|
Sillimanite |
 |
Burt J B, Ross N L, Angel R J, Koch M |
 |
American Mineralogist 91 (2006) 319-326 |
|
Equations of state and structures of andalusite |
|
to 9.8 GPa and sillimanite to 8.5 GPa |
|
Locality: Okkamitiya Sabaragamuiwa province, Sri Lanka |
|
Sample: P = .0001 GPa |
|
_database_code_amcsd 0004109 |
|
7.48388 7.6726 5.76807 90 90 90 Pbnm |
|
atom x y z Biso |
|
Al1 0 0 0 .33 |
|
Al2 .14181 .3451 .25 .40 |
|
Si .15318 .3407 .75 .39 |
|
OA .3607 .4075 .75 .35 |
|
OB .3572 .4348 .25 .42 |
|
OC .4762 .0022 .75 .94 |
|
OD .1258 .2228 .5151 .54 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Sillimanite |
|
Burt J B, Ross N L, Angel R J, Koch M |
|
American Mineralogist 91 (2006) 319-326 |
|
Equations of state and structures of andalusite |
|
to 9.8 GPa and sillimanite to 8.5 GPa |
|
Locality: Okkamitiya Sabaragamuiwa province, Sri Lanka |
|
Sample: P = 1.548 GPa |
|
_database_code_amcsd 0004110 |
|
7.46040 7.6395 5.75840 90 90 90 Pbnm |
|
atom x y z Biso |
|
Al1 0 0 0 .40 |
|
Al2 .14164 .3439 .25 .49 |
|
Si .15356 .3414 .75 .37 |
|
OA .3614 .4054 .75 .41 |
|
OB .3562 .4337 .25 .44 |
|
OC .4756 .0040 .75 .94 |
|
OD .1261 .2223 .5148 .61 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Sillimanite |
|
Burt J B, Ross N L, Angel R J, Koch M |
|
American Mineralogist 91 (2006) 319-326 |
|
Equations of state and structures of andalusite |
|
to 9.8 GPa and sillimanite to 8.5 GPa |
|
Locality: Okkamitiya Sabaragamuiwa province, Sri Lanka |
|
Sample: P = 4.144 GPa |
|
_database_code_amcsd 0004111 |
|
7.42183 7.5868 5.74298 90 90 90 Pbnm |
|
atom x y z Biso |
|
Al1 0 0 0 .41 |
|
Al2 .1411 .3410 .25 .47 |
|
Si .15455 .3377 .75 .44 |
|
OA .3629 .4080 .75 .41 |
|
OB .3556 .4364 .25 .48 |
|
OC .4747 .0051 .75 .97 |
|
OD .1267 .2194 .5154 .59 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Sillimanite |
|
Burt J B, Ross N L, Angel R J, Koch M |
|
American Mineralogist 91 (2006) 319-326 |
|
Equations of state and structures of andalusite |
|
to 9.8 GPa and sillimanite to 8.5 GPa |
|
Locality: Okkamitiya Sabaragamuiwa province, Sri Lanka |
|
Sample: P = 5.750 GPa |
|
_database_code_amcsd 0004112 |
|
7.39939 7.5576 5.73421 90 90 90 Pbnm |
|
atom x y z Biso |
|
Al1 0 0 0 .28 |
|
Al2 .14001 .3378 .25 .31 |
|
Si .15466 .3363 .75 .28 |
|
OA .3639 .4142 .75 .41 |
|
OB .3545 .4452 .25 .42 |
|
OC .4738 .0047 .75 .85 |
|
OD .1275 .2162 .5154 .47 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Sillimanite |
|
Burt J B, Ross N L, Angel R J, Koch M |
|
American Mineralogist 91 (2006) 319-326 |
|
Equations of state and structures of andalusite |
|
to 9.8 GPa and sillimanite to 8.5 GPa |
|
Locality: Okkamitiya Sabaragamuiwa province, Sri Lanka |
|
Sample: P = 7.663 GPa |
