|
Apatite-(CaOH) |
 |
Hughes J M, Cameron M, Crowley K D |
 |
American Mineralogist 74 (1989) 870-876 |
|
Structural variations in natural F, OH, and Cl apatites |
|
Locality: Holly Springs, Georgia, USA |
|
_database_code_amcsd 0001260 |
|
9.4166 9.4166 6.8745 90 90 120 P6_3/m |
|
atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
|
Ca1 2/3 1/3 .00144 .00408 .00408 0.0033 .00204 0 0 |
|
Ca2 -.00657 .24706 .25 .00308 .00353 .00417 .00156 0 0 |
|
P .36860 .39866 .25 .00223 .00250 0.0034 .00127 0 0 |
|
O1 .4850 .3289 .25 0.0036 0.0044 0.0059 .0027 0 0 |
|
O2 .4649 .5871 .25 0.0035 0.0031 0.0105 .0016 0 0 |
|
O3 .2580 .3435 .0703 0.0050 0.0096 0.0070 .00505 -.0025 -.0041 |
|
O(H) 0 0 .1979 .5 0.0030 0.0030 0.012 .0015 0 0 |
|
H 0 0 .04 .5 3.3 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Apatite-(CaOH) |
|
Hughes J M, Cameron M, Mariano A N |
|
American Mineralogist 76 (1991) 1165-1173 |
|
Rare-earth-element ordering and structural variations in natural |
|
rare-earth-bearing apatites |
|
sample B from the Oka carbonatite |
|
_database_code_amcsd 0001376 |
|
9.4202 9.4202 6.9157 90 90 120 P6_3/m |
|
atom x y z occ Biso |
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Ca1 2/3 1/3 .0004 .939 1.101 |
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Na1 2/3 1/3 .0004 .010 1.101 |
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Ce1 2/3 1/3 .0004 .051 1.101 |
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Ca2 .99088 .24301 .25 .893 1.000 |
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Ce2 .99088 .24301 .25 .107 1.000 |
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P .36896 .39824 .25 .865 .73 |
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Si .36896 .39824 .25 .135 .73 |
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O1 .4842 .3261 .25 1.08 |
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O2 .4659 .5874 .25 1.35 |
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O3 .2567 .3421 .0708 1.72 |
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F 0 0 .25 .335 1.9 |
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OH 0 0 .304 .332 2.3 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Apatite-(CaOH) |
|
Wilson R M, Elliot J C, Dowker S E P |
|
American Mineralogist 84 (1999) 1406-1414 |
|
Rietveld refinement of the crystallographic structure of human dental |
|
enamel apatites |
|
Sample: H6L, synthetic |
|
_database_code_amcsd 0002297 |
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9.4081 9.4081 6.8887 90 90 120 P6_3/m |
|
atom x y z occ |
|
Ca1 2/3 1/3 .0007 |
|
Ca2 .2426 .9904 .25 |
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P .3948 .3657 .25 |
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O1 .3270 .4849 .25 |
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O2 .5791 .4618 .25 |
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O3 .3417 .2578 .0711 |
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Oh 0 0 .1837 .5 |
|
H 0 0 .0608 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Apatite-(CaOH) |
|
Wilson R M, Elliot J C, Dowker S E P |
|
American Mineralogist 84 (1999) 1406-1414 |
|
Rietveld refinement of the crystallographic structure of human dental |
|
enamel apatites |
|
Sample: H6G, synthetic |
|
_database_code_amcsd 0002298 |
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9.4394 9.4394 6.8861 90 90 120 P6_3/m |
