogist Crystal Structure Database

8 matching records for this search.

Clinoptilolite-Ca
 
Smyth J R, Spaid A T, Bish D L
Download am/vol75/AM75_522.pdf
American Mineralogist 75 (1990) 522-528
Crystal structures of a natural and a Cs-exchanged clinoptilolite
natural sample
_database_code_amcsd 0001304
17.633 17.941 7.400 90 116.39 90 C2/m
atom     x     y     z occ B(1,1) B(2,2) B(3,3)  B(1,2) B(1,3) B(2,3)
Si1  .1789 .1705 .0953 .87 .00062 .00104  .0070 -.00004 .00063 .00018
Al1  .1789 .1705 .0953 .13 .00062 .00104  .0070 -.00004 .00063 .00018
Si2  .2131 .4104 .5030 .67 .00092 .00072  .0081  .00006 .00087 .00003
Al2  .2131 .4104 .5030 .33 .00092 .00072  .0081  .00006 .00087 .00003
Si3  .2080 .1907 .7152 .90 .00087 .00093  .0067  .00002 .00081 .00007
Al3  .2080 .1907 .7152 .10 .00087 .00093  .0067  .00002 .00081 .00007
Si4  .0654 .2989 .4129 .92 .00065 .00103  .0071  .00000 .00066  .0001
Al4  .0654 .2989 .4129 .08 .00065 .00103  .0071  .00000 .00066  .0001
Si5      0 .2160     0 .91 .00045 .00116  .0072       0  .0003      0
Al5      0 .2160     0 .09 .00045 .00116  .0072       0  .0003      0
Na1  .1478     0 .6661  .5  .0075  .0027  .0320       0  .0052      0
Ca1  .1478     0 .6661  .5  .0075  .0027  .0320       0  .0052      0
Na2  .0404    .5 .2167 .39  .0015  .0022  .0293       0 -.0004      0
Ca2  .0404    .5 .2167 .39  .0015  .0022  .0293       0 -.0004      0
K3   .2344    .5 .0252 .64  .0116  .0037  .0780       0  .0218      0
O1   .1973    .5 .4571      .0029  .0008  .0180       0  .0018      0
O2   .2320 .1212 .6138      .0022  .0020  .0159  -.0003  .0033 -.0019
O3   .1835 .1565 .8859      .0029  .0021  .0138  -.0003  .0029 -.0001
O4   .2356 .1065 .2518      .0022  .0018  .0146   .0007  .0024  .0004
O5       0 .3245    .5      .0026  .0024  .0212       0  .0048      0
O6   .0811 .1614 .0570      .0009  .0015  .0187  -.0001  .0017 -.0001
O7   .1274 .2343 .5484      .0025  .0025  .0163   .0007  .0001  .0015
O8   .0110 .2682 .1857      .0017  .0026  .0148   .0002  .0015 -.0017
O9   .2119 .2534 .1830      .0015  .0015  .0199  -.0005  .0023 -.0014
O10  .1174 .3723 .4079      .0016  .0016  .0200  -.0005  .0026 -.0002
Wat2 .0798     0 .8531 .98  .0158  .0105  .2570       0 -.0037      0
Wat3 .0798 .4190 .9655 .89  .0060  .0045  .0385  -.0007 -.0006  .0032
Wat4     0    .5    .5      .0058  .0035  .0562       0  .0082      0
Wat5 .0202 .0901  .525 .36  .0042  .0067  .1480  -.0022 -.0008  .0126
Wat6 .0865     0 .2654 .81  .0085  .0090  .1010       0  .0159      0
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Clinoptilolite-Ca
 
