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Hornblende |
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Phillips M W, Draheim J E, Popp R K, Clowe C A, Pinkerton A A |
 |
American Mineralogist 74 (1989) 764-773 |
|
Effects of oxidation-dehydrogenation in tschermakitic hornblende |
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sample H-1, natural |
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_database_code_amcsd 0001249 |
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9.813 18.055 5.321 90 104.97 90 C2/m |
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atom x y z occ Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Al1 .28020 .08606 .30109 .390 0.0058 0.0063 0.0063 -.0011 .0009 -.0002 |
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Si1 .28020 .08606 .30109 .610 0.0058 0.0063 0.0063 -.0011 .0009 -.0002 |
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Si2 .29168 .17334 .81442 0.0061 0.0070 0.0066 -.0001 .0014 .0007 |
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Fe1 0 .08972 .5 .415 0.0083 0.0066 0.0057 0 .0020 0 |
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Mg1 0 .08972 .5 .585 0.0083 0.0066 0.0057 0 .0020 0 |
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Fe2 0 .17782 0 .214 0.0056 0.0061 0.0063 0 .0013 0 |
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Mg2 0 .17782 0 .321 0.0056 0.0061 0.0063 0 .0013 0 |
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Al2 0 .17782 0 .430 0.0056 0.0061 0.0063 0 .0013 0 |
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Ti2 0 .17782 0 .035 0.0056 0.0061 0.0063 0 .0013 0 |
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Fe3 0 0 0 .588 0.0079 0.0056 0.0058 0 .0013 0 |
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Mg3 0 0 0 .412 0.0079 0.0056 0.0058 0 .0013 0 |
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Ca4 0 .28038 .5 .901 0.0104 0.0097 0.0104 0 .0052 0 |
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Na4 0 .28038 .5 .099 0.0104 0.0097 0.0104 0 .0052 0 |
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O1 .1057 .0920 .2116 0.0079 0.0168 0.0096 -.0026 .0027 -.0017 |
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O2 .1195 .1753 .7385 0.0070 0.0099 0.0112 .0002 .0011 .0009 |
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O3 .1108 0 .7115 0.0071 0.0114 0.0125 0 .0008 0 |
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O4 .3696 .2505 .7943 0.0132 0.0086 0.0123 -.0018 .0051 -.0008 |
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O5 .3506 .1394 .1093 0.0084 0.0146 0.0100 -.0001 .0008 .0051 |
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O6 .3421 .1198 .6020 0.0092 0.0136 0.0130 .0002 .0018 -.0035 |
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O7 .3333 0 .2860 0.0154 0.0140 0.0179 0 0.0030 0 |
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Na2/m 0 .5 0 .430 0.0440 0.1900 0.0770 0 0.0520 0 |
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H .325 .5 .245 0.5 |
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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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| |
|
Hornblende |
| |
Phillips M W, Draheim J E, Popp R K, Clowe C A, Pinkerton A A |
|
American Mineralogist 74 (1989) 764-773 |
|
Effects of oxidation-dehydrogenation in tschermakitic hornblende |
|
sample H-11, after annealing at 650 C, 1 kbar |
|
_database_code_amcsd 0001250 |
|
9.803 18.046 5.313 90 105.05 90 C2/m |
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atom x y z occ Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Al1 .28110 .08682 .30119 .390 0.0069 0.0068 0.0071 -.0007 .0012 -.0003 |
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Si1 .28110 .08682 .30119 .610 0.0069 0.0068 0.0071 -.0007 .0012 -.0003 |
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Si2 .29154 .17306 .81322 0.0071 0.0076 0.0075 .0001 .0017 .0007 |
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Fe1 0 .08869 .5 .413 0.0093 0.0089 0.0067 0 .0023 0 |
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Mg1 0 .08869 .5 .587 0.0093 0.0089 0.0067 0 .0023 0 |
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Fe2 0 .17764 0 .284 0.0072 0.0065 0.0072 0 .0016 0 |
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Mg2 0 .17764 0 .251 0.0072 0.0065 0.0072 0 .0016 0 |
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Al2 0 .17764 0 .430 0.0072 0.0065 0.0072 0 .0016 0 |
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Ti2 0 .17764 0 .035 0.0072 0.0065 0.0072 0 .0016 0 |
