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Feldspar |
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Grundy H D, Ito J |
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American Mineralogist 59 (1974) 1319-1326 |
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The refinement of the crystal structure of a synthetic non-stoichiometric Sr |
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feldspar |
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_database_code_amcsd 0000436 |
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8.3282 12.9801 7.1358 90 115.599 90 C2/m |
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atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Si1 .0054 .1772 .2237 .52 .00395 .00122 .00339 -.00069 .00196 -.00015 |
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Al1 .0054 .1772 .2237 .48 .00395 .00122 .00339 -.00069 .00196 -.00015 |
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Si2 .6908 .1166 .3414 .61 .00387 .00093 .00381 -.00001 .00132 -.00018 |
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Al2 .6908 .1166 .3414 .39 .00387 .00093 .00381 -.00001 .00132 -.00018 |
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Sr .2696 0 .1306 .84 .00610 .00403 .01046 0 .00186 0 |
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Na .2696 0 .1306 .03 .00610 .00403 .01046 0 .00186 0 |
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OA(1) 0 .1329 0 .00739 .00159 .00560 0 .00415 0 |
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OA(2) .5951 0 .2843 .00322 .00075 .00966 0 .00017 0 |
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OB .8201 .1298 .2212 .00732 .00216 .01108 -.00005 .00526 .00112 |
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OC .0193 .3052 .2518 .00665 .00170 .00999 -.00039 .00350 .00005 |
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OD .1907 .1227 .4025 .00661 .00296 .00660 .00007 .00181 .00069 |
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Feldspar |
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Chiari G, Calleri M, Bruno E, Ribbe P H |
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American Mineralogist 60 (1975) 111-119 |
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The structure of partially disordered, synthetic strontium feldspar |
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_database_code_amcsd 0000444 |
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8.388 12.974 14.264 90 115.2 90 I2/c |
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atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Sr .2690 -.002 .0656 .0021 .0027 .0013 .0001 .0002 -.0002 |
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SiT1(o) .0066 .1746 .1083 .9 .0023 .0015 .0006 -.0005 .0003 -.0001 |
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AlT1(o) .0066 .1746 .1083 .1 .0023 .0015 .0006 -.0005 .0003 -.0001 |
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SiT1(z) .0032 .1775 .6164 .1 .0036 .0016 .0004 -.0002 .0006 .0000 |
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AlT1(z) .0032 .1775 .6164 .9 .0036 .0016 .0004 -.0002 .0006 .0000 |
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SiT2(o) .6934 .1200 .1706 .1 .0019 .0016 .0004 -.0002 .0001 -.0001 |
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AlT2(o) .6934 .1200 .1706 .9 .0019 .0016 .0004 -.0002 .0001 -.0001 |
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SiT2(z) .6845 .1137 .6716 .9 .0035 .0012 .0006 .0001 .0005 .0001 |
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AlT2(z) .6845 .1137 .6716 .1 .0035 .0012 .0006 .0001 .0005 .0001 |
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OA(1) .0045 .1289 .0003 .0039 .0023 .0006 .0009 .0008 -.0002 |
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OA(2) .5911 .0002 .1427 .0030 .0017 .0013 .0008 .0003 .0004 |
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OB(o) .8267 .1266 .1054 .0057 .0028 .0012 -.0002 .0017 -.0002 |
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OB(z) .8104 .1263 .6113 .0036 .0031 .0017 -.0013 .0016 .0000 |
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OC(o) .0132 .2984 .1186 .0043 .0026 .0007 -.0011 .0000 -.0004 |
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OC(z) .0188 .3090 .6304 .0043 .0021 .0018 -.0005 .0013 -.0002 |
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OD(o) .1876 .1245 .1955 .0058 .0029 .0010 .0003 .0006 .0002 |
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OD(z) .1960 .1190 .7027 .0036 .0031 .0006 .0004 -.0003 -.0001 |
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Feldspar |
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Benna P, Tribaudino M, Bruno E |
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American Mineralogist 81 (1996) 1337-1343 |
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The structure of ordered and disordered lead feldspar (PbAl2Si2O8) |
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Sample: disordered |
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_database_code_amcsd 0001839 |
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8.428 13.054 7.174 90 115.32 90 C2/m |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Pb .2749 .0213 .1406 .5 .022 .052 .043 .016 .008 .004 |
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Si1 .0038 .1793 .2258 .5 .018 .013 .016 .005 .009 -.001 |
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Al1 .0038 .1793 .2258 .5 .018 .013 .016 .005 .009 -.001 |