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atom x y z occ |
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Ca1 2/3 1/3 .0021 |
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Ca2 .2478 .9917 .25 |
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P .3995 .3691 .25 |
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O1 .3319 .4862 .25 |
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O2 .5806 .4614 .25 |
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O3 .3437 .2593 .0697 |
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OH 0 0 .1906 .5 |
|
H 0 0 .0608 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Apatite-(CaOH) |
|
Wilson R M, Elliot J C, Dowker S E P |
|
American Mineralogist 84 (1999) 1406-1414 |
|
Rietveld refinement of the crystallographic structure of human dental |
|
enamel apatites |
|
Sample: H6M, synthetic |
|
_database_code_amcsd 0002299 |
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9.4172 9.4172 6.8799 90 90 120 P6_3/m |
|
atom x y z occ |
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Ca1 2/3 1/3 .0017 |
|
Ca2 .2467 .9933 .25 |
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P .3979 .3678 .25 |
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O1 .3275 .4844 .25 |
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O2 .5860 .4649 .25 |
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O3 .3424 .2577 .0685 |
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OH 0 0 .1999 .5 |
|
H 0 0 .0608 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Apatite-(CaOH) |
|
Wilson R M, Elliot J C, Dowker S E P |
|
American Mineralogist 84 (1999) 1406-1414 |
|
Rietveld refinement of the crystallographic structure of human dental |
|
enamel apatites |
|
Sample: Prep.63b, synthetic |
|
_database_code_amcsd 0002300 |
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9.4232 9.4232 6.8833 90 90 120 P6_3/m |
|
atom x y z occ |
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Ca1 2/3 1/3 .0014 |
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Ca2 .2469 .9931 .25 |
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P .3984 .3679 .25 |
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O1 .3273 .4848 .25 |
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O2 .5852 .4635 .25 |
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O3 .3415 .2565 .0690 |
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OH 0 0 .1917 .5 |
|
H 0 0 .0608 .5 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Apatite-(CaOH) |
|
Wilson R M, Elliot J C, Dowker S E P |
|
American Mineralogist 84 (1999) 1406-1414 |
|
Rietveld refinement of the crystallographic structure of human dental |
|
enamel apatites |
|
Sample: RC1 - enamel |
|
_database_code_amcsd 0002301 |
|
9.4623 9.4623 6.8863 90 90 120 P6_3/m |
|
atom x y z occ |
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Ca1 2/3 1/3 .0014 .97 |
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Na1 2/3 1/3 .0014 .02 |
|
Mg1 2/3 1/3 .0014 .01 |
|
Ca2 .2450 .9895 .25 .93 |
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Na2 .2450 .9895 .25 .02 |
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Mg2 .2450 .9895 .25 .01 |
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P .3987 .3697 .25 .92 |
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O1 .3317 .4864 .25 .91 |
