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Erionite-Ca |
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Gualtieri A, Artioli G, Passaglia E, Bigi S, Viani A, Hanson J C |
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American Mineralogist 83 (1998) 590-606 |
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Crystal structure-crystal chemistry relationships in the zeolites erionite |
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and offretite |
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Sample from Lady Hill |
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_database_code_amcsd 0002001 |
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13.339 13.339 15.112 90 90 120 P6_3/mmc |
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atom x y z occ Uiso |
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Si1 .0012 .2308 .1058 .939 .027 |
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Al1 .0012 .2308 .1058 .061 .027 |
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Si2 .0871 .4190 .25 .512 .015 |
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Al2 .0871 .4190 .25 .488 .015 |
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Ca1 1/3 2/3 .118 .40 .091 |
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Ca2 1/3 2/3 .942 .47 .082 |
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Ca3 2/3 1/3 .221 .07 .041 |
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Ca4 .5 0 0 .04 .091 |
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K 0 0 .25 .051 |
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O1 .0295 .3443 .1584 .044 |
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O2 .0991 .1982 .1285 .052 |
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O3 .1266 .2532 .6284 .044 |
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O4 .2645 0 0 .051 |
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O5 .2314 .4628 .25 .033 |
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O6 .1105 .5552 .25 .035 |
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Wat1 .2705 .5410 -.060 .39 .067 |
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Wat1b .2439 .4878 .0154 .46 .067 |
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Wat2 .2050 .4100 .75 .31 .048 |
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Wat2b .254 .508 .691 .29 .048 |
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Wat3 .4414 .8828 .9141 .62 .047 |
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Wat3b .470 -.060 .027 .38 .047 |
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Wat3c .4205 .8410 .6586 .18 .047 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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Erionite-Ca |
| |
Gualtieri A, Artioli G, Passaglia E, Bigi S, Viani A, Hanson J C |
|
American Mineralogist 83 (1998) 590-606 |
|
Crystal structure-crystal chemistry relationships in the zeolites erionite |
|
and offretite |
|
Sample from Shourdo |
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_database_code_amcsd 0002002 |
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13.264 13.264 15.067 90 90 120 P6_3/mmc |
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atom x y z occ Uiso |
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Si1 .0006 .2329 .1052 .823 .036 |
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Al1 .0006 .2329 .1052 .177 .036 |
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Si2 .0926 .4226 .25 .695 .031 |
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Al2 .0926 .4226 .25 .305 .031 |
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Ca1 1/3 2/3 .104 .15 .077 |
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Ca2 1/3 2/3 .887 .12 .069 |
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Ca3 2/3 1/3 .2010 .13 .032 |
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Ca4 .5 0 0 .14 .065 |
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Mg 2/3 1/3 .0730 .13 .103 |
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K 0 0 .25 .038 |
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O1 .0251 .3473 .6609 .045 |
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O2 .0973 .1946 .1261 .019 |
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O3 .1263 .2526 .6320 .024 |
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O4 .2680 0 0 .038 |
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O5 .2310 .4620 .25 .043 |
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O6 .0970 .5485 .25 .070 |
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Wat1 .266 .532 .008 .29 .086 |
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Wat2 .235 .470 .718 .36 .128 |
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Wat2b .260 .522 .694 .18 .128 |
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Wat3 .431 .862 .903 .61 .138 |
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Wat3b .462 -.074 .029 .22 .138 |
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Wat3c .465 .930 .779 .14 .138 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Erionite-Ca |
| |
Gualtieri A, Artioli G, Passaglia E, Bigi S, Viani A, Hanson J C |
|
American Mineralogist 83 (1998) 590-606 |
|
Crystal structure-crystal chemistry relationships in the zeolites erionite |
|
and offretite |
|
Sample from Tunguska |
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_database_code_amcsd 0002003 |
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13.304 13.304 15.078 90 90 120 P6_3/mmc |
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atom x y z occ Uiso |
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Si1 .0030 .2332 .1057 .823 .036 |
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Al1 .0030 .2332 .1057 .177 .036 |
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Si2 .0945 .4227 .25 .645 .028 |
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Al2 .0945 .4227 .25 .355 .028 |
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Ca1 1/3 2/3 .113 .16 .026 |
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Ca2 1/3 2/3 .9263 .55 .072 |
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Ca3 2/3 1/3 .219 .13 .033 |
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Ca4 .5 0 0 .04 .095 |
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K 0 0 .25 .85 .039 |
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O1 .0223 .3453 .6616 .026 |
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O2 .0952 .1904 .1255 .042 |
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O3 .1259 .2518 .6383 .058 |
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O4 .2661 0 0 .040 |
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O5 .2284 .4568 .25 .051 |
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O6 .0722 .5361 .25 .061 |
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Wat1 .2476 .4952 .020 .39 .128 |
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Wat2 .242 .484 .75 .24 .149 |
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Wat2b .238 .476 .678 .46 .149 |
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Wat3 .4337 .8674 .882 .74 .128 |
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Wat3b .534 .069 .004 .33 .128 |
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Wat3c .421 .842 .711 .19 .128 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Erionite-Ca |
| |
Gualtieri A, Artioli G, Passaglia E, Bigi S, Viani A, Hanson J C |
|
American Mineralogist 83 (1998) 590-606 |
|
Crystal structure-crystal chemistry relationships in the zeolites erionite |
|
and offretite |
|
Sample from Agate Beach |
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_database_code_amcsd 0002004 |
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13.289 13.289 15.079 90 90 120 P6_3/mmc |
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atom x y z occ Uiso |
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Si1 -.0005 .2332 .1015 .830 .031 |
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Al1 -.0005 .2332 .1015 .170 .031 |
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Si2 .0897 .4249 .25 .655 .046 |
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Al2 .0897 .4249 .25 .345 .046 |
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Ca1 1/3 2/3 .1137 .30 .085 |
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Ca2 1/3 2/3 .9047 .22 .079 |
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Ca3 2/3 1/3 .177 .16 .020 |
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Mg 2/3 1/3 .049 .20 .018 |
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K 0 0 .25 .87 .017 |
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O1 .0175 .3305 .6752 .057 |
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O2 .0915 .1830 .1176 .064 |
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O3 .1101 .2202 .6371 .062 |
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O4 .2693 0 0 .019 |
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O5 .2329 .4658 .25 .088 |
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O6 .0365 .5182 .25 .052 |
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Wat1 .245 .490 .106 .33 .162 |
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Wat2b .2658 .5316 .7009 .86 .135 |
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Wat3 .422 .844 .897 .90 .107 |
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Wat3b .469 -.602 .073 .30 .107 |
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Wat3c .441 .882 .789 .24 .107 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
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