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Si2 .6932 .1170 .3455 .5 .010 .006 .008 .000 .003 .000 |
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Al2 .6932 .1170 .3455 .5 .010 .006 .008 .000 .003 .000 |
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OA(l) 0 .1353 0 .027 .019 .015 .000 .007 .000 |
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OA(2) .6033 0 .2956 .019 .012 .031 .000 .010 .000 |
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OB .8175 .1311 .2214 .028 .025 .032 .000 .017 .001 |
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OC .0181 .3066 .2539 .025 .019 .029 -.006 .014 .002 |
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OD .1905 .1249 .4010 .025 .028 .016 .001 .001 -.001 |
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Feldspar |
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Benna P, Tribaudino M, Bruno E |
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American Mineralogist 81 (1996) 1337-1343 |
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The structure of ordered and disordered lead feldspar (PbAl2Si2O8) |
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Sample: ordered |
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_database_code_amcsd 0001840 |
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8.388 13.067 14.327 90 115.19 90 I2/c |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Pb .2715 -.0098 .0731 .5 .009 .030 .021 -.002 .005 -.001 |
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Si1(0) .0077 .1755 .1091 .007 .008 .006 -.002 .003 -.001 |
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Al1(z) .0021 .1797 .6163 .006 .007 .007 -.002 .004 -.000 |
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Al2(0) .6945 .1202 .1712 .004 .007 .008 .001 .003 .001 |
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Si2(z) .6867 .1137 .6748 .005 .006 .009 -.001 .003 -.001 |
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OA(l) .0062 .1336 .0006 .016 .015 .007 -.002 .005 .000 |
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OA(2) .5956 -.0008 .1471 .007 .004 .017 .002 .004 .002 |
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OB(O) .8280 .1295 .1055 .011 .014 .023 -.004 .012 -.001 |
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OB(z) .8154 .1300 .6191 .009 .019 .022 -.002 .013 .001 |
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OC(O) .0178 .2979 .1217 .013 .010 .018 -.005 .008 -.002 |
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OC(Z) .0182 .3109 .6328 .011 .007 .018 -.003 .005 -.003 |
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OD(O) .1833 .1230 .1957 .015 .021 .010 -.000 .000 .002 |
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OD(z) .2006 .1202 .7010 .009 .014 .012 .001 .001 .001 |
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Feldspar |
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Tribaudino M, Benna P, Bruno E |
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American Mineralogist 83 (1998) 159-166 |
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Structural variations induced by thermal treatment in lead feldspar (PbAl2Si2O8) |
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Sample: PbF_L1h, single Pb site |
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_database_code_amcsd 0001953 |
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8.395 13.081 14.343 90 115.27 90 I2/c |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Pb .2716 -.0096 .0728 .017 .044 .022 -.003 .008 -.002 |
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Al1o .0078 .1760 .1091 .075 .014 .014 .006 -.003 .006 -.001 |
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Si1o .0078 .1760 .1091 .925 .014 .014 .006 -.003 .006 -.001 |
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Al1z .0022 .1797 .6164 .925 .013 .013 .009 -.003 .008 -.001 |
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Si1z .0022 .1797 .6164 .075 .013 .013 .009 -.003 .008 -.001 |
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Al2o .6948 .1201 .1711 .925 .013 .010 .008 .000 .007 .000 |
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Si2o .6948 .1201 .1711 .075 .013 .010 .008 .000 .007 .000 |
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Al2z .6873 .1140 .6749 .075 .012 .011 .009 .001 .007 .001 |
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Si2z .6873 .1140 .6749 .925 .012 .011 .009 .001 .007 .001 |
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OA(1) .0052 .1342 .0009 .027 .021 .009 -.002 .012 -.002 |
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OA(2) .5944 -.0005 .1459 .015 .011 .022 -.002 .009 .000 |
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OB(o) .8256 .1289 .1060 .014 .019 .023 .004 .012 -.001 |
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OB(Z) .8137 .1301 .6183 .014 .022 .031 -.001 .017 .003 |
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OC(O) .0189 .2987 .1219 .021 .017 .019 -.002 .010 -.002 |
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OC(Z) .0190 .3108 .6323 .018 .018 .020 -.003 .010 .004 |
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OD(o) .1845 .1233 .1957 .021 .028 .011 .003 .008 .005 |
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OD(Z) .2021 .1210 .7011 .018 .018 .015 .004 .004 .004 |
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| Download AMC data (View Text File)
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| |