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O2 .5752 .4555 .25 .95 |
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O3 .3427 .2587 .0734 .89 |
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Oh 0 0 .1880 .48 |
|
H 0 0 .0608 .58 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Apatite-(CaOH) |
|
Wilson R M, Elliot J C, Dowker S E P |
|
American Mineralogist 84 (1999) 1406-1414 |
|
Rietveld refinement of the crystallographic structure of human dental |
|
enamel apatites |
|
Sample: RC7 - enamel |
|
_database_code_amcsd 0002302 |
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9.4512 9.4512 6.8803 90 90 120 P6_3/m |
|
atom x y z occ |
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Ca1 2/3 1/3 .0042 .97 |
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Na1 2/3 1/3 .0042 .02 |
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Mg1 2/3 1/3 .0042 .01 |
|
Ca2 .2457 .9896 .25 .93 |
|
Na2 .2457 .9896 .25 .02 |
|
Mg2 .2457 .9896 .25 .01 |
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P .3982 .3686 .25 .93 |
|
O1 .3283 .4859 .25 .89 |
|
O2 .5754 .4551 .25 |
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O3 .3359 .2526 .0699 .88 |
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Oh 0 0 .1881 .52 |
|
H 0 0 .0608 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Apatite-(CaOH) |
|
Wilson R M, Elliot J C, Dowker S E P |
|
American Mineralogist 84 (1999) 1406-1414 |
|
Rietveld refinement of the crystallographic structure of human dental |
|
enamel apatites |
|
Sample: RC8 - enamel |
|
_database_code_amcsd 0002303 |
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9.4343 9.4343 6.8681 90 90 120 P6_3/m |
|
atom x y z occ |
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Ca1 2/3 1/3 .0024 .97 |
|
Na1 2/3 1/3 .0024 .02 |
|
Mg1 2/3 1/3 .0024 .01 |
|
Ca2 .2442 .9880 .25 .92 |
|
Na2 .2442 .9880 .25 .02 |
|
Mg2 .2442 .9880 .25 .01 |
|
P .3975 .3668 .25 .87 |
|
O1 .3254 .4863 .25 .91 |
|
O2 .5684 .4542 .25 |
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O3 .3445 .2604 .0697 .94 |
|
Oh 0 0 .1747 .57 |
|
H 0 0 .0608 .23 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Apatite-(CaOH) |
|
Wilson R M, Elliot J C, Dowker S E P |
|
American Mineralogist 84 (1999) 1406-1414 |
|
Rietveld refinement of the crystallographic structure of human dental |
|
enamel apatites |
|
Sample: RE1 - enamel |
|
_database_code_amcsd 0002304 |
|
9.4564 9.4564 6.8821 90 90 120 P6_3/m |
|
atom x y z occ |
|
Ca1 2/3 1/3 .0041 .97 |
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Na1 2/3 1/3 .0041 .02 |
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Mg1 2/3 1/3 .0041 .01 |
|
Ca2 .2437 .9888 .25 .93 |
|
Na2 .2437 .9888 .25 .02 |
|
P .3969 .3669 .25 .93 |
|
O1 .3317 .4902 .25 .87 |
|
O2 .5739 .4562 .25 .98 |
|
O3 .3398 .2567 .0693 .87 |
|
Oh 0 0 .1857 .52 |
|
H 0 0 .0608 .88 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Apatite-(CaOH) |
|
Wilson R M, Elliot J C, Dowker S E P |
|
American Mineralogist 84 (1999) 1406-1414 |
|
Rietveld refinement of the crystallographic structure of human dental |
|
enamel apatites |
|
Sample: RE2 - enamel |
|
_database_code_amcsd 0002305 |
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9.4598 9.4598 6.8865 90 90 120 P6_3/m |
|
atom x y z occ |
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Ca1 2/3 1/3 .0024 .97 |
