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Cordierite |
 |
Wallace J H, Wenk H R |
 |
American Mineralogist 65 (1980) 96-111 |
|
Structure variation in low cordierites |
|
sci 1542 mono |
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_database_code_amcsd 0000763 |
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17.044 9.716 9.334 90 90 90 Cccm |
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atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Mg1 .33742 0 .25 .900 .00041 .00121 .00193 0 0 -.00001 |
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Fe1 .33742 0 .25 .068 .00041 .00121 .00193 0 0 -.00001 |
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Al1 .25 .25 .25006 .962 .00044 .00096 .00104 0.00023 0 0 |
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Si2 0 .5 .25 .876 .00028 .00115 .00076 0 0 0 |
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Al2 0 .5 .25 .097 .00028 .00115 .00076 0 0 0 |
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Si3 .19252 .07803 0 .963 .00031 .00069 .00102 0.00004 0 0 |
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Si4 .13516 -.23731 0 .970 .00025 .00090 .00099 -.00005 0 0 |
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Al5 .05083 .30791 0 .911 .00028 .00085 .00110 0.00008 0 0 |
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Si5 .05083 .30791 0 .048 .00028 .00085 .00110 0.00008 0 0 |
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O1 .24722 -.10301 .35881 .00078 .00155 .00176 -.00016 0.00032 -.00025 |
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O2 .06220 -.41620 .34910 .00054 .00232 .00184 -.00014 0.00004 -.00057 |
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O3 -.17326 -.31006 .35854 .00067 .00203 .00179 0.00023 -.00024 -.00026 |
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O4 .04321 -.24815 0 .00051 .00299 .00371 -.00011 0 0 |
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O5 .12231 .18464 0 .00074 .00239 .00361 0.00047 0 0 |
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O6 .16468 -.07957 0 .00091 .00151 .00415 -.00027 0 0 |
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OH1 0 0 .25 .740 .051 .026 0.011 0 0 0 |
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OH2 0 0 0 .120 .001 -.001 0.510 0.002 0 0 |
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| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
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| |
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Cordierite |
|
Wallace J H, Wenk H R |
|
American Mineralogist 65 (1980) 96-111 |
|
Structure variation in low cordierites |
|
sci 1542 filter |
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_database_code_amcsd 0000764 |
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17.044 9.716 9.334 90 90 90 Cccm |
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atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Mg1 .33739 0 .25 .886 .00037 .00120 .00175 0 0 -.00005 |
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Fe1 .33739 0 .25 .068 .00037 .00120 .00175 0 0 -.00005 |
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Al1 .25008 .25 .25010 .954 .00042 .00093 .00100 0.00016 0 0 |
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Si2 0 .5 .25 .864 .00031 .00098 .00079 0 0 0 |
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Al2 0 .5 .25 .096 .00031 .00098 .00079 0 0 0 |
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Si3 .19252 .07796 0 .960 .00031 .00076 .00093 0.00001 0 0 |
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Si4 .13517 -.23732 0 .958 .00033 .00083 .00098 -.00007 0 0 |
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Al5 .05077 .30786 0 .913 .00033 .00099 .00106 0.00006 0 0 |
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Si5 .05077 .30786 0 .048 .00033 .00099 .00106 0.00006 0 0 |
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O1 .24723 -.10292 .35868 .00088 .00154 .00172 -.00011 0.00030 -.00026 |
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O2 .06229 -.41627 .34908 .00059 .00221 .00185 -.00010 0.00011 -.00057 |
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O3 -.17321 -.31005 .35851 .00076 .00193 .00185 0.00012 -.00030 -.00047 |
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O4 .04305 -.24824 0 .00053 .00334 .00339 -.00015 0 0 |
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O5 .12213 .18479 0 .00069 .00237 .00378 0.00063 0 0 |
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O6 .16474 -.07956 0 .00102 .00127 .00387 -.00026 0 0 |
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OH1 0 0 .25 .770 0.050 0.028 0.012 0 0 0 |
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OH2 0 0 0 .080 -.001 -.004 0.320 0.00230 0 0 |
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|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
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| |
|
Cordierite |
|
Wallace J H, Wenk H R |
|
American Mineralogist 65 (1980) 96-111 |
|
Structure variation in low cordierites |
|
Brg 50 |
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_database_code_amcsd 0000765 |
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17.089 9.737 9.344 90 90 90 Cccm |
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atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Mg1 .33734 0 .25 .883 .00025 .00112 .00160 0 0 -.00007 |
