|
Tremolite |
 |
Oberti R, Ungaretti L, Cannillo E, Hawthorne F C, Memmi I |
| |
European Journal of Mineralogy 7 (1995) 1049-1063 |
|
Temperature-dependent Al order-disorder in the |
|
tetrahedral double chain of C2/m amphiboles |
|
Sample: S(1) |
|
_database_code_amcsd 0006601 |
|
9.810 18.091 5.294 90 104.58 90 C2/m |
|
atom x y z occ Biso |
|
NaA 0 1/2 0 .022 1.82 |
|
KA 0 1/2 0 .008 1.82 |
|
NaAm .0282 1/2 .0573 .022 2.52 |
|
KAm .0282 1/2 .0573 .008 2.52 |
|
NaA2 0 .4807 0 .022 2.50 |
|
KA2 0 .4807 0 .008 2.50 |
|
FeM1 0 .0886 1/2 .22 .59 |
|
MgM1 0 .0886 1/2 .78 .59 |
|
AlM2 0 .1771 0 .08 .55 |
|
FeM2 0 .1771 0 .21 .55 |
|
MgM2 0 .1771 0 .71 .55 |
|
AlM3 0 0 0 .05 .68 |
|
FeM3 0 0 0 .28 .68 |
|
MgM3 0 0 0 .67 .68 |
|
CaM4 0 .2778 1/2 .4175 .89 |
|
NaM4 0 .2778 1/2 .01 .89 |
|
MnM4 0 .2778 1/2 .0075 .89 |
|
FeM4 0 .2778 1/2 .065 .89 |
|
CaM4' 0 .2528 1/2 .4175 2.48 |
|
NaM4' 0 .2528 1/2 .01 2.48 |
|
MnM4' 0 .2528 1/2 .0075 2.48 |
|
FeM4' 0 .2528 1/2 .065 2.48 |
|
SiT1 .2808 .0846 .2964 .845 .53 |
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AlT1 .2808 .0846 .2964 .155 .53 |
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SiT2 .2900 .1715 .8055 .59 |
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H .2013 0 .7459 .9865 .80 |
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O1 .1099 .0878 .2149 .77 |
|
O2 .1202 .1727 .7279 .69 |
|
O3 .1104 0 .7132 .9865 .84 |
|
F3 .1104 0 .7132 .0135 .84 |
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O4 .3672 .2483 .7901 .96 |
|
O5 .3476 .1360 .1002 1.05 |
|
O6 .3437 .1185 .5919 .97 |
|
O7 .3368 0 .2878 1.09 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Magnesiohornblende |
|
Oberti R, Ungaretti L, Cannillo E, Hawthorne F C, Memmi I |
| |
European Journal of Mineralogy 7 (1995) 1049-1063 |
|
Temperature-dependent Al order-disorder in the |
|
tetrahedral double chain of C2/m amphiboles |
|
Sample: S(3) |
|
_database_code_amcsd 0006602 |
|
9.856 18.078 5.311 90 104.85 90 C2/m |
|
atom x y z occ Biso |
|
NaA 0 1/2 0 .056 1.61 |
|
KA 0 1/2 0 .026 1.61 |
|
NaAm .0436 1/2 .0924 .056 1.33 |
|
KAm .0436 1/2 .0924 .026 1.33 |
|
NaA2 0 .4700 0 .056 2.50 |
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KA2 0 .4700 0 .026 2.50 |
|
FeM1 0 .0888 1/2 .3 .54 |
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MgM1 0 .0888 1/2 .7 .54 |
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AlM2 0 .1777 0 .11 .47 |
|
TiM2 0 .1777 0 .075 .47 |
|
FeM2 0 .1777 0 .26 .47 |
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MgM2 0 .1777 0 .555 .47 |
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AlM3 0 0 0 .03 .49 |
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FeM3 0 0 0 .34 .49 |
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MgM3 0 0 0 .63 .49 |
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CaM4 0 .2789 1/2 .4525 .88 |
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MnM4 0 .2789 1/2 .005 .88 |
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FeM4 0 .2789 1/2 .0425 .88 |
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CaM4' 0 .2533 1/2 .4525 .69 |
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MnM4' 0 .2533 1/2 .005 .69 |
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FeM4' 0 .2533 1/2 .0425 .69 |
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SiT1 .2804 .0850 .2987 .78 .44 |
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AlT1 .2804 .0850 .2987 .22 .44 |
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SiT2 .2901 .1718 .8082 .95 .51 |
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AlT2 .2901 .1718 .8082 .05 .51 |
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H .1950 0 .7587 .9765 .5 |
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O1 .1090 .0884 .2150 .69 |