|
Na1 2/3 1/3 .0024 .02 |
|
Mg1 2/3 1/3 .0024 .01 |
|
Ca2 .2452 .9905 .25 .93 |
|
Na2 .2452 .9905 .25 .02 |
|
P .3977 .3696 .25 .93 |
|
O1 .3327 .4875 .25 .89 |
|
O2 .5779 .4602 .25 |
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O3 .3364 .2532 .0716 .85 |
|
Oh 0 0 .1881 .48 |
|
H 0 0 .0608 .79 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Apatite-(CaOH) |
|
Wilson R M, Elliot J C, Dowker S E P |
|
American Mineralogist 84 (1999) 1406-1414 |
|
Rietveld refinement of the crystallographic structure of human dental |
|
enamel apatites |
|
Sample: RFP - enamel |
|
_database_code_amcsd 0002306 |
|
9.4592 9.4592 6.8816 90 90 120 P6_3/m |
|
atom x y z occ |
|
Ca1 2/3 1/3 .0007 .97 |
|
Na1 2/3 1/3 .0007 .02 |
|
Mg1 2/3 1/3 .0007 .01 |
|
Ca2 .2463 .9893 .25 .92 |
|
Na2 .2463 .9893 .25 .02 |
|
P .3998 .3688 .25 .91 |
|
O1 .3286 .4869 .25 .91 |
|
O2 .5772 .4558 .25 .95 |
|
O3 .3444 .2599 .0716 .92 |
|
Oh 0 0 .1748 .55 |
|
H 0 0 .0608 .62 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Apatite-(CaOH) |
|
Wilson R M, Elliot J C, Dowker S E P |
|
American Mineralogist 84 (1999) 1406-1414 |
|
Rietveld refinement of the crystallographic structure of human dental |
|
enamel apatites |
|
Sample: RFB - enamel |
|
_database_code_amcsd 0002307 |
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9.4586 9.4586 6.8811 90 90 120 P6_3/m |
|
atom x y z occ |
|
Ca1 2/3 1/3 .0026 .97 |
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Na1 2/3 1/3 .0026 .02 |
|
Mg1 2/3 1/3 .0026 .01 |
|
Ca2 .2460 .9899 .25 .94 |
|
Na2 .2460 .9899 .25 .02 |
|
P .3991 .3694 .25 .95 |
|
O1 .3337 .4875 .25 .91 |
|
O2 .5804 .4600 .25 .97 |
|
O3 .3414 .2579 .0704 .90 |
|
Oh 0 0 .1803 .50 |
|
H 0 0 .0608 .89 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Apatite-(CaOH) |
|
Wilson R M, Elliot J C, Dowker S E P |
|
American Mineralogist 84 (1999) 1406-1414 |
|
Rietveld refinement of the crystallographic structure of human dental |
|
enamel apatites |
|
Sample: RGP - enamel |
|
_database_code_amcsd 0002308 |
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9.4554 9.4554 6.8835 90 90 120 P6_3/m |
|
atom x y z occ |
|
Ca1 2/3 1/3 .0026 .97 |
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Na1 2/3 1/3 .0026 .02 |
|
Mg1 2/3 1/3 .0026 .01 |
|
Ca2 .2471 .9909 .25 .94 |
|
Na2 .2471 .9909 .25 .02 |
|
P .3996 .3692 .25 .94 |
|
O1 .3311 .4857 .25 .93 |
|
O2 .5805 .4599 .25 .98 |
|
O3 .3408 .2577 .0718 .91 |
|
Oh 0 0 .1818 .53 |
|
H 0 0 .0608 .81 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Apatite-(CaOH) |
|
Wilson R M, Elliot J C, Dowker S E P |
|
American Mineralogist 84 (1999) 1406-1414 |
|
Rietveld refinement of the crystallographic structure of human dental |
|
enamel apatites |
|
Sample: RGB - enamel |
|
_database_code_amcsd 0002309 |
|
9.4506 9.4506 6.8780 90 90 120 P6_3/m |
|
atom x y z occ |
|
Ca1 2/3 1/3 .0021 .97 |
|
Na1 2/3 1/3 .0021 .02 |
|
Mg1 2/3 1/3 .0021 .01 |
|
Ca2 .2464 .9907 .25 .94 |
|
Na2 .2464 .9907 .25 .02 |
|
Mg2 .2464 .9907 .25 .01 |
|
P .3992 .3692 .25 .95 |
|
O1 .3322 .4864 .25 .94 |
|
O2 .5802 .4608 .25 .97 |
|
O3 .3399 .2565 .0697 .92 |
|
Oh 0 0 .1851 .51 |
|
H 0 0 .0608 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Apatite-(CaOH) |
|
Wilson R M, Elliot J C, Dowker S E P |
|
American Mineralogist 84 (1999) 1406-1414 |
|
