|
Hopeite |
 |
Hill R J, Jones J B |
 |
American Mineralogist 61 (1976) 987-995 |
|
The crystal structure of hopeite |
|
10.597 18.318 5.031 90 90 90 Pnma |
|
atom x y z B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
|
Zn1 .26365 .25 .07280 .00261 .00129 .01055 0 -.00038 0 |
|
Zn2 .14273 .49915 .20780 .00219 .00098 .00887 -.00003 -.00001 -.00015 |
|
P .39710 .40580 .22561 .00258 .00072 .00932 .00011 -.00020 .00017 |
|
Wat1 .1065 .75 .2579 .0036 .0018 .0139 0 -.0008 0 |
|
Wat2 .1143 .25 .3480 .0028 .0028 .0178 0 .0018 0 |
|
Wat3 .3367 .6695 .3372 .0045 .0016 .0267 .0007 .0015 .0004 |
|
O4 .3599 .3275 .2838 .0055 .0010 .0145 -.0008 -.0027 .0006 |
|
O5 .1003 .5795 .4283 .0094 .0013 .0117 .0012 -.0023 -.0009 |
|
O6 .0250 .4217 .1433 .0026 .0011 .0259 -.0003 .0010 -.0010 |
|
OH7 .3013 .4597 .3597 .0029 .0014 .0120 .0006 -.0014 -.0011 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Hopeite |
|
Whitaker A |
 |
Acta Crystallographica B31 (1975) 2026-2035 |
|
The crystal structure of hopeite, Zn3(PO4)2*4H2O |
|
Locality: synthetic |
|
10.629 18.339 5.040 90 90 90 Pnma |
|
atom x y z B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
|
Zn1 .23618 .25 .57284 .00215 .00144 .01151 0 .00042 0 |
|
Zn2 .14267 -.00087 .20768 .00077 .00070 .00393 .00000 .00001 -.00015 |
|
P .10285 .09421 .72589 .00133 .00043 .00425 .00008 .00017 -.00019 |
|
O4 .14010 .17265 .78465 .00413 .00080 .00993 -.00051 .00318 -.00068 |
|
O5 .10004 .07994 .42983 .00822 .00106 .00268 .00132 -.00230 -.00059 |
|
O6 .47552 .07867 .64140 .00054 .00078 .02113 -.00017 -.00091 .00123 |
|
O7 .19796 .04067 .86067 .00098 .00088 .00724 .00041 .00186 .00071 |
|
Wat1 .10737 .25 .25730 .00214 .00190 .00760 0 -.00162 0 |
|
Wat2 .38614 .25 .84901 .00092 .00244 .01550 0 -.00191 0 |
|
Wat3 .33521 .16977 .33917 .00295 .00143 .01971 .00080 .00099 .00110 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Hopeite |
|
Kawahara A, Takano Y, Takahashi M |
|
Mineralogical Journal 7 (1973) 289-297 |
|
The structure of hopeite |
|
Locality: synthetic |
|
10.553 18.199 5.031 90 90 90 Pnma |
|
atom x y z Biso |
|
Zn1 .26384 .25 .4277 1.08 |
|
Zn2 .14295 .00072 .2934 .87 |
|
P .39705 .09448 .2751 .87 |
|
O1 .3028 .0411 .1318 1.02 |
|
O2 .5252 .0785 .1334 1.43 |
|
O3 .3611 .1728 .2133 1.63 |
|
O4 .3994 .0807 .5691 2.01 |
|
Wat5 .1633 .1690 .6602 1.98 |
|
Wat6 .3922 .25 .7409 1.87 |
|
Wat7 .1136 .25 .1565 2.11 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Hopeite |
|
Haussuhl S, Middendorf B, Dorffel M |
| |
Journal of Solid State Chemistry 93 (1991) 9-16 |
|
Structure and properties of hopeites (MgxZn1-x)3(PO4)2*4H2O |
|
Locality: synthetic |
|
10.594 18.333 5.029 90 90 90 Pnma |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
MgM .26247 .25 .0729 .62 .0186 .0174 .0214 .0170 0 -.0006 0 |
|
ZnM .26247 .25 .0729 .38 .0186 .0174 .0214 .0170 0 -.0006 0 |
|
Zn .14241 .49897 .20834 .0124 .0124 .0133 .0115 -.0003 .0002 -.0008 |
|
P .39693 .40469 .2270 .0111 .0141 .0088 .0103 .0007 -.0006 .0005 |
|
O4 .3591 .3273 .2820 .0196 .030 .0114 .0173 -.0062 -.0093 .0021 |
|
O5 .0997 .5792 .4305 .0268 .051 .0167 .0126 .011 -.004 -.0039 |
|
O6 .0253 .4218 .1415 .0203 .0124 .0156 .033 -.0025 .0038 -.0046 |
|
O7 .3009 .4597 .3619 .0156 .0133 .0207 .0129 .0049 -.0025 -.0038 |
|
Wat1 .1065 .75 .2581 .0223 .019 .030 .018 0 -.004 0 |
|
Wat2 .1145 .25 .3450 .0273 .017 .043 .022 0 .005 0 |
|
Wat3 .3361 .6700 .3394 .0257 .027 .021 .029 .0075 .006 .001 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
Multiple datasets can be concatenated into a single downloadable file by
selecting the datasets and then hitting the "Download Selected Data" button.