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Feldspar |
| |
Tribaudino M, Benna P, Bruno E |
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American Mineralogist 83 (1998) 159-166 |
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Structural variations induced by thermal treatment in lead feldspar (PbAl2Si2O8) |
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Sample: PbF_L1h, split Pb site |
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_database_code_amcsd 0001954 |
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8.395 13.081 14.343 90 115.27 90 I2/c |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Pb' .2699 -.0111 .0736 .6 .013 .027 .015 -.007 .004 .000 |
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Pb" .2758 -.0029 .0704 .4 .026 .119 .044 .009 .022 -.003 |
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Al1o .0078 .1760 .1091 .075 .014 .014 .006 -.003 .006 -.001 |
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Si1o .0078 .1760 .1091 .925 .014 .014 .006 -.003 .006 -.001 |
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Al1z .0022 .1797 .6164 .925 .013 .013 .009 -.003 .008 -.001 |
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Si1z .0022 .1797 .6164 .075 .013 .013 .009 -.003 .008 -.001 |
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Al2o .6948 .1201 .1711 .925 .013 .010 .008 .000 .007 .000 |
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Si2o .6948 .1201 .1711 .075 .013 .010 .008 .000 .007 .000 |
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Al2z .6873 .1140 .6749 .075 .012 .011 .009 .001 .007 .001 |
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Si2z .6873 .1140 .6749 .925 .012 .011 .009 .001 .007 .001 |
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OA(1) .0052 .1342 .0009 .027 .021 .009 -.002 .012 -.002 |
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OA(2) .5944 -.0005 .1459 .015 .011 .022 -.002 .009 .000 |
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OB(o) .8256 .1289 .1060 .014 .019 .023 .004 .012 -.001 |
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OB(Z) .8137 .1301 .6183 .014 .022 .031 -.001 .017 .003 |
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OC(O) .0189 .2987 .1219 .021 .017 .019 -.002 .010 -.002 |
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OC(Z) .0190 .3108 .6323 .018 .018 .020 -.003 .010 .004 |
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OD(o) .1845 .1233 .1957 .021 .028 .011 .003 .008 .005 |
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OD(Z) .2021 .1210 .7011 .018 .018 .015 .004 .004 .004 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink) |
| |
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Feldspar |
| |
Tribaudino M, Benna P, Bruno E |
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American Mineralogist 83 (1998) 159-166 |
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Structural variations induced by thermal treatment in lead feldspar (PbAl2Si2O8) |
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Sample: PbF_L16h, single Pb site |
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_database_code_amcsd 0001955 |
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8.399 13.061 14.334 90 115.28 90 I2/c |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Pb .2723 -.0079 .0719 .017 .071 .028 -.010 .007 -.003 |
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Al1o .0072 .1773 .1097 .14 .011 .013 .008 -.002 .004 -.002 |
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Si1o .0072 .1773 .1097 .86 .011 .013 .008 -.002 .004 -.002 |
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Al1z .0025 .1793 .6153 .86 .013 .013 .004 -.003 .007 .000 |
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Si1z .0025 .1793 .6153 .14 .013 .013 .004 -.003 .007 .000 |
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Al2o .6958 .1198 .1714 .86 .007 .008 .010 .004 .004 .001 |
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Si2o .6958 .1198 .1714 .14 .007 .008 .010 .004 .004 .001 |
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Al2z .6875 .1149 .6738 .14 .012 .011 .009 -.003 .006 -.002 |
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Si2z .6875 .1149 .6738 .86 .012 .011 .009 -.003 .006 -.002 |
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OA(1) .0020 .1345 -.0010 .022 .021 .011 .004 .009 -.003 |
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OA(2) .5984 -.0004 .1465 .014 .015 .018 -.003 .006 -.005 |
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OB(o) .8294 .1294 .1079 .021 .021 .026 -.003 .015 -.005 |
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OB(Z) .8148 .1322 .6163 .021 .015 .024 -.005 .011 .003 |
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Oc(o) .0179 .3008 .1219 .023 .011 .023 .000 .008 -.001 |
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Ocz .0200 .3105 .6325 .012 .014 .020 -.001 .007 -.006 |
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Odo .1837 .1244 .1963 .020 .020 .014 .004 .000 .005 |
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Odz .1986 .1228 .7021 .015 .019 .016 .001 .006 -.001 |
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|
| Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink) |
| |
|
Feldspar |
| |
Tribaudino M, Benna P, Bruno E |
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American Mineralogist 83 (1998) 159-166 |