Rietveld refinement of the crystallographic structure of human dental |
|
enamel apatites |
|
Sample: RHP - enamel |
|
_database_code_amcsd 0002310 |
|
9.4586 9.4586 6.8809 90 90 120 P6_3/m |
|
atom x y z occ |
|
Ca1 2/3 1/3 .0019 .97 |
|
Na1 2/3 1/3 .0019 .02 |
|
Mg1 2/3 1/3 .0019 .01 |
|
Ca2 .2470 .9912 .25 .93 |
|
Na2 .2470 .9912 .25 .02 |
|
P .3999 .3691 .25 .92 |
|
O1 .3299 .4865 .25 .93 |
|
O2 .5781 .4568 .25 .96 |
|
O3 .3431 .2590 .0713 .92 |
|
Oh 0 0 .1785 .83 |
|
H 0 0 .0608 .73 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Apatite-(CaOH) |
|
Wilson R M, Elliot J C, Dowker S E P |
|
American Mineralogist 84 (1999) 1406-1414 |
|
Rietveld refinement of the crystallographic structure of human dental |
|
enamel apatites |
|
Sample: RHB - enamel |
|
_database_code_amcsd 0002311 |
|
9.4616 9.4616 6.8819 90 90 120 P6_3/m |
|
atom x y z occ |
|
Ca1 2/3 1/3 .0015 .97 |
|
Na1 2/3 1/3 .0015 .02 |
|
Mg1 2/3 1/3 .0015 .01 |
|
Ca2 .2476 .9914 .25 .93 |
|
Na2 .2476 .9914 .25 .02 |
|
P .3999 .3693 .25 .95 |
|
O1 .3301 .4847 .25 .94 |
|
O2 .5796 .4590 .25 .96 |
|
O3 .3436 .2592 .0706 .93 |
|
Oh 0 0 .1771 .54 |
|
H 0 0 .0608 .55 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Apatite-(CaOH) |
|
Wilson R M, Elliot J C, Dowker S E P |
|
American Mineralogist 84 (1999) 1406-1414 |
|
Rietveld refinement of the crystallographic structure of human dental |
|
enamel apatites |
|
Sample: RQ1 - enamel |
|
_database_code_amcsd 0002312 |
|
9.4584 9.4584 6.8808 90 90 120 P6_3/m |
|
atom x y z occ |
|
Ca1 2/3 1/3 .0019 .97 |
|
Na1 2/3 1/3 .0019 .02 |
|
Mg1 2/3 1/3 .0019 .01 |
|
Ca2 .2448 .9879 .25 .92 |
|
Na2 .2448 .9879 .25 .02 |
|
P .4025 .3693 .25 .92 |
|
O1 .3310 .4880 .25 .91 |
|
O2 .5821 .4574 .25 .96 |
|
O3 .3437 .2611 .0737 .91 |
|
Oh 0 0 .1817 .51 |
|
H 0 0 .0608 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Apatite-(CaOH) |
|
Fleet M E, Liu X, King P L |
|
American Mineralogist 89 (2004) 1422-1432 |
|
Accommodation of the carbonate ion in apatite: An FTIR and X-ray structure study |
|
of crystals synthesized at 2-4 GPa |
|
Sample: xt372 |
|
_database_code_amcsd 0003638 |
|
9.4234 9.4234 6.8801 90 90 120 P6_3/m |
|
atom x y z occ Uiso |
|
Ca1 2/3 1/3 .0017 .0148 |
|
Ca2 .99304 .24700 .25 .0137 |
|
P .3688 .3988 .25 .976 .0101 |
|
O1 .4845 .3289 .25 .0150 |
|
O2 .4649 .5866 .25 .0200 |
|
O3 .2580 .3432 .0714 .988 .0240 |
|
O4 0 0 .1950 .5 .023 |
|
H 0 0 .053 .72 .023 |
|
OB3 .36 .43 .47 .014 .025 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Apatite-(CaOH) |
|
Fleet M E, Liu X, King P L |
|
American Mineralogist 89 (2004) 1422-1432 |
|
Accommodation of the carbonate ion in apatite: An FTIR and X-ray structure study |
|
of crystals synthesized at 2-4 GPa |
|
Sample: xt374 |
|
_database_code_amcsd 0003639 |
|
9.4468 9.4468 6.8806 90 90 120 P6_3/m |
|
atom x y z occ Uiso |
|
Ca1 2/3 1/3 .0018 .0156 |
|
Ca2 .99268 .24830 .25 .0158 |
|
P .3689 .3993 .25 .0130 |
|
O1 .4845 .3287 .25 .0151 |
|
O2 .4649 .5862 .25 .0234 |
|
O3 .2587 .3435 .0710 .0285 |
|
O4 0 0 .1949 .5 .035 |
|
H 0 0 .53 .65 .035 |
|
C 0 0 0 .01 .025 |
|
OA12 .944 .126 .527 .012 .025 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Apatite-(CaOH) |
|
Sudarsanan K, Young R A |
 |
Acta Crystallographica B25 (1969) 1534-1543 |
|
Significant precision in crystal structural details: Holly Springs |
|
hydroxyapatite |
|
