|
Djurleite |
 |
Evans H T |
 |
Zeitschrift fur Kristallographie 150 (1979) 299-320 |
|
The crystal structures of low chalocite and djurleite |
|
Locality: Ozark Lead Co. mine at Sweetwater, Missouri, USA |
|
_database_code_amcsd 0010818 |
|
26.897 15.745 13.565 90 90.13 90 P2_1/n |
|
atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Cu1 .0589 .4992 .0020 .036 .022 .020 -.001 .010 -.004 |
|
Cu2 .0630 .7552 .006 .030 .024 .024 -.003 .010 .006 |
|
Cu3 .0659 .1286 .2466 .031 .015 .021 .000 .012 -.002 |
|
Cu4 .0659 .9899 .4944 .055 .020 .016 .007 .006 -.002 |
|
Cu5 .0558 .2425 .4999 .027 .018 .024 .002 .009 .006 |
|
Cu6 .0643 .5085 .4952 .035 .021 .028 -.005 .002 .004 |
|
Cu7 .0674 .1126 .7593 .028 .023 .013 -.003 .008 -.001 |
|
Cu8 .0616 .3598 .7433 .052 .021 .020 -.005 .001 -.005 |
|
Cu9 .0683 .6155 .7542 .027 .015 .013 -.001 .008 .001 |
|
Cu10 .1884 .9995 .9979 .025 .020 .023 .002 .005 .003 |
|
Cu11 .1931 .2535 .9936 .031 .023 .019 -.001 -.002 .000 |
|
Cu12 .1806 .7459 .9892 .070 .059 .053 -.005 .019 .004 |
|
Cu13 .1887 .1255 .2389 .041 .026 .022 .002 -.002 .002 |
|
Cu14 .1946 .6214 .2495 .033 .034 .022 .002 -.006 .002 |
|
Cu15 .1901 .8706 .2423 .021 .016 .014 -.003 .009 .000 |
|
Cu16 .1811 .9987 .4834 .038 .024 .027 .000 .013 .001 |
|
Cu17 .1943 .7503 .4952 .024 .022 .013 -.002 .003 .013 |
|
Cu18 .1811 .1336 .7549 .036 .019 .022 -.001 .002 -.002 |
|
Cu19 .1888 .3852 .7415 .046 .018 .012 .000 .001 .000 |
|
Cu20 .1928 .8775 .7389 .045 .017 .034 .000 .000 -.001 |
|
Cu21 .0163 .1531 .0663 .019 .026 .018 -.002 .012 -.004 |
|
Cu22 .0171 .3905 .1371 .023 .017 .028 -.004 .016 -.004 |
|
Cu23 .0183 .6344 .1237 .025 .020 .047 -.003 .007 .007 |
|
Cu24 .0149 .8761 .1242 .012 .019 .029 -.003 .003 -.002 |
|
Cu25 .0144 .2896 .3064 .022 .019 .017 -.002 .002 .003 |
|
Cu26 .0159 .4645 .3191 .023 .027 .027 .002 .003 .005 |
|
Cu27 .0174 .7391 .3335 .013 .063 .045 .001 .001 .011 |
|
Cu28 .0142 .1045 .5931 .022 .029 .047 .007 .001 .001 |
|
Cu29 .0105 .3883 .5620 .028 .034 .073 .009 .040 .023 |
|
Cu30 .0171 .8599 .6332 .017 .019 .047 .003 .011 .011 |
|
Cu31 .0148 .9668 .8134 .013 .020 .023 .002 .012 .005 |
|
Cu32 .1082 .0824 .0717 .017 .021 .016 .002 .012 -.002 |
|
Cu33 .1073 .3426 .0630 .020 .028 .020 -.003 .005 .002 |
|
Cu34 .1035 .9110 .0507 .018 .020 .017 .001 .010 -.006 |
|
Cu35 .1077 .5346 .3123 .014 .054 .019 .001 .003 -.010 |
|
Cu36 .1125 .7667 .3268 .014 .056 .128 .005 .009 -.026 |
|
Cu37 .1087 .9573 .3159 .019 .042 .018 -.001 .013 .005 |
|
Cu38 .1077 .6589 .5611 .025 .014 .018 .000 .002 -.003 |
|
Cu39 .1076 .8330 .5580 .023 .036 .039 .003 .013 .018 |
|
Cu40 .1046 .0074 .8874 .031 .019 .019 .001 .004 .001 |
|
Cu41 .1074 .2501 .8772 .017 .017 .040 .000 .013 -.001 |
|
Cu42 .1129 .4717 .8340 .030 .046 .053 -.014 .012 -.008 |
|
Cu43 .1095 .7748 .8162 .022 .029 .023 .000 .004 -.009 |
|
Cu44 .1390 .4994 .1278 .015 .030 .027 .007 .014 -.005 |