|
O2 .1194 .1734 .7296 .71 |
|
O3 .1105 0 .7138 .9765 .78 |
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F3 .1105 0 .7138 .0235 .78 |
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O4 .3676 .2489 .7908 .91 |
|
O5 .3479 .1369 .1043 .96 |
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O6 .3429 .1183 .5958 .93 |
|
O7 .3356 0 .2863 1.03 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Pargasite |
|
Oberti R, Ungaretti L, Cannillo E, Hawthorne F C, Memmi I |
| |
European Journal of Mineralogy 7 (1995) 1049-1063 |
|
Temperature-dependent Al order-disorder in the |
|
tetrahedral double chain of C2/m amphiboles |
|
Sample: S(5) |
|
_database_code_amcsd 0006603 |
|
9.869 18.058 5.320 90 105.03 90 C2/m |
|
atom x y z occ Biso |
|
NaA 0 1/2 0 .078 3.54 |
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KA 0 1/2 0 .02 3.54 |
|
NaAm .0362 1/2 .0719 .078 4.89 |
|
KAm .0362 1/2 .0719 .02 4.89 |
|
NaA2 0 .4670 0 .078 1.90 |
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KA2 0 .4670 0 .02 1.90 |
|
FeM1 0 .0888 1/2 .31 .57 |
|
MgM1 0 .0888 1/2 .69 .57 |
|
AlM2 0 .1779 0 .15 .52 |
|
TiM2 0 .1779 0 .105 .52 |
|
FeM2 0 .1779 0 .245 .52 |
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MgM2 0 .1779 0 .5 .52 |
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AlM3 0 0 0 .05 .51 |
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FeM3 0 0 0 .35 .51 |
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MgM3 0 0 0 .6 .51 |
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CaM4 0 .2798 1/2 .4625 .83 |
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NaM4 0 .2798 1/2 .01 .83 |
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MnM4 0 .2798 1/2 .005 .83 |
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FeM4 0 .2798 1/2 .0225 .83 |
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CaM4' 0 .2541 1/2 .4625 .70 |
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NaM4' 0 .2541 1/2 .01 .70 |
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MnM4' 0 .2541 1/2 .005 .70 |
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FeM4' 0 .2541 1/2 .0225 .70 |
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SiT1 .2806 .0852 .3007 .9475 .44 |
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AlT1 .2806 .0852 .3007 .0525 .44 |
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SiT2 .2906 .1721 .8111 .925 .48 |
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AlT2 .2906 .1721 .8111 .075 .48 |
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H .1903 0 .7648 .979 2.94 |
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O1 .1080 .0888 .2152 .73 |
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O2 .1187 .1738 .7327 .71 |
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O3 .1095 0 .7141 .979 .79 |
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F3 .1095 0 .7141 .021 .79 |
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O4 .3685 .2496 .7906 .93 |
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O5 .3492 .1386 .1095 .96 |
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O6 .3429 .1177 .6012 1.00 |
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O7 .3360 0 .2821 1.14 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Pargasite |
|
Oberti R, Ungaretti L, Cannillo E, Hawthorne F C, Memmi I |
| |
European Journal of Mineralogy 7 (1995) 1049-1063 |
|
Temperature-dependent Al order-disorder in the |
|
tetrahedral double chain of C2/m amphiboles |
|
Sample: S(6) |
|
Note: O(5) y-coordinate changed to reproduce reported bond lengths |
|
_database_code_amcsd 0006604 |
|
9.867 18.044 5.318 90 105.06 90 C2/m |
|
atom x y z occ Biso |
|
NaA 0 1/2 0 .09 5.76 |