Armbruster T
Download am/vol78/AM78_260.pdf
American Mineralogist 78 (1993) 260-264
Dehydration mechanism of clinoptilolite and heulandite: Single-crystal X-ray
study of Na-poor, Ca-, K-, Mg-rich clinoptilolite at 100 K
Sample Natural
Data obtained from the ICSD
_database_code_amcsd 0001547
17.622 17.895 7.399 90 116.45 90 C2/m
atom     x     y      z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Si1  .1793 .1696  .0977   .8       .0096  .0149  .0100 -.0004  .0047  .0011
Al1  .1793 .1696  .0977   .2       .0096  .0149  .0100 -.0004  .0047  .0011
Si2  .2861 .0893  .4979   .7       .0123  .0101  .0124  .0005  .0057  .0002
Al2  .2861 .0893  .4979   .3       .0123  .0101  .0124  .0005  .0057  .0002
Si3  .2937 .3094  .2856  .83       .0120  .0135  .0094  .0002  .0058  .0003
Al3  .2937 .3094  .2856  .17       .0120  .0135  .0094  .0002  .0058  .0003
Si4  .0648 .3001  .4124  .84       .0110  .0143  .0105 -.0005  .0051  .0002
Al4  .0648 .3001  .4124  .16       .0110  .0143  .0105 -.0005  .0051  .0002
Si5      0 .2171      0  .92       .0098  .0143  .0109      0  .0042      0
Al5      0 .2171      0  .08       .0098  .0143  .0109      0  .0042      0
O1   .3022     0  .5447            .0300  .0150  .0230      0  .0090      0
O2   .2301 .1210  .6097            .0320  .0270  .0320 -.0040  .0220 -.0080
O3   .1827 .1546 -.1150            .0390  .0280  .0220 -.0040  .0210  .0000
O4   .2354 .1046  .2532            .0240  .0260  .0190  .0090  .0050  .0010
O5       0 .3282     .5            .0330  .0290  .0310      0  .0240      0
O6   .0815 .1627  .0633            .0150  .0200  .0270 -.0010  .0080  .0010
O7   .3764 .2670  .4520            .0290  .0340  .0300  .0110  .0050  .0100
O8   .0084 .2704  .1834       .05  .0250  .0320  .0220  .0010  .0080 -.0110
O9   .2140 .2525  .1842       .10  .0190  .0210  .0300 -.0060  .0130 -.0080
O10  .1193 .3723  .4063            .0220  .0230  .0320 -.0070  .0120 -.0020
Na   .1422     0  .6746  .48       .0330  .0140  .0360      0  .0100      0
Ca   .4584     0  .8011 .392       .0210  .0260  .0400      0  .0060      0
Ba    .248    .5   .055  .08       .0900  .0200  .0700      0  .0600      0
K     .248    .5   .055  .14       .0900  .0200  .0700      0  .0600      0
Mg       0     0     .5  .36       .0280  .0150  .0640      0  .0080      0
OH11  .711     0   .973   .3       .0400  .1100  .0500      0  .0100      0
OH12  .096     0   .784            .1400  .0730  .9200      0 -.1400      0
OH13 .4198 .9189  .0348            .0770  .0530  .0750  .0060  .0150 -.0020
OH14     0    .5     .5            .0780  .0380  .1330      0  .0480      0
OH15 -.007 .1014   .573  .41       .0800  .0900  .1300      0  .0400      0
OH16  .044     0   .080  .53       .4300  .0300  .8000      0  .5700      0
OH17   .44  .466   .686   .3       .3200  .2400  .2800 -.1600  .0600  .1000
OH18  .101     0   .112  .19
OH19  .363     0   .192  .16
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Clinoptilolite-Ca
 
