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Clinoferrosilite |
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Ohashi Y, Burnham C W, Finger L W |
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American Mineralogist 60 (1975) 423-434 |
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The effect of Ca-Fe substitution on the clinopyroxene crystal structure |
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Fs80Wo20 |
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_database_code_amcsd 0000459 |
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9.760 9.057 5.234 90 106.3 90 C2/c |
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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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Fe1 0 .9050 .25 .64 .00100 .00154 .01059 0 .00111 0 |
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Fe2 0 .2751 .25 .6 1.78 .00326 .01051 .01000 0 .00388 0 |
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Ca 0 .2751 .25 .4 1.78 .00326 .01051 .01000 0 .00388 0 |
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Si .2937 .0891 .2440 .65 .00065 .00166 .01088 .00021 .00049 -.00090 |
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O1 .1214 .0893 .1535 .78 .00056 .00237 .01167 -.00035 .00172 -.00023 |
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O2 .3712 .2417 .3480 1.53 .00180 .00251 .02750 .00086 -.00033 -.00482 |
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O3 .3517 .0261 -.002 1.14 .00123 .00561 .01095 -.00126 .00084 -.00317 |
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View JMOL 3-D Structure (permalink) |
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Clinoferrosilite |
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Ohashi Y, Burnham C W, Finger L W |
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American Mineralogist 60 (1975) 423-434 |
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The effect of Ca-Fe substitution on the clinopyroxene crystal structure |
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Fs85Wo15 |
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_database_code_amcsd 0000460 |
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9.779 9.088 5.258 90 107.39 90 P2_1/c |
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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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SiA .0461 .3387 .2569 .0012 .0028 .0083 .0003 .0009 -.0008 |
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SiB .5455 .8373 .2436 .0021 .0014 .0078 -.0007 .0020 -.0007 |
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Fe1 .2512 .6543 .2454 .0018 .0022 .0067 .0002 .0012 .0002 |
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Fe2 .2534 .0182 .2443 .7 .0020 .0082 .0079 -.0001 -.0001 .0007 |
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Ca2 .2534 .0182 .2443 .3 .0020 .0082 .0079 -.0001 -.0001 .0007 |
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O1a .8729 .3407 .1601 .0013 .0021 .0048 .0000 -.0008 .0002 |
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O2a .1182 .4948 .3423 .0055 .0041 .0232 .0001 .0076 -.0005 |
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O3a .1002 .2299 .5172 .0006 .0106 .0193 .0012 .0001 .0105 |
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O1b .3719 .8360 .1499 .0023 .0035 .0103 .0000 .0026 -.0010 |
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O2b .6280 .9873 .3656 .0017 .0017 .0192 -.0019 .0027 -.0035 |
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O3b .6038 .7192 .4983 .0026 .0056 .0098 -.0007 .0041 .0015 |
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View JMOL 3-D Structure (permalink) |
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Clinoferrosilite |
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Sueno S, Kimata M, Prewitt C T |
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American Mineralogist 69 (1984) 264-269 |
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The crystal structure of high clinoferrosilicate |
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T = 1050 C |
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_database_code_amcsd 0000936 |
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9.928 9.179 5.338 90 110.20 90 C2/c |
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atom x y z Biso |
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Fe1 0 .9014 .25 2.03 |
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Fe2 0 .2625 .25 2.84 |
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Si .2962 .0852 .2708 1.90 |
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O1 .1241 .0903 .1587 3.28 |
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O2 .3747 .2398 .3616 2.23 |
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O3 .3589 .0134 .0445 2.40 |
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View JMOL 3-D Structure (permalink) |
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Clinoferrosilite |
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Hugh-Jones D A, Woodland A B, Angel R J |
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American Mineralogist 79 (1994) 1032-1041 |
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The structure of high-pressure C2/c ferrosilite and crystal chemistry of |
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high-pressure C2/c pyroxenes |
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P = room pressure |
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_database_code_amcsd 0001679 |
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9.7075 9.0807 5.2347 90 108.46 90 P2_1/c |
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atom x y z Biso |
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Fe1 .2512 .6538 .2262 .92 |
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Fe2 .2256 .0145 .2239 1.13 |
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SiA .0454 .3384 .2915 .64 |
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SiB .5531 .8334 .2431 .77 |
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O1A .871 .338 .178 .62 |
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O1B .379 .837 .137 .59 |
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O2A .125 .496 .335 .70 |
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O2B .633 .981 .387 1.17 |
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O3A .106 .266 .597 1.45 |
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O3B .608 .702 .470 1.60 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink) |
| |
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Clinoferrosilite |
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Hugh-Jones D A, Woodland A B, Angel R J |
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American Mineralogist 79 (1994) 1032-1041 |
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The structure of high-pressure C2/c ferrosilite and crystal chemistry of |
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high-pressure C2/c pyroxenes |
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P = 1.87 GPa |
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_database_code_amcsd 0001680 |
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9.540 8.996 5.008 90 103.01 90 C2/c |
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atom x y z Biso |
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Fe1 0 .9054 .25 .38 |
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Fe2 0 .2721 .25 .28 |
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Si .2988 .0882 .2225 .05 |
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O1 .126 .095 .154 .30 |
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O2 .377 .233 .373 .30 |
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O3 .352 .053 .934 .30 |
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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) |
| |
|
Clinoferrosilite |
|
Hugh-Jones D A, Woodland A B, Angel R J |
|
American Mineralogist 79 (1994) 1032-1041 |
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The structure of high-pressure C2/c ferrosilite and crystal chemistry of |
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high-pressure C2/c pyroxenes |
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Sample: fictive hedenbergite-like C2/c FeSiO3 phase |
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_database_code_amcsd 0001681 |
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9.73 9.11 5.23 90 107.8 90 C2/c |
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atom x y z |
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Fe1 0 .901 .25 |
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Fe2 0 .263 .25 |
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Si .296 .085 .252 |
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O1 .124 .090 .159 |
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O2 .375 .240 .362 |
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O3 .359 .031 .045 |
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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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