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KA 0 1/2 0 .02 5.76 |
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NaAm .0341 1/2 .0664 .09 3.97 |
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KAm .0341 1/2 .0664 .02 3.97 |
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NaA2 0 .4664 0 .09 5.09 |
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KA2 0 .4664 0 .02 5.09 |
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MgM1 0 .0889 1/2 .69 .63 |
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FeM1 0 .0889 1/2 .31 .63 |
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MgM2 0 .1779 0 .49 .58 |
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AlM2 0 .1779 0 .16 .58 |
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TiM2 0 .1779 0 .105 .58 |
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FeM2 0 .1779 0 .235 .58 |
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NiM2 0 .1779 0 .005 .58 |
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ZnM2 0 .1779 0 .005 .58 |
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MgM3 0 0 0 .61 .55 |
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AlM3 0 0 0 .05 .55 |
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FeM3 0 0 0 .34 .55 |
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CaM4 0 .2799 1/2 .46 .90 |
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MnM4 0 .2799 1/2 .005 .90 |
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FeM4 0 .2799 1/2 .035 .90 |
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CaM4' 0 .2526 1/2 .46 .76 |
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MnM4' 0 .2526 1/2 .005 .76 |
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FeM4' 0 .2526 1/2 .035 .76 |
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AlT1 .2806 .0853 .3011 .05 .48 |
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SiT1 .2806 .0853 .3011 .95 .48 |
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AlT2 .2907 .1721 .8116 .10 .52 |
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SiT2 .2907 .1721 .8116 .90 .52 |
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H .1897 0 .7511 .986 2.51 |
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O1 .1079 .0889 .2147 .77 |
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O2 .1186 .1740 .7330 .73 |
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O3 .1093 0 .7143 .986 .81 |
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F3 .1093 0 .7143 .014 .81 |
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O4 .3687 .2497 .7905 .97 |
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O5 .3492 .1386 .1104 1.00 |
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O6 .3428 .1176 .6017 1.03 |
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O7 .3358 0 .2819 1.20 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Pargasite |
|
Oberti R, Ungaretti L, Cannillo E, Hawthorne F C, Memmi I |
| |
European Journal of Mineralogy 7 (1995) 1049-1063 |
|
Temperature-dependent Al order-disorder in the |
|
tetrahedral double chain of C2/m amphiboles |
|
Sample: S(7) |
|
_database_code_amcsd 0006605 |
|
9.870 18.046 5.318 90 105.04 90 C2/m |
|
atom x y z occ Biso |
|
NaA 0 1/2 0 .092 3.03 |
|
KA 0 1/2 0 .02 3.03 |
|
NaAm .0408 1/2 .0875 .092 4.20 |
|
KAm .0408 1/2 .0875 .02 4.20 |
|
NaA2 0 .491 0 .092 2.79 |
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KA2 0 .491 0 .02 2.79 |
|
MgM1 0 .0887 1/2 .71 .60 |
|
FeM1 0 .0887 1/2 .29 .60 |
|
MgM2 0 .1778 0 .505 .54 |
|
AlM2 0 .1778 0 .125 .54 |
|
TiM2 0 .1778 0 .165 .54 |
|
FeM2 0 .1778 0 .205 .54 |
|
MgM3 0 0 0 .63 .54 |
|
AlM3 0 0 0 .05 .54 |
|
FeM3 0 0 0 .32 .54 |
|
NaM4 0 .2803 1/2 .0025 .74 |
|
CaM4 0 .2803 1/2 .4575 .74 |
|
MnM4 0 .2803 1/2 .005 .74 |