|
_database_code_amcsd 0004113 |
|
7.3717 7.5243 5.72421 90 90 90 Pbnm |
|
atom x y z Biso |
|
Al1 0 0 0 .25 |
|
Al2 .1397 .3389 .25 .32 |
|
Si .1550 .3363 .75 .25 |
|
OA .3642 .4117 .75 .22 |
|
OB .3550 .4411 .25 .55 |
|
OC .4723 .0033 .75 .84 |
|
OD .1285 .2167 .5148 .47 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Andalusite |
|
Burt J B, Ross N L, Angel R J, Koch M |
|
American Mineralogist 91 (2006) 319-326 |
|
Equations of state and structures of andalusite |
|
to 9.8 GPa and sillimanite to 8.5 GPa |
|
Locality: Minas Gerais, Brazil |
|
Sample: P = .0001 GPa |
|
_database_code_amcsd 0004114 |
|
7.7930 7.89734 5.55583 90 90 90 Pnnm |
|
atom x y z Biso |
|
Al1 0 0 .2418 .44 |
|
Al2 .3703 .13879 .5 .41 |
|
Si .2465 .25237 0 .40 |
|
OA .4224 .3638 .5 .43 |
|
OB .4254 .3619 0 .42 |
|
OC .1017 .4012 0 .73 |
|
OD .2292 .1341 .2388 .52 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Andalusite |
|
Burt J B, Ross N L, Angel R J, Koch M |
|
American Mineralogist 91 (2006) 319-326 |
|
Equations of state and structures of andalusite |
|
to 9.8 GPa and sillimanite to 8.5 GPa |
|
Locality: Minas Gerais, Brazil |
|
Sample: P = 1.474 GPa |
|
_database_code_amcsd 0004115 |
|
7.7568 7.87268 5.54488 90 90 90 Pnnm |
|
atom x y z Biso |
|
Al1 0 0 .24198 .29 |
|
Al2 .3704 .13868 .5 .31 |
|
Si .2464 .25148 0 .28 |
|
OA .4217 .3630 .5 .3159 |
|
OB .4257 .3615 0 .36 |
|
OC .1018 .4004 0 .70 |
|
OD .2302 .13261 .2395 .45 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Andalusite |
|
Burt J B, Ross N L, Angel R J, Koch M |
|
American Mineralogist 91 (2006) 319-326 |
|
Equations of state and structures of andalusite |
|
to 9.8 GPa and sillimanite to 8.5 GPa |
|
Locality: Minas Gerais, Brazil |
|
Sample: P = 2.512 GPa |
|
_database_code_amcsd 0004116 |
|
7.7320 7.85659 5.53642 90 90 90 Pnnm |
|
atom x y z Biso |
|
Al1 0 0 .2415 .31 |
|
Al2 .3700 .13868 .5 .31 |
|
Si .2466 .25092 0 .301 |
|
OA .4208 .3637 .5 .37 |
|
OB .4270 .3608 0 .34 |
|
OC .1044 .4001 0 .67 |
|
OD .2296 .1320 .2400 .47 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Andalusite |
|
Burt J B, Ross N L, Angel R J, Koch M |
|
American Mineralogist 91 (2006) 319-326 |
|
Equations of state and structures of andalusite |
|
to 9.8 GPa and sillimanite to 8.5 GPa |
|
Locality: Minas Gerais, Brazil |
|
Sample: P = 3.129 GPa |
|
_database_code_amcsd 0004117 |
|
7.7186 7.8467 5.5329 90 90 90 Pnnm |
|
atom x y z Biso |
|
Al1 0 0 .24182 .299 |
|
Al2 .3699 .13831 .5 .321 |
|
Si .2466 .25083 0 .294 |
|
OA .4203 .3631 .5 .33 |
|
OB .4272 .3601 0 .32 |
|
OC .1020 .3998 0 .71 |
|
OD .2296 .13146 .2394 .44 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Andalusite |
|
Burt J B, Ross N L, Angel R J, Koch M |