Armbruster T
Download am/vol78/AM78_260.pdf
American Mineralogist 78 (1993) 260-264
Dehydration mechanism of clinoptilolite and heulandite: Single-crystal X-ray
study of Na-poor, Ca-, K-, Mg-rich clinoptilolite at 100 K
Sample Dehyd 1
Data obtained from the ICSD
_database_code_amcsd 0001548
17.588 17.572 7.389 90 116.77 90 C2/m
atom     x     y      z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Si1  .1803 .1655  .0958   .8       .0133  .0287  .0182 -.0025  .0085  .0012
Al1  .1803 .1655  .0958   .2       .0133  .0287  .0182 -.0025  .0085  .0012
Si2  .2941 .0896   .506   .7       .0232  .0185  .0221 -.0006  .0126  .0001
Al2  .2941 .0896   .506   .3       .0232  .0185  .0221 -.0006  .0126  .0001
Si3  .2879 .3127  .2758  .83       .0211  .0262  .0180 -.0003  .0118  .0003
Al3  .2879 .3127  .2758  .17       .0211  .0262  .0180  .0211  .0118  .0003
Si4  .0651 .2915  .4132  .84       .0181  .0298  .0186 -.0026  .0096 -.0011
Al4  .0651 .2915  .4132  .16       .0181  .0298  .0186 -.0026  .0096 -.0011
Si5      0 .2075      0  .92       .0167  .0259  .0172      0  .0071      0
Al5      0 .2075      0  .08       .0167  .0259  .0172      0  .0071      0
O1   .3159     0  .5552            .0680  .0230  .0440      0  .0160      0
O2   .2418 .1179  .6282            .0640  .0610  .0650 -.0100  .0510 -.0220
O3   .1885 .1464 -.1109            .0400  .0470  .0300 -.0140  .0200 -.0060
O4   .2394  .103  .2607       .05  .0260  .0450  .0280  .0070  .0060  .0070
O5       0 .3167     .5            .0800  .0740  .0710      0  .0680      0
O6    .082 .1537  .0555            .0170  .0350  .0400  .0000  .0150  .0030
O7   .3703  .272  .4495            .0470  .0490  .0510  .0100 -.0040  .0210
O8   .0116 .2615  .1858            .0450  .0530  .0300  .0010  .0100 -.0190
O9   .2107 .2525  .1688            .0310  .0290  .0370 -.0080  .0220 -.0050
O10  .1137 .3681  .4038            .0370  .0500  .0470 -.0180  .0130  .0020
Na    .195     0    .76  .28       .0900  .0200  .0800      0  .0600      0
Ca   .4632     0   .748 .222       .0460  .0740  .0500      0 -.0050      0
Ba   .2413    .5   .057  .08       .1220  .0190  .0870      0  .0750      0
K1   .2413    .5   .057  .33       .1220  .0190  .0870      0  .0750      0
K2     .23     0  -.011  .06 0.05
K3    .215     0    .14  .03 0.05
OH11  .083     0   .878  .36       .0800  .0400  .1400      0 -.0100      0
OH12  .433  .918   .037  .41       .4400  .1300  .1200  .1100 -.1300 -.0500
OH13     0    .5     .5  .62       .1800  .1400  .2400      0  .1400      0
OH14  .101     0   .112  .19
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Clinoptilolite-Ca
 
Cappelletti P, Langella A, Cruciani G
 
European Journal of Mineralogy 11 (1999) 1051-1060
Crystal-chemistry and synchrotron Rietveld refinement
of two different clinoptilolites from volcanoclastites
of North-Western Sardinia
Sample: LAC1
Locality: volcanoclastites of North-Western Sardinia
_database_code_amcsd 0006812
17.6750 17.9572 7.4091 90 116.304 90 C2/m
atom     x     y     z occ Uiso
Na1   .138     0  .692 .33  .05
Ca2   .047    .5  .196 .43  .07
K3    .242    .5  .041 .32  .03
Mg4      0     0    .5 .26  .06
Si1  .1783 .1704 .0982      .01
Si2  .2119 .4118 .5060      .02
Si3  .2098 .1914 .7103      .02
Si4  .0686 .2998 .4192      .01
Si5      0 .2185     0      .01
O1   .1941    .5 .4597      .02
O2   .2316 .1242 .6019      .02
O3   .1842 .1575 .8819      .03
O4   .2323 .1046 .2493      .03
O5       0 .3275    .5      .03
O6   .0785 .1599 .0599      .01
O7   .1265 .2342 .5573      .03
O8   .0114 .2769 .1830      .01
O9   .2113 .2526 .1843      .02
O10  .1169 .3764 .4214      .02
Wat1  .321     0  .073 .68  .12
Wat2  .131     0  .926 .30  .07
Wat3  .081  .414  .961      .11
Wat4    .5     0    .5      .03
Wat5  .016  .096  .414  .5  .07
Wat6  .091     0  .316  .5  .20
Wat7  .085     0  .704  .5  .12
Wat8  .051     0  .099 .49  .15
Wat9  .149     0  .624 .48  .17
Wat10 .008     0  .753 .26  .13
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Clinoptilolite-Ca
 