Locality: Holly Springs, Cherokee County, Georgia, USA |
|
Sample: X-23-4 |
|
_database_code_amcsd 0009357 |
|
9.424 9.424 6.879 90 90 120 P6_3/m |
|
atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
|
CaI 1/3 2/3 .0015 .0031 .0031 .0018 .00155 0 0 |
|
CaII .2468 .9934 .25 .0021 .0023 .0028 .0010 0 0 |
|
P .3987 .3685 .25 .0019 .0017 .0025 .0010 0 0 |
|
OI .3284 .4848 .25 .0039 .0030 .0054 .0027 0 0 |
|
OII .5873 .4651 .25 .0020 .0026 .0096 .0009 0 0 |
|
OIII .3437 .2579 .0702 .0092 .0042 .0049 .0045 -.0041 -.0027 |
|
Oh 0 0 .1950 .5 .0025 .0025 .0102 .00125 0 0 |
|
H 0 0 .0608 .5 .0129 .0129 .0104 .00645 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 (permalink) |
| |
|
Apatite-(CaOH) |
|
Sudarsanan K, Young R A |
|
Acta Crystallographica B25 (1969) 1534-1543 |
|
Significant precision in crystal structural details: Holly Springs |
|
hydroxyapatite |
|
Locality: Holly Springs, Cherokee County, Georgia, USA |
|
Sample: X-23-6 |
|
_database_code_amcsd 0009358 |
|
9.424 9.424 6.879 90 90 120 P6_3/m |
|
atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
|
CaI 1/3 2/3 .0014 .0031 .0031 .0021 .00155 0 0 |
|
CaII .2465 .9933 .25 .0021 .0021 .0031 .0010 0 0 |
|
P .3985 .3684 .25 .0018 .0017 .0027 .0010 0 0 |
|
OI .3282 .4846 .25 .0037 .0029 .0055 .0025 0 0 |
|
OII .5871 .4649 .25 .0018 .0028 .0097 .0010 0 0 |
|
OIII .3434 .2579 .0704 .0089 .0043 .0053 .0044 -.0038 -.0026 |
|
Oh 0 0 .1960 .5 .0026 .0026 .0095 .0013 0 0 |
|
H 0 0 .0608 .5 .0129 .0129 .0104 .00645 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 (permalink) |
| |
|
Apatite-(CaOH) |
|
Sudarsanan K, Young R A |
|
Acta Crystallographica B25 (1969) 1534-1543 |
|
Significant precision in crystal structural details: Holly Springs |
|
hydroxyapatite |
|
Locality: Holly Springs, Cherokee County, Georgia, USA |
|
Sample: X-23-10 |
|
_database_code_amcsd 0009359 |
|
9.424 9.424 6.879 90 90 120 P6_3/m |
|
atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
|
CaI 1/3 2/3 .0014 .0032 .0032 .0022 .0016 0 0 |
|
CaII .2468 .9934 .25 .0021 .0024 .0030 .0010 0 0 |
|
P .3987 .3685 .25 .0020 .0017 .0027 .0011 0 0 |
|
OI .3282 .4847 .25 .0040 .0029 .0054 .0026 0 0 |
|
OII .5872 .4652 .25 .0019 .0028 .0102 .0011 0 0 |
|
OIII .3438 .2581 .0704 .0087 .0045 .0053 .0044 -.0042 -.0024 |
|
Oh 0 0 .1955 .5 .0026 .0026 .0098 .0013 0 0 |
|
H 0 0 .0608 .5 .0129 .0129 .0104 .00645 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 (permalink) |
| |
|
Apatite-(CaOH) |
|
Sudarsanan K, Young R A |
|
Acta Crystallographica B25 (1969) 1534-1543 |
|
Significant precision in crystal structural details: Holly Springs |
|
hydroxyapatite |
|
Locality: Holly Springs, Cherokee County, Georgia, USA |
|
Sample: Neutron |
|
_database_code_amcsd 0009360 |
|
9.424 9.424 6.879 90 90 120 P6_3/m |
|
atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
|
CaI 1/3 2/3 .0013 .0033 .0033 .0024 .00165 0 0 |
|
CaII .2465 .9931 .25 .0024 .0025 .0030 .0012 0 0 |
|
P .3983 .3683 .25 .0018 .0020 .0026 .0009 0 0 |
|
OI .3282 .4846 .25 .0035 .0028 .0044 .0024 0 0 |
|
OII .5876 .4652 .25 .0020 .0024 .0089 .0009 0 0 |
|
OIII .3433 .2579 .0704 .0084 .0039 .0044 .0043 -.0034 -.0021 |
|
Oh 0 0 .1978 .5 .0025 .0025 .0101 .00125 0 0 |
|
H 0 0 .0608 .5 .0129 .0129 .0104 .00645 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 (permalink) |
| |
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