|
American Mineralogist 91 (2006) 319-326 |
|
Equations of state and structures of andalusite |
|
to 9.8 GPa and sillimanite to 8.5 GPa |
|
Locality: Minas Gerais, Brazil |
|
Sample: P = 3.932 GPa |
|
_database_code_amcsd 0004118 |
|
7.7014 7.8354 5.52629 90 90 90 Pnnm |
|
atom x y z Biso |
|
Al1 0 0 .2419 .31 |
|
Al2 .3702 .13830 .5 .31 |
|
Si .2472 .25020 0 .28 |
|
OA .4215 .3635 .5 .35 |
|
OB .4259 .3599 0 .38 |
|
OC .1045 .3996 0 .70 |
|
OD .2289 .1315 .2398 .40 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Andalusite |
|
Burt J B, Ross N L, Angel R J, Koch M |
|
American Mineralogist 91 (2006) 319-326 |
|
Equations of state and structures of andalusite |
|
to 9.8 GPa and sillimanite to 8.5 GPa |
|
Locality: Minas Gerais, Brazil |
|
Sample: P = 5.441 GPa |
|
_database_code_amcsd 0004119 |
|
7.6704 7.81452 5.51589 90 90 90 Pnnm |
|
atom x y z Biso |
|
Al1 0 0 .2417 .30 |
|
Al2 .3695 .13774 .5 .30 |
|
Si .2475 .24974 0 .30 |
|
OA .4203 .3633 .5 .3304 |
|
OB .4287 .3584 0 .33 |
|
OC .10377 .3999 0 .75 |
|
OD .2292 .1303 .2399 .39 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Andalusite |
|
Burt J B, Ross N L, Angel R J, Koch M |
|
American Mineralogist 91 (2006) 319-326 |
|
Equations of state and structures of andalusite |
|
to 9.8 GPa and sillimanite to 8.5 GPa |
|
Locality: Minas Gerais, Brazil |
|
Sample: P = 7.565 GPa |
|
_database_code_amcsd 0004120 |
|
7.6313 7.78625 5.50175 90 90 90 Pnnm |
|
atom x y z Biso |
|
Al1 0 0 .2418 .30 |
|
Al2 .3694 .1378 .5 .36 |
|
Si .2471 .2485 0 .37 |
|
OA .4194 .3621 .5 .39 |
|
OB .4290 .3568 0 .37 |
|
OC .1038 .3990 0 .64 |
|
OD .2291 .1290 .2391 .37 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Andalusite |
|
Burt J B, Ross N L, Angel R J, Koch M |
|
American Mineralogist 91 (2006) 319-326 |
|
Equations of state and structures of andalusite |
|
to 9.8 GPa and sillimanite to 8.5 GPa |
|
Locality: Minas Gerais, Brazil |
|
Sample: P = 9.828 GPa |
|
_database_code_amcsd 0004121 |
|
7.5922 7.7600 5.4872 90 90 90 Pnnm |
|
atom x y z Biso |
|
Al1 0 0 .2418 .28 |
|
Al2 .3693 .1378 .5 .28 |
|
Si .2479 .24784 0 .28 |
|
OA .4187 .3631 .5 .33 |
|
OB .4309 .3562 0 .37 |
|
OC .1043 .4003 0 .77 |
|
OD .2288 .1285 .2393 .33 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Fizelyite |
|
Yang H, Downs R T, Burt J B, Costin G |
| |
The Canadian Mineralogist 47 (2009) 1257-1264 |
|
Structure refinement of an untwinned single crystal of Ag-excess fizelyite, |
|
Ag5.94Pb13.74Sb20.84S48 |
|
Locality: Van Silver mine, Squamish, British Columbia, Canada |
|
_database_code_amcsd 0006307 |
|
19.2767 13.2345 8.7230 90 90.401 90 P2_1/n |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Pb1 .25336 .90335 .39489 .03218 .03363 .03376 .02918 -.00773 .00202 -.00293 |