Cappelletti P, Langella A, Cruciani G
 
European Journal of Mineralogy 11 (1999) 1051-1060
Crystal-chemistry and synchrotron Rietveld refinement
of two different clinoptilolites from volcanoclastites
of North-Western Sardinia
Sample: ZC16
Locality: volcanoclastites of North-Western Sardinia
_database_code_amcsd 0006813
17.6589 17.9241 7.4034 90 116.243 90 C2/m
atom     x     y     z  occ Uiso
Na1   .157     0  .590  .13  .04
Ca2   .043    .5  .179  .37  .10
K3    .234    .5  .038  .61  .07
Si1  .1795 .1713 .0990       .01
Si2  .2103 .4119 .5035       .02
Si3  .2074 .1892 .7067       .02
Si4  .0682 .2993 .4188       .01
Si5      0 .2170     0       .01
O1   .1872    .5 .4726       .02
O2   .2367 .1240 .6081       .03
O3   .1917 .1530 .8916       .03
O4   .2349 .1059 .2535       .03
O5       0 .3282    .5       .04
O6   .0799 .1595 .0569       .01
O7   .1275 .2347 .5541       .03
O8   .0168 .2771 .1818       .01
O9   .2139 .2532 .1927       .02
O10  .1169 .3764 .4214       .03
Wat1  .335     0  .092  .38  .09
Wat2  .118     0  .864  .44  .06
Wat3  .082  .408  .964 1.05  .14
Wat4    .5     0    .5       .03
Wat5  .027  .108  .396  .51  .04
Wat6  .125     0  .357  .37  .05
Wat7  .072     0  .683  .69  .22
Wat8  .055     0  .154  .93  .17
Wat9  .149     0  .682  .73  .11
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Clinoptilolite-Ca
 