|
Cu45 .1374 .7322 .1483 .037 .105 .081 .037 .003 -.032 |
|
Cu46 .1390 .1700 .4220 .030 .040 .045 -.014 .022 .003 |
|
Cu47 .1398 .3665 .4211 .016 .184 .035 .000 .009 -.005 |
|
Cu48 .1407 .0056 .6581 .015 .028 .034 -.003 .005 -.002 |
|
Cu49 .1455 .2551 .6101 .027 .025 .037 -.004 .007 .007 |
|
Cu50 .1445 .5031 .6163 .020 .020 .053 .002 .004 .005 |
|
Cu51 .1428 .5976 .9303 .026 .108 .074 -.003 .013 -.059 |
|
Cu52 .2241 .2884 .1861 .023 .033 .024 .005 .008 .007 |
|
Cu53 .2298 .4622 .1987 .022 .028 .025 -.001 .005 -.004 |
|
Cu54 .2344 .1381 .4237 .028 .086 .067 .011 .016 .010 |
|
Cu55 .2342 .3910 .4078 .019 .064 .106 .009 .009 .035 |
|
Cu56 .2311 .5884 .4366 .015 .036 .029 -.001 .005 -.003 |
|
Cu57 .2340 .5409 .6925 .025 .029 .025 .000 .000 .001 |
|
Cu58 .2322 .7143 .6814 .017 .035 .021 -.002 .000 -.002 |
|
Cu59 .2306 .4086 .9366 .024 .043 .043 .000 .015 .016 |
|
Cu60 .2367 .6345 .8759 .027 .037 .063 .004 .005 -.015 |
|
Cu61 .2356 .8534 .9122 .029 .109 .067 -.019 -.013 -.037 |
|
Cu62 .1277 .2615 .2446 .032 .036 .052 .001 -.016 .009 |
|
S1 .0646 .9911 .1743 .014 .013 .017 .009 .009 -.003 |
|
S2 .0570 .2567 .1634 .016 .008 .016 -.002 .013 .005 |
|
S3 .0587 .5127 .1746 .022 .017 .010 -.008 -.002 -.003 |
|
S4 .0563 .7556 .1747 .015 .020 .010 .004 .004 -.003 |
|
S5 .0621 .1167 .4139 .019 .023 .012 -.006 .000 .000 |
|
S6 .0569 .3729 .4192 .016 .006 .011 -.005 -.001 -.001 |
|
S7 .0698 .6326 .4114 .022 .008 .021 .005 -.004 -.005 |
|
S8 .0669 .8637 .4146 .021 .005 .020 -.004 .000 -.005 |
|
S9 .0569 .9932 .6626 .027 .012 .015 -.008 .018 .001 |
|
S10 .0661 .2356 .6666 .009 .020 .014 -.003 .007 -.002 |
|
S11 .0645 .4904 .6666 .011 .004 .033 .000 .006 .002 |
|
S12 .0683 .7477 .6718 .009 .011 .022 .001 .013 .001 |
|
S13 .0650 .1314 .9276 .011 .010 .016 .003 .006 -.003 |
|
S14 .0634 .3746 .9149 .012 .018 .015 .003 -.002 -.011 |
|
S15 .0617 .6297 .9236 .026 .046 .007 .006 -.004 .001 |
|
S16 .0660 .8753 .9031 .005 .017 .018 -.004 -.005 .015 |
|
S17 .1886 .1291 .0741 .016 .023 .013 .004 .005 -.005 |
|
S18 .1872 .3834 .0790 .014 .009 .019 .002 -.002 -.002 |
|
S19 .1834 .6233 .0801 .017 .005 .027 -.007 .011 .003 |
|
S20 .1838 .8700 .0748 .024 .003 .024 .001 .013 .005 |
|
S21 .1889 .0044 .3207 .021 .014 .016 -.008 .001 -.003 |
|
S22 .1928 .2570 .3414 .017 .009 .020 .003 .008 -.001 |
|
S23 .1871 .4951 .3374 .022 .020 .011 .020 .009 .006 |
|
S24 .1950 .7473 .329 .018 .013 .016 -.001 .000 -.001 |
|
S25 .1827 .1239 .5768 .019 .009 .016 .000 .002 -.001 |
|
S26 .1822 .3780 .5718 .042 .014 .016 -.008 .002 .002 |
|
S27 .1900 .6216 .5800 .004 .021 .014 .006 .004 -.003 |
|
S28 .1875 .8778 .5755 .010 .014 .017 -.005 .008 .008 |
|
S29 .1851 .9989 .8256 .025 .023 .015 -.004 .010 -.002 |
|
S30 .1882 .2603 .8271 .015 .013 .015 -.005 .015 -.003 |
|
S31 .1934 .5080 .8370 .016 .010 .014 -.005 .006 -.004 |
|
