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Celestine |
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Miyake M, Minato I, Morikawa H, Iwai S I |
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American Mineralogist 63 (1978) 506-510 |
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Crystal structure and sulphate force constants of barite, celestite, and |
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anglesite |
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_database_code_amcsd 0000664 |
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6.870 8.371 5.355 90 90 90 Pbnm |
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atom x y z B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Sr .1583 .1839 .25 .0034 .0023 .0105 -.0001 0 0 |
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S .1853 .4382 .75 .0020 .0023 .0060 -.0001 0 0 |
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O1 .0930 .5942 .75 .0100 .0027 .0230 .0035 0 0 |
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O2 .0419 .3075 .75 .0048 .0049 .0170 -.0031 0 0 |
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O3 .3108 .4217 .9746 .0051 .0044 .0080 -.0008 -.0028 .0001 |
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Celestine |
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Antao S M |
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American Mineralogist 97 (2012) 661-665 |
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Structural trends for celestite (SrSO4), anglesite (PbSO4), and barite (BaSO4): |
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confirmation of expected variations within SO4 groups |
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Locality: Saxony, Ngar Majunga, Madagascar |
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_database_code_amcsd 0018844 |
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6.87032 8.36030 5.34732 90 90 90 Pbnm |
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atom x y z occ Uiso |
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Sr .15826 .18405 .25 .966 .0101 |
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Fe .15826 .18405 .25 .001 .0101 |
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Ba .15826 .18405 .25 .001 .0101 |
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S .1843 .4388 .75 .0089 |
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O1 .0933 .5952 .75 .0168 |
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O2 .0401 .3067 .75 .0155 |
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O3 .3120 .4223 .9743 .0112 |
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Celestine |
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Hawthorne F C, Ferguson R B |
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The Canadian Mineralogist 13 (1975) 181-187 |
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Anhydrous sulphates. I: Refinement of the crystal structure of celestite |
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with an appendix on the structure of thenardite |
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_database_code_amcsd 0005112 |
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8.360 5.352 6.858 90 90 90 Pnma |
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atom x y z B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Sr .1841 .25 .1582 .00269 .01022 .00334 0 .00010 0 |
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S .4379 .75 .1849 .00264 .00444 .00182 0 .00009 0 |
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O1 .5970 .75 .0937 .00325 .01042 .00814 0 .00320 0 |
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O2 .3101 .75 .0406 .00496 .01082 .00612 0 -.00191 0 |
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O3 .4219 .9745 .3101 .00397 .00548 .00668 -.00107 .00077 -.00082 |
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Celestine |
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Jacobsen S D, Smyth J R, Swope R J, Downs R T |
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The Canadian Mineralogist 36 (1998) 1053-1060 |
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Rigid-body character of the SO4 groups in celestine, anglesite and |
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barite |
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_database_code_amcsd 0005557 |
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6.8671 8.3545 5.3458 90 90 90 Pbnm |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Sr .15818 .18395 .25 .01005 .00757 .01681 .00026 0 0 |
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S .18505 .43797 .75 .00797 .00762 .00896 -.00014 0 0 |
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O1 .0923 .5952 .75 .0195 .0119 .0299 .0084 0 0 |
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O2 .0418 .3071 .75 .0126 .0161 .0210 -.0066 0 0 |
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O3 .3107 .4222 .9744 .0138 .0156 .0116 -.0011 -.0040 .0006 |
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| 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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Celestine |
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Garske D, Peacor D R |
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Zeitschrift fur Kristallographie 121 (1965) 204-210 |
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Refinement of the structure of celestite SrSO4 |
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Locality: France Stone Company's quarry near Waterville, Ohio, USA |
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_database_code_amcsd 0010619 |
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8.377 5.350 6.873 90 90 90 Pnma |
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atom x y z Biso |
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Sr .1836 .25 .1583 .53 |
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S .438 .75 .188 .15 |
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O1 .603 .75 .093 .64 |
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O2 .305 .75 .033 1.52 |
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O3 .420 .979 .312 .21 |
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| 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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Celestine |
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Brigatti M F, Galli E, ,Medici L |
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Mineralogical Magazine 61 (1997) 447-451 |
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Ba-rich celestine: new data and crystal structure refinement |
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Locality: filling cavities of volcanoclastic rocks, Montecchio Maggiore, Vicenza, Italy |
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_database_code_amcsd 0014527 |
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8.408 5.372 6.897 90 90 90 Pnma |
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atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Sr .1836 .25 .1585 .87 .66 .001379 .007537 .003784 0 -.000129 0 |
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Ba .1836 .25 .1585 .13 .66 .001379 .007537 .003784 0 -.000129 0 |
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S .4377 .75 .1851 .32 .000813 .002079 .002470 0 -.000216 0 |
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O1 .5939 .75 .0945 1.5 .003183 .016460 .008409 0 .002156 0 |
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O2 .3083 .75 .0437 1.1 .002829 .013861 .004730 0 -.001724 0 |
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O3 .4220 .9760 .3106 .80 .003536 .003725 .004730 .001107 -.000690 -.001957 |
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| 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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Celestine |
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James R |
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Proceedings of the Royal Society of London A109 (1925) 598-620 |
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The Crystal Structures of Barytes, Celestine and Anglesite |
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_cod_database_code 1010543 |
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_database_code_amcsd 0017448 |
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8.36 5.36 6.84 90 90 90 Pnma |
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atom x y z |
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Sr1 .3208 .25 .3388 |
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S1 .443 .25 -.1947 |
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| 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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