Koyama K, Takeuchi Y
Download zk/vol145/ZK145_216.pdf
Zeitschrift fur Kristallographie 145 (1977) 216-239
Clinoptilolite: The distribution of potassium atoms
and its role in thermal stability
Locality: Kuruma Pass, Fukushima Prefecture, Japan
Note: z(Wat7) corrected
_database_code_amcsd 0010792
17.6600 17.963 7.400 90 116.47 90 C2/m
atom     x     y     z occ Biso B(1,1) B(2,2) B(3,3)  B(1,2) B(1,3) B(2,3)
Na1  .1427     0  .667 .36       .0042  .0012  .0259       0  .0033      0
Ca1  .1427     0  .667 .24       .0042  .0012  .0259       0  .0033      0
Na2  .0392    .5  .208 .20       .0012  .0022  .0322       0  .0011      0
Ca2  .0392    .5  .208 .26       .0012  .0022  .0322       0  .0011      0
K3   .2562    .5  .084 .37       .0038  .0005  .0257       0  .0051      0
Mg4      0     0    .5 .04 18.6
Si1  .1792 .1695 .0942 .80      .00042 .00121  .0120 -.00003  .0010  .0003
Al1  .1792 .1695 .0942 .20      .00042 .00121  .0120 -.00003  .0010  .0003
Si2  .2122 .4107 .5029 .58      .00083 .00089  .0126      .0  .0015  .0002
Al2  .2122 .4107 .5029 .42      .00083 .00089  .0126      .0  .0015  .0002
Si3  .2084 .1911 .7145 .91      .00063 .00100  .0113  .00004  .0013     .0
Al3  .2084 .1911 .7145 .09      .00063 .00100  .0113  .00004  .0013     .0
Si4  .0656 .2986 .4134 .94      .00050 .00109  .0102 -.00012  .0008 -.0001
Al4  .0656 .2986 .4134 .06      .00050 .00109  .0102 -.00012  .0008 -.0001
Si5      0 .2156     0 .86      .00060 .00111  .0114       0  .0012      0
Al5      0 .2156     0 .14      .00060 .00111  .0114       0  .0012      0
O1   .1975    .5 .4564           .0029  .0014  .0185       0  .0030      0
O2   .2329 .1224 .6109           .0026  .0020  .0203  -.0001  .0047 -.0019
O3   .1835 .1560 .8810           .0028  .0020  .0169  -.0003  .0040  .0001
O4   .2357 .1056 .2489           .0022  .0021  .0148   .0011  .0021  .0022
O5       0 .3214    .5           .0031  .0024  .0222       0  .0065      0
O6   .0815 .1614 .0588           .0008  .0016  .0212   .0001  .0022  .0004
O7   .1273 .2331 .5461           .0025  .0024  .0174   .0009  .0005  .0025
O8   .0117 .2688 .1854           .0018  .0024  .0111      .0 -.0003 -.0026
O9   .2126 .2525 .1837           .0014  .0019  .0200  -.0006  .0022 -.0017
O10  .1160 .3720 .4108           .0015  .0018  .0233  -.0008  .0021 -.0003
Wat1  .218    .5 -.005 .75  4.4
Wat2  .087     0  .897 .45  8.8
Wat3 .0787 .4198  .964      8.1
Wat4     0    .5    .5      7.0
Wat5     0  .088    .5 .74 16.4
Wat6  .083     0  .267 .91 17.7
Wat7  .094     0  .740 .34 17.5
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Clinoptilolite-Ca
 
Koyama K, Takeuchi Y
Download zk/vol145/ZK145_216.pdf
Zeitschrift fur Kristallographie 145 (1977) 216-239
Clinoptilolite: The distribution of potassium atoms
and its role in thermal stability
Locality: Agoura, California, USA
Note: z(O3) corrected
_database_code_amcsd 0010793
17.6620 17.911 7.407 90 116.40 90 C2/m
atom      x      y     z occ Biso B(1,1) B(2,2) B(3,3)  B(1,2) B(1,3)  B(2,3)
Na1   .1428      0  .667 .36       .0083  .0015  .0358       0  .0079       0
Ca1   .1428      0  .667 .06       .0083  .0015  .0358       0  .0079       0
Na2   .0393     .5  .210 .10       .0020  .0019  .0235       0  .0015       0
Ca2   .0393     .5  .210 .25       .0020  .0019  .0235       0  .0015       0
K3    .2413     .5  .049 .44       .0085  .0019  .0395       0  .0138       0
Mg4       0      0    .5 .10  1.1
Si1  .17906 .16943 .0963 .83      .00106 .00103  .0060  .00001 .00160  .00032
Al1  .17906 .16943 .0963 .17      .00106 .00103  .0060  .00001 .00160  .00032
Si2  .21334 .41099 .5040 .69      .00126 .00073  .0070  .00003 .00162  .00008
Al2  .21334 .41099 .5040 .31      .00126 .00073  .0070  .00003 .00162  .00008
Si3  .20846 .19034 .7153 .87      .00122 .00087  .0055  .00007 .00176  .00005
Al3  .20846 .19034 .7153 .13      .00122 .00087  .0055  .00007 .00176  .00005
Si4  .06623 .29837 .4148 .89      .00108 .00100  .0061 -.00015 .00152 -.00002
Al4  .06623 .29837 .4148 .11      .00108 .00100  .0061 -.00015 .00152 -.00002
Si5       0 .21651     0 .90      .00113 .00101  .0058       0  .0014       0
Al5       0 .21651     0 .10      .00113 .00101  .0058       0  .0014       0
O1    .1959     .5 .4574           .0032  .0011  .0146       0  .0031       0
O2    .2336  .1204 .6144           .0032  .0018  .0165      .0  .0054  -.0012
O3    .1850  .1551 .8859           .0041  .0019  .0133  -.0002  .0055   .0002
O4    .2333  .1041 .2509           .0027  .0020  .0092   .0008  .0018   .0005
O5        0  .3232    .5           .0030  .0024  .0169       0  .0056       0
O6    .0808  .1627 .0555           .0014  .0015  .0152      .0  .0024   .0001
O7    .1268  .2317 .5492           .0030  .0021  .0159   .0010  .0017   .0024
O8    .0122  .2702 .1856           .0022  .0023  .0103   .0001  .0011  -.0021
O9    .2123  .2520 .1860           .0017  .0016  .0178  -.0006  .0025  -.0018
O10   .1188  .3718 .4148           .0022  .0016  .0176  -.0006  .0030  -.0001
Wat1   .211     .5 -.033 .38  6.2
Wat2   .084      0  .888 .44 14.6
Wat3  .0777  .4206  .964      9.5
Wat4      0     .5    .5      7.4
Wat5      0   .095    .5 .76 22.1
Wat6   .073      0  .249 .83 19.1
Wat7   .096      0  .756 .42 10.2
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Clinoptilolite-Ca
 