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Fe1 .33734 0 .25 .090 .00025 .00112 .00160 0 0 -.00007 |
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Al1 .25011 .25 .25010 .960 .00033 .00102 .00110 0.00017 0 0 |
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Si2 0 .5 .25 .871 .00028 .00113 .00084 0 0 0 |
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Al2 0 .5 .25 .097 .00028 .00113 .00084 0 0 0 |
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Si3 .19236 .078030 0 .963 .00029 .00073 .00098 0 0 0 |
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Si4 .13526 -.23704 0 .965 .00021 .00089 .00102 -.00006 0 0 |
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Al5 .05077 .307950 0 .903 .00019 .00096 .00099 0.00008 0 0 |
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Si5 .05077 .307950 0 .048 .00019 .00096 .00099 0.00008 0 0 |
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O1 .24695 -.10317 .35876 .00082 .00171 .00169 -.00007 0.00025 -.00019 |
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O2 .06199 -.41601 .34877 .00058 .00227 .00193 -.00010 0.00001 -.00067 |
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O3 -.17335 -.30949 .35847 .00062 .00214 .00185 0.00022 -.00018 -.00043 |
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O4 .04332 -.24787 0 .00058 .00338 .00388 -.00010 0 0 |
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O5 .12217 .184140 0 .00090 .00230 .00374 0.00045 0 0 |
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O6 .16438 -.07957 0 .00099 .00143 .00378 -.00031 0 0 |
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OH1 0 0 .25 .600 .032 .024 .017 0 0 0 |
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OH2 0 0 0 .110 .002 .006 .010 0.002 0 0 |
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|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Cordierite |
|
Wallace J H, Wenk H R |
|
American Mineralogist 65 (1980) 96-111 |
|
Structure variation in low cordierites |
|
sci 624 |
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_database_code_amcsd 0000766 |
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17.088 9.726 9.335 90 90 90 Cccm |
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atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Mg1 .33751 0 .25 .816 .00032 .00109 .00174 0 0 0.00008 |
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Fe1 .33751 0 .25 .130 .00032 .00109 .00174 0 0 0.00008 |
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Al1 .25 .25 .25006 .964 .00041 .00097 .00111 0.00013 0 0 |
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Si2 0 .5 .25 .853 .00020 .00091 .00075 0 0 0 |
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Al2 0 .5 .25 .095 .00020 .00091 .00075 0 0 0 |
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Si3 .19234 .077810 0 .970 .00030 .00072 .00101 0.00008 0 0 |
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Si4 .13511 -.23714 0 .971 .00025 .00090 .00104 -.00009 0 0 |
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Al5 .05059 .307700 0 .928 .00029 .00109 .00115 0.00006 0 0 |
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Si5 .05059 .307700 0 .049 .00029 .00109 .00115 0.00006 0 0 |
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O1 .24695 -.10288 .35874 .00074 .00167 .00159 -.00018 .00045 -.00027 |
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O2 .06208 -.41554 .34870 .00049 .00215 .00179 -.00013 -.00003 -.00088 |
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O3 -.17323 -.30982 .35824 .00059 .00200 .00185 0.00015 -.00023 -.00053 |
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O4 .04334 -.24887 0 .00035 .00332 .00351 -.00027 0 0 |
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O5 .12219 .184810 0 .00065 .00219 .00383 0.00058 0 0 |
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O6 .16431 -.07930 0 .00089 .00118 .00388 -.00037 0 0 |
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OH1 0 0 .25 .960 .220 .018 .075 0 0 0 |
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OH2 0 0 0 .260 .015 .022 .057 0.001 0 0 |
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|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Cordierite |
|
Wallace J H, Wenk H R |
|
American Mineralogist 65 (1980) 96-111 |
|
Structure variation in low cordierites |
|
sci 1018 |
|
_database_code_amcsd 0000767 |
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17.114 9.761 9.333 90 90 90 Cccm |
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atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Mg1 .33734 0 .25 .626 .00037 .00125 .00187 0 0 -.00001 |
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Fe1 .33734 0 .25 .626 .00037 .00125 .00187 0 0 -.00001 |
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Al1 .25 .25 .25011 .970 .00048 .00124 .00110 0.00016 0 0 |
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Si2 0 .5 .25 .884 .00030 .00142 .00094 0 0 0 |
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Al2 0 .5 .25 .098 .00030 .00142 .00094 0 0 0 |
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Si3 .19170 .078390 0 .966 .00030 .00085 .00104 0.00003 0 0 |
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Si4 .13508 -.23636 0 .960 .00028 .00093 .00096 -.00008 0 0 |
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Al4 .05046 .307770 0 .899 .00024 .00099 .00097 0.00006 0 0 |
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Si5 .05046 .307770 0 .047 .00024 .00099 .00097 0.00006 0 0 |