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Fe3 0 0 0 .490 0.0093 0.0064 0.0072 0 .0012 0 |
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Mg3 0 0 0 .510 0.0093 0.0064 0.0072 0 .0012 0 |
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Ca4 0 .27999 .5 .903 0.0117 0.0097 0.0118 0 .0055 0 |
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Na4 0 .27999 .5 .097 0.0117 0.0097 0.0118 0 .0055 0 |
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O1 .1063 .0906 .2132 0.0093 0.0165 0.0107 -.0020 .0030 -.0010 |
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O2 .1192 .1743 .7356 0.0078 0.0133 0.0111 .0006 .0011 .0016 |
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O3 .1102 0 .7136 0.0085 0.0132 0.0164 0 .0014 0 |
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O4 .3686 .2505 .7930 0.0143 0.0098 0.0131 -.0013 .0050 -.0004 |
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O5 .3504 .1395 .1089 0.0105 0.0152 0.0123 .0002 .0014 .0047 |
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O6 .3430 .1195 .6021 0.0104 0.0137 0.0136 -.0002 .0019 -.0036 |
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O7 .3353 0 .2861 0.0154 0.0134 0.0200 0 .0030 0 |
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Na2/m 0 .5 0 .470 0.1570 0.1070 0.1910 0 .1660 0 |
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H .319 .5 .268 .890 0.5 |
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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
|
| |
|
Hornblende |
| |
Phillips M W, Draheim J E, Popp R K, Clowe C A, Pinkerton A A |
|
American Mineralogist 74 (1989) 764-773 |
|
Effects of oxidation-dehydrogenation in tschermakitic hornblende |
|
sample H-3, after annealing at 700 C |
|
_database_code_amcsd 0001251 |
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9.786 18.024 5.306 90 105.09 90 C2/m |
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atom x y z occ Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Al1 .28216 .08563 .30101 .390 0.0074 0.0066 0.0068 -.0009 .0006 .0002 |
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Si1 .28216 .08563 .30101 .610 0.0074 0.0066 0.0068 -.0009 .0006 .0002 |
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Si2 .29167 .17291 .81243 0.0073 0.0065 0.0077 .0001 .0019 .0011 |
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Fe1 0 .08686 .5 .443 0.0095 0.0118 0.0079 0 .0034 0 |
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Mg1 0 .08686 .5 .557 0.0095 0.0118 0.0079 0 .0034 0 |
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Fe2 0 .17738 0 .256 0.0073 0.0066 0.0081 0 .0017 0 |
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Mg2 0 .17738 0 .279 0.0073 0.0066 0.0081 0 .0017 0 |
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Al2 0 .17738 0 .430 0.0073 0.0066 0.0081 0 .0017 0 |
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Ti2 0 .17738 0 .035 0.0073 0.0066 0.0081 0 .0017 0 |
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Fe3 0 0 0 .454 0.0096 0.0041 0.0075 0 .0014 0 |
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Mg3 0 0 0 .546 0.0096 0.0041 0.0075 0 .0014 0 |
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Ca4 0 .27950 .5 .915 0.0112 0.0093 0.0106 0 .0055 0 |
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Na4 0 .27950 .5 .073 0.0112 0.0093 0.0106 0 .0055 0 |
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O1 .1073 .0896 .2141 0.0100 0.0180 0.0101 -.0027 .0020 -.0012 |
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O2 .1188 .1734 .7333 0.0065 0.0122 0.0116 .0002 .0005 .0014 |
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O3 .1093 0 .7142 0.0110 0.0140 0.0110 0 .0003 0 |
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O4 .3670 .2506 .7932 0.0146 0.0094 0.0160 -.0015 .0068 -.0010 |
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O5 .3501 .1394 .1066 0.0087 0.0160 0.0144 -.0002 .0018 .0058 |
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O6 .3441 .1195 .6019 0.0102 0.0140 0.0123 .0014 .0020 -.0042 |
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O7 .3371 0 .2870 0.0170 0.0160 0.0190 0 .0030 0 |
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Na2/m 0 .5 0 .560 0.2760 0.0900 0.3250 0 .2850 0 |
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H .291 .5 .263 .670 0.5 |
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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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