Alberti A
 
Tschermaks Mineralogische und Petrographische Mitteilungen 22 (1975) 25-37
The crystal structure of two clinoptilolites
Locality: Agoura, California, USA
_database_code_amcsd 0015651
17.646 17.898 7.397 90 116.37 90 C2/m
atom     x     y     z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Ca1  .1418     0 .6673 .34       .0088  .0027  .0304      0  .0050      0
Ca2  .0382    .5 .2088 .34       .0011  .0021  .0153      0 -.0007      0
Ca3      0     0     0 .22 20.5
Si1  .1795 .1692 .0956           .0009  .0011  .0050  .0000  .0011  .0001
Al2  .2117 .4103 .5034 .30       .0012  .0008  .0062  .0001  .0013  .0001
Si2  .2117 .4103 .5034 .70       .0012  .0008  .0062  .0001  .0013  .0001
Si3  .2091 .1903 .7153           .0011  .0010  .0045  .0001  .0011  .0001
Si4  .0659 .2975 .4135           .0009  .0011  .0049  .0000  .0011 -.0001
Si5      0 .2146     0           .0010  .0012  .0047      0  .0009      0
O1   .1945    .5 .4554           .0032  .0011  .0103      0  .0025      0
O2   .2346 .1220 .6132           .0030  .0019  .0155  .0000  .0044 -.0016
O3   .1853 .1546 .8845           .0037  .0022  .0120 -.0003  .0047  .0001
O4   .2355 .1056 .2528           .0024  .0018  .0102  .0007  .0014  .0009
O5       0 .3218    .5           .0033  .0028  .0191      0  .0063      0
O6   .0809 .1604 .0567           .0016  .0015  .0156  .0001  .0025  .0002
O7   .1277 .2326 .5461           .0025  .0028  .0142  .0009  .0005  .0016
O8   .0123 .2682 .1859           .0026  .0028  .0097  .0001  .0014 -.0021
O9   .2126 .2518 .1842           .0021  .0020  .0155 -.0007  .0028 -.0015
O10  .1176 .3709 .4129           .0023  .0016  .0187 -.0006  .0031  .0001
Wat1 .2332    .5 .0333      3.4
Wat2 .0865     0 .8133 .49 15.7
Wat3 .0792 .4175 .9622 .91  8.1
Wat4     0    .5    .5      7.7
Wat5 .0226 .0897 .4655 .48 20.9
Wat6 .0794     0 .2570 .68 16.4
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Total number of retrieved datasets: 8
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