|
Pb2 .25021 .91738 -.09877 .03155 .03316 .02741 .03401 -.00215 -.00364 .00198 |
|
PbM1 .04887 .88423 .63069 .880 .02493 .02451 .02613 .02414 .00108 -.00147 -.00081 |
|
SbM1A .04887 .88423 .63069 .120 .02493 .02451 .02613 .02414 .00108 -.00147 -.00081 |
|
PbM2 .12809 .14880 .11639 .556 .02370 .02483 .01881 .02749 .00054 .00214 -.00003 |
|
SbM2A .12809 .14880 .11639 .095 .02370 .02483 .01881 .02749 .00054 .00214 -.00003 |
|
AgM2B .11798 .15008 .05462 .330 .09790 .10607 .02085 .16729 -.00852 .03758 .01501 |
|
Sb1 .34866 .12667 .64208 .02235 .02547 .02153 .02002 .00258 -.00127 .00073 |
|
Sb2 .44284 .88187 .62540 .02223 .01866 .02095 .02703 -.00002 -.00363 .00087 |
|
Sb3 .12784 .64666 .38066 .02162 .02210 .02009 .02266 -.00015 .00001 .00015 |
|
Sb4 -.05363 .63074 .63687 .02269 .02175 .02430 .02198 -.00106 -.00151 -.00148 |
|
Sb5 .05207 .87500 .14416 .02161 .02015 .02221 .02248 -.00328 .00023 .00136 |
|
Ag1 .14372 .17987 -.39271 .755 .04637 .03757 .05093 .05059 .02238 -.00231 .01009 |
|
Ag1B .13336 .16903 -.34655 .192 .02802 .01722 .02421 .04261 .00972 -.00172 -.01177 |
|
Ag2 .17332 .11542 .33880 .209 .04046 .03250 .02228 .06699 -.01154 .02738 -.01545 |
|
S1 .39464 .00414 -.16482 .02295 .02652 .02387 .01844 .00093 -.00093 -.00012 |
|
S2 -.00030 .72559 .84772 .03224 .03281 .04091 .02299 -.01066 -.00048 -.00504 |
|
S3 .23047 .04647 -.35532 .02388 .02212 .02285 .02664 .00538 -.00274 -.00133 |
|
S4 .33643 .78508 .62657 .02409 .02311 .02370 .02543 -.00431 -.00148 .00414 |
|
S5 .09962 .96916 .93084 .03017 .02782 .03657 .02607 -.01035 -.00319 .00649 |
|
S6 .16607 .75761 .58753 .02259 .02099 .02423 .02255 -.00224 .00164 -.00006 |
|
S7 .39728 .00309 .43327 .02244 .02552 .02419 .01761 -.00100 -.00037 .00214 |
|
S8 -.01999 .75146 .43163 .02524 .02147 .03394 .02032 -.00031 -.00022 .00161 |
|
S9 .25856 .06015 .13720 .02554 .02368 .02174 .03125 -.00530 .00284 -.00045 |
|
S10 -.16860 .70588 .64858 .02635 .01687 .03400 .02820 -.00154 .00070 .00429 |
|
S11 .08702 .99048 .34882 .02929 .03761 .02633 .02392 -.00053 -.00064 -.00351 |
|
S12 .15766 .76730 .16853 .02366 .02469 .02470 .02158 -.00071 -.00048 .00194 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Wilkinsonite |
|
Burt J B, Downs R T, Costin G |
 |
Acta Crystallographica E63 (2007) i122-i124 |
|
Single-crystal X-ray refinement of wilkinsonite, Na2Fe2+4Fe3+2Si6O20. |
|
Locality: Warrumbungle Volcano, central New South Wales, Australia |
|
_database_code_amcsd 0010476 |
|
10.3355 10.7847 8.9142 105.048 96.461 125.302 P-1 |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Na1 .21036 .63125 .38834 .01308 .01321 .01409 .01308 .00920 .00318 .00594 |
|