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O1 .24623 -.10370 .35868 .00083 .00171 .00176 -.00008 0.00037 -.00019 |
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O2 .06172 -.41580 .34874 .00059 .00239 .00184 -.00012 0.00006 -.00075 |
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O3 -.17323 -.30846 .35841 .00067 .00221 .00171 0.00013 -.00025 -.00046 |
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O4 .04332 -.24703 0 .00044 .00365 .00384 -.00018 0 0 |
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O5 .12135 .183910 0 .00087 .00263 .00375 0.00077 0 0 |
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O6 .16390 -.07889 0 .00102 .00136 .00398 -.00043 0 0 |
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OH1 0 0 .25 .42 .0059 .0160 .0082 0 0 0 |
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OH2 0 0 0 .16 .0001 .0026 .0110 -.0005 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Cordierite |
|
Wallace J H, Wenk H R |
|
American Mineralogist 65 (1980) 96-111 |
|
Structure variation in low cordierites |
|
sci 1104 |
|
_database_code_amcsd 0000768 |
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17.098 9.741 9.319 90 90 90 Cccm |
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atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Mg1 .33735 0 .25 .581 .00028 .00118 .00174 0 0 0.00002 |
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Fe1 .33735 0 .25 .366 .00028 .00118 .00174 0 0 0.00002 |
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Al1 .25 .25 .25002 .969 .00043 .00128 .00110 0.00014 0 0 |
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Si2 0 .5 .25 .881 .00035 .00128 .00097 0 0 0 |
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Al2 0 .5 .25 .098 .00035 .00128 .00097 0 0 0 |
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Si3 .19150 .078530 0 .967 .00031 .00090 .00096 0.00003 0 0 |
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Si4 .13506 -.23592 0 .962 .00027 .00096 .00089 -.00011 0 0 |
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Al5 .05024 .307510 0 .906 .00024 .00133 .00096 0.00009 0 0 |
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Si5 .05024 .307510 0 .048 .00024 .00133 .00096 0.00009 0 0 |
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O1 .24584 -.10367 .35849 .00083 .00175 .00187 0.00000 0.00038 -.00012 |
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O2 .06148 -.41534 .34882 .00063 .00246 .00170 -.00017 0.00003 -.00067 |
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O3 -.17319 -.30796 .35827 .00059 .00224 .00190 0.00019 -.00024 -.00047 |
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O4 .04344 -.24735 0 .00052 .00358 .00415 -.00012 0 0 |
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O5 .12149 .18412 0 .00088 .00261 .00366 0.00064 0 0 |
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O6 .16373 -.07855 0 .00096 .00198 .00355 -.00034 0 0 |
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OH1 0 0 .25 .65 .0280 .024 .017 0 0 0 |
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OH2 0 0 0 .12 .0003 .003 .004 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Cordierite |
|
Wallace J H, Wenk H R |
|
American Mineralogist 65 (1980) 96-111 |
|
Structure variation in low cordierites |
|
sci 552 |
|
_database_code_amcsd 0000769 |
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17.140 9.769 9.321 90 90 90 Cccm |
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atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Mg1 .33733 0 .25 .588 .00028 .00127 .00211 0 0 -.00003 |
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Fe1 .33733 0 .25 .386 .00028 .00127 .00211 0 0 -.00003 |
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Al1 .25 .25 .25006 .978 .00044 .00142 .00143 0.00013 0 0 |
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Si2 0 .5 .25 .880 .00026 .00126 .00109 0 0 0 |
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Al2 0 .5 .25 .098 .00026 .00126 .00109 0 0 0 |
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Si3 .19135 .078440 0 .983 .00029 .00102 .00140 0.00005 0 0 |
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Si4 .13502 -.23589 0 .969 .00023 .00122 .00124 -.00009 0 0 |
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Al5 .05032 .307490 0 .901 .00016 .00117 .00126 0.00007 0 0 |
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Si5 .05032 .307490 0 .047 .00016 .00117 .00126 0.00007 0 0 |
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O1 .24563 -.10374 .35836 .00074 .00191 .00206 -.00006 0.00035 -.00005 |
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O2 .06144 -.41538 .34922 .00054 .00240 .00223 -.00015 0.00013 -.00086 |
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O3 -.17322 -.30721 .35803 .00059 .00228 .00212 0.00019 -.00017 -.00036 |
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O4 .04348 -.24780 0 .00036 .00383 .00446 -.00023 0 0 |
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O5 .12130 .184190 0 .00079 .00259 .00409 0.00056 0 0 |
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O6 .16362 -.07814 0 .00084 .00175 .00394 -.00017 0 0 |
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OH1 0 0 .25 .60 .018 .025 .019 0 0 0 |
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OH2 0 0 0 .12 .002 .001 .009 0 0 0 |
|
|
| 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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