S32 .1915 .7528 .8246 .037 .006 .012 .004 .004 .001 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
|
| |
|
Djurleite |
|
Evans H T |
| |
Science 203 (1979) 356-358 |
|
Djurleite (Cu1.94S) and low chalcocite (Cu2S): New crystal structure studies |
|
Locality: Ozark Lead Co. mine, Sweetwater, Missouri |
|
_database_code_amcsd 0019203 |
|
26.897 15.745 13.565 90 90.13 90 P2_1/n |
|
atom x y z |
|
Cu1 .0585 .4995 .0013 |
|
Cu2 .0629 .7546 .0057 |
|
Cu3 .0658 .1287 .2463 |
|
Cu4 .0666 .9891 .4950 |
|
Cu5 .0547 .2432 .5000 |
|
Cu6 .0637 .5088 .4961 |
|
Cu7 .0674 .1130 .7588 |
|
Cu8 .0618 .3601 .7429 |
|
Cu9 .0684 .6153 .7550 |
|
Cu10 .1882 .9989 .9975 |
|
Cu11 .1932 .2538 .9947 |
|
Cu12 .1801 .7454 .9895 |
|
Cu13 .1886 .1258 .2391 |
|
Cu14 .1944 .6213 .2498 |
|
Cu15 .1901 .8707 .2424 |
|
Cu16 .1817 .9986 .4833 |
|
Cu17 .1940 .7508 .4955 |
|
Cu18 .1816 .1337 .7545 |
|
Cu19 .1890 .3852 .7412 |
|
Cu20 .1931 .8773 .7385 |
|
Cu21 .0161 .1536 .0656 |
|
Cu22 .0169 .3899 .1376 |
|
Cu23 .0180 .6341 .1245 |
|
Cu24 .0148 .8770 .1250 |
|
Cu25 .0146 .2896 .3053 |
|
Cu26 .0164 .4645 .3179 |
|
Cu27 .0177 .7394 .3335 |
|
Cu28 .0140 .1048 .5903 |
|
Cu29 .0112 .3880 .5622 |
|
Cu30 .0176 .8598 .6328 |
|
Cu31 .0143 .9668 .8129 |
|
Cu32 .1082 .0815 .0721 |
|
Cu33 .1068 .3423 .0638 |
|
Cu34 .1032 .9108 .0500 |
|
Cu35 .1081 .5347 .3120 |
|
Cu36 .1120 .7677 .3252 |
|
Cu37 .1086 .9563 .3169 |
|
Cu38 .1082 .6590 .5622 |
|
Cu39 .1075 .8336 .5589 |
|
Cu40 .1049 .0073 .8886 |
|
Cu41 .1077 .2500 .8788 |
|
Cu42 .1129 .4712 .8329 |
|
Cu43 .1091 .7740 .8161 |
|
Cu44 .1392 .4992 .1277 |
|
Cu45 .1372 .7337 .1493 |
|
Cu46 .1392 .1697 .4233 |
|
Cu47 .1397 .3639 .4205 |
|
Cu48 .1404 .0064 .6588 |
|
Cu49 .1453 .2554 .6100 |
|
Cu50 .1443 .5029 .6162 |
|
Cu51 .1420 .5960 .9293 |
|
Cu52 .2241 .2886 .1852 |
|
Cu53 .2303 .4620 .1977 |
|
Cu54 .2346 .1367 .4227 |
|
Cu55 .2346 .3904 .4062 |
|
Cu56 .2308 .5872 .4358 |
|
Cu57 .2344 .5411 .6927 |
|
Cu58 .2325 .7142 .6811 |
|
Cu59 .2306 .4097 .9373 |
|
Cu60 .2373 .6349 .8738 |
|
Cu61 .2359 .8561 .9123 |
|
Cu62 .1270 .2612 .2454 |
|
S1 .0652 .9917 .1734 |
|
S2 .0571 .2572 .1613 |
|
S3 .0580 .5131 .1751 |
|
S4 .0562 .7546 .1751 |
|
S5 .0615 .1176 .4136 |
|
S6 .0571 .3717 .4211 |
|
S7 .0700 .6329 .4106 |
|
S8 .0674 .8637 .4137 |
|
S9 .0570 .9926 .6629 |
|
S10 .0663 .2347 .6674 |
|
S11 .0651 .4905 .6678 |
|
S12 .0692 .7459 .6725 |
|
S13 .0653 .1311 .9272 |
|
S14 .0636 .3746 .9152 |
|
S15 .0616 .6295 .9252 |
|
S16 .0656 .8733 .9023 |
|
S17 .1888 .1290 .0734 |
|
S18 .1870 .3823 .0798 |
|
S19 .1824 .6235 .0790 |
|
S20 .1836 .8687 .0737 |
|
S21 .1892 .0037 .3209 |
|
S22 .1926 .2555 .3401 |
|
S23 .1876 .4955 .3382 |
|
S24 .1949 .7471 .3278 |
|
S25 .1827 .1241 .5768 |
|
S26 .1829 .3774 .5737 |
|
S27 .1900 .6224 .5799 |
|
S28 .1870 .8784 .5743 |
|
S29 .1847 .9991 .8254 |
|
S30 .1875 .2605 .8288 |
|
S31 .1923 .5086 .8385 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
|
| |