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FeM4 0 .2803 1/2 .035 .74 |
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NaM4' 0 .2580 1/2 .0025 .62 |
|
CaM4' 0 .2580 1/2 .4575 .62 |
|
MnM4' 0 .2580 1/2 .005 .62 |
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FeM4' 0 .2580 1/2 .035 .62 |
|
AlT1 .2807 .0853 .3011 .065 .47 |
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SiT1 .2807 .0853 .3011 .935 .47 |
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AlT2 .2907 .1722 .8114 .1075 .50 |
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SiT2 .2907 .1722 .8114 .8925 .50 |
|
H .2003 0 .7683 .979 1.53 |
|
O1 .1080 .0886 .2154 .72 |
|
O2 .1186 .1738 .7329 .72 |
|
O3 .1094 0 .7144 .979 .81 |
|
F3 .1094 0 .7144 .021 .81 |
|
O4 .3684 .2498 .7903 .94 |
|
O5 .3493 .1389 .1102 1.00 |
|
O6 .3431 .1174 .6022 1.03 |
|
O7 .3368 0 .2812 1.19 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Magnesiocarpholite |
|
Fuchs Y, Mellini M, Memmi I |
| |
European Journal of Mineralogy 13 (2001) 533-543 |
|
Crystal-chemistry of magnesiocarpholite: controversial X-ray |
|
diffraction, Mossbauer, FTIR and Raman results |
|
Locality: Monte Argentario |
|
_database_code_amcsd 0006870 |
|
13.716 20.084 5.110 90 90 90 *Ccca |
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0 -.25 -.25 |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
K 0 .75 .25 .004 .0100 |
|
MgM1 0 .87500 .75 .65 .0084 .0068 .0091 .0094 0 .0014 0 |
|
FeM1 0 .87500 .75 .35 .0084 .0068 .0091 .0094 0 .0014 0 |
|
Al1 .19088 .75 .75 .985 .0060 .0060 .0061 .0060 0 0 .0004 |
|
Al2 0 .96131 .25 .985 .0066 .0057 .0075 .0066 0 0 0 |
|
Si .19355 .87981 .4167 .0059 .0051 .0065 .0062 .0005 .0000 .0002 |
|
O1 .20599 .79991 .4310 .0081 .0085 .0070 .0089 .0005 .0007 .0001 |
|
O2 .08047 .89933 .4085 .0084 .0070 .0096 .0087 .0014 .0002 .0015 |
|
O3 .24801 .91275 .6711 .0091 .0097 .0096 .0080 -.0001 -.0025 -.0003 |
|
Oh1 .09973 .80978 .8791 .987 .0113 .0108 .0126 .0106 .0031 .0005 .0003 |
|
F1 .09973 .80978 .8791 .038 .0113 .0108 .0126 .0106 .0031 .0005 .0003 |
|
Oh2 .06810 .96589 .9273 .987 .0083 .0058 .0103 .0087 .0006 .0009 .0008 |
|
F2 .06810 .96589 .9273 .038 .0083 .0058 .0103 .0087 .0006 .0009 .0008 |
|
H1 -.093 .801 .506 .987 .0610 |
|
H2 .134 .963 .916 .987 .0240 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Magnesiocarpholite |
|
Fuchs Y, Mellini M, Memmi I |
| |
European Journal of Mineralogy 13 (2001) 533-543 |
|
Crystal-chemistry of magnesiocarpholite: controversial X-ray |
|
diffraction, Mossbauer, FTIR and Raman results |
|
Locality: Monte Leoni |
|
_database_code_amcsd 0006871 |
|
13.726 20.099 5.112 90 90 90 *Ccca |
|
0 -.25 -.25 |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
K 0 .75 .25 .004 .0100 |
|
MgM1 0 .87524 .75 .65 .0073 .0058 .0079 .0084 0 .0013 0 |
|
FeM1 0 .87524 .75 .35 .0073 .0058 .0079 .0084 0 .0013 0 |
|
Al1 .19117 .75 .75 .99 .0056 .0054 .0052 .0061 0 0 .0004 |
|
Al2 0 .96128 .25 .99 .0053 .0048 .0057 .0056 0 -.0001 0 |
|
Si .19351 .87978 .4167 .0048 .0041 .0053 .0052 .0008 .0001 .0002 |
|
O1 .20620 .79982 .4313 .0069 .0070 .0055 .0081 .0006 .0005 .0002 |
|
O2 .08032 .89928 .4098 .0073 .0052 .0088 .0078 .0014 .0000 .0013 |
|
O3 .24835 .91283 .6708 .0078 .0086 .0074 .0074 -.0004 -.0020 .0008 |
|
Oh1 .09982 .80994 .8767 .99 .0101 .0090 .0105 .0107 .0040 .0000 -.0003 |
|
F1 .09982 .80994 .8767 .03 .0101 .0090 .0105 .0107 .0040 .0000 -.0003 |
|
Oh2 .06814 .96580 .9278 .99 .0071 .0046 .0088 .0079 .0010 .0008 .0003 |
|
F2 .06814 .96580 .9278 .03 .0071 .0046 .0088 .0079 .0010 .0008 .0003 |
|
H1 -.90 .801 .495 .99 .0680 |
|
H2 .129 .959 .925 .99 .0310 |
|
|
| 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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