Na2 .66109 .61279 .37244 .01558 .01086 .01320 .01675 .00442 .00296 .00733 |
|
Fe1 0 0 .5 .5 .00893 .00765 .00758 .01054 .00497 .00108 .00270 |
|
Fe2 0 .5 0 .5 .00792 .00626 .00853 .00711 .00417 .00190 .00219 |
|
Fe3 .31905 .85202 .17897 .00742 .00687 .00730 .00832 .00475 .00202 .00296 |
|
Fe4 .76728 .82004 .15109 .00742 .00679 .00778 .00715 .00459 .00230 .00234 |
|
Fe5 .09363 .93553 .05864 .01104 .00914 .01221 .01226 .00646 .00323 .00645 |
|
Fe6 .59487 .94132 .06557 .00708 .00779 .00659 .00733 .00437 .00305 .00366 |
|
Fe7 .99381 .73633 .26446 .00706 .00583 .00704 .00751 .00423 .00170 .00166 |
|
Si1 .47856 .23504 .33068 .00584 .00534 .00565 .00726 .00345 .00262 .00339 |
|
Si2 .98595 .23337 .34225 .00495 .00550 .00606 .00513 .00425 .00258 .00275 |
|
Si3 .79150 .33856 .24104 .00509 .00492 .00506 .00563 .00320 .00198 .00240 |
|
Si4 .72159 .66157 .77590 .00559 .00542 .00580 .00606 .00384 .00170 .00235 |
|
Si5 .64857 .94629 .44736 .00608 .00587 .00739 .00602 .00434 .00228 .00352 |
|
Si6 .35235 .55640 .04592 .00539 .00472 .00398 .00566 .00217 .00119 .00130 |
|
O1 .35818 .06889 .16487 .00790 .00911 .00842 .00716 .00623 .00296 .00253 |
|
O2 .86095 .06772 .17513 .00799 .00704 .00920 .00911 .00578 .00366 .00338 |
|
O3 .55580 .95318 .29564 .00787 .00448 .00930 .00941 .00387 .00272 .00433 |
|
O4 .01485 .93349 .27479 .00762 .00610 .00878 .00816 .00468 .00199 .00385 |
|
O5 .24029 .87626 .39573 .00945 .01098 .00804 .01162 .00728 .00554 .00284 |
|
O6 .75486 .88351 .39477 .00751 .00727 .00750 .00906 .00534 .00282 .00323 |
|
O7 .50726 .80265 .50559 .00809 .00560 .00841 .00810 .00317 .00228 .00380 |
|
O8 .95777 .78451 .49264 .00658 .00526 .00806 .00804 .00466 .00229 .00415 |
|
O9 .89916 .32134 .37379 .00739 .00841 .00935 .00840 .00721 .00298 .00450 |
|
O10 .59320 .66083 .64779 .00691 .00778 .00802 .00535 .00540 .00270 .00196 |
|
O11 .33560 .82749 .92558 .00777 .00503 .00576 .00752 .00210 -.00067 .00072 |
|
O12 .84312 .83177 .93604 .00788 .00332 .00772 .00847 .00214 .00076 .00189 |
|
O13 .52551 .71191 .03936 .00860 .00782 .00853 .00988 .00496 .00362 .00453 |
|
O14 .06659 .72728 .06868 .00815 .00958 .00689 .00795 .00491 .00272 .00382 |
|
O15 .24054 .60582 .11124 .00724 .00785 .00853 .00698 .00686 .00162 .00119 |
|
O16 .74816 .60204 .12861 .00747 .00584 .00878 .00792 .00526 .00065 .00255 |
|
O17 .59950 .50029 .81427 .00792 .00773 .00950 .01125 .00725 .00310 .00562 |
|
O18 .93448 .50527 .21937 .00944 .00638 .00991 .00954 .00388 .00306 .00382 |
|
O19 .83356 .63351 .68068 .00757 .00620 .00462 .00978 .00233 .00378 .00249 |
|
O20 .67365 .36341 .33607 .00814 .00798 .00711 .00905 .00485 .00347 .00240 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
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