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Structural variations induced by thermal treatment in lead feldspar (PbAl2Si2O8) |
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Sample: PbF_L16h, split Pb site |
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_database_code_amcsd 0001956 |
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8.399 13.061 14.334 90 115.28 90 I2/c |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Pb' .2731 -.0136 .0730 .6 .009 .039 .019 -.012 .003 .000 |
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Pb" .2726 .0058 .0691 .4 .037 .109 .048 .031 .014 -.002 |
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Al1o .0072 .1773 .1097 .14 .011 .013 .008 -.002 .004 -.002 |
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Si1o .0072 .1773 .1097 .86 .011 .013 .008 -.002 .004 -.002 |
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Al1z .0025 .1793 .6153 .86 .013 .013 .004 -.003 .007 .000 |
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Si1z .0025 .1793 .6153 .14 .013 .013 .004 -.003 .007 .000 |
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Al2o .6958 .1198 .1714 .86 .007 .008 .010 .004 .004 .001 |
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Si2o .6958 .1198 .1714 .14 .007 .008 .010 .004 .004 .001 |
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Al2z .6875 .1149 .6738 .14 .012 .011 .009 -.003 .006 -.002 |
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Si2z .6875 .1149 .6738 .86 .012 .011 .009 -.003 .006 -.002 |
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OA(1) .0020 .1345 -.0010 .022 .021 .011 .004 .009 -.003 |
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OA(2) .5984 -.0004 .1465 .014 .015 .018 -.003 .006 -.005 |
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OB(o) .8294 .1294 .1079 .021 .021 .026 -.003 .015 -.005 |
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OB(Z) .8148 .1322 .6163 .021 .015 .024 -.005 .011 .003 |
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Oc(o) .0179 .3008 .1219 .023 .011 .023 .000 .008 -.001 |
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Ocz .0200 .3105 .6325 .012 .014 .020 -.001 .007 -.006 |
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Odo .1837 .1244 .1963 .020 .020 .014 .004 .000 .005 |
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Odz .1986 .1228 .7021 .015 .019 .016 .001 .006 -.001 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink) |
| |
|
Feldspar |
| |
Tribaudino M, Benna P, Bruno E |
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American Mineralogist 83 (1998) 159-166 |
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Structural variations induced by thermal treatment in lead feldspar (PbAl2Si2O8) |
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Sample: PbF_L64h, single Pb site |
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_database_code_amcsd 0001957 |
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8.405 13.063 14.344 90 115.29 90 I2/c |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Pb .2723 -.0076 .0718 .014 .074 .031 -.010 .006 -.005 |
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Al1o .0068 .1769 .1091 .15 .013 .008 .007 -.004 .007 -.001 |
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Si1o .0068 .1769 .1091 .85 .013 .008 .007 -.004 .007 -.001 |
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Al1z .0027 .1799 .6162 .85 .008 .008 .007 -.003 .003 -.002 |
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Si1z .0027 .1799 .6162 .15 .008 .008 .007 -.003 .003 -.002 |
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Al2o .6968 .1195 .1720 .85 .006 .004 .011 .001 .002 -.001 |
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Si2o .6968 .1195 .1720 .15 .006 .004 .011 .001 .002 -.001 |
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Al2z .6883 .1148 .6734 .15 .006 .008 .010 .000 .005 .001 |
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Si2z .6883 .1148 .6734 .85 .006 .008 .010 .000 .005 .001 |
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Oa1 .0049 .1335 .0003 .022 .012 .008 -.001 .010 .000 |
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Oa2 .5988 -.0010 .1456 .013 .005 .021 .003 .004 .009 |
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Obo .8256 .1295 .1079 .030 .013 .024 -.008 .020 -.002 |
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Obz .8157 .1300 .6156 .011 .020 .028 -.004 .008 .004 |
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Oco .0158 .3004 .1207 .015 .019 .022 -.003 .010 .002 |
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Ocz .0205 .3109 .6320 .018 .017 .011 -.002 .004 -.005 |
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Odo .1856 .1254 .1964 .027 .023 .011 .002 .008 .007 |
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Odz .1958 .1211 .7010 .008 .021 .015 -.001 .000 -.003 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink) |
| |
|
Feldspar |
| |
Tribaudino M, Benna P, Bruno E |
|
American Mineralogist 83 (1998) 159-166 |
|
Structural variations induced by thermal treatment in lead feldspar (PbAl2Si2O8) |
|
Sample: PbF_L64h, split Pb site |
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_database_code_amcsd 0001958 |
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8.405 13.063 14.344 90 115.29 90 I2/c |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Pb' .2742 .0005 .0695 .6 .018 .118 .049 .013 .012 .001 |
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Pb" .2710 -.0136 .0737 .4 .010 .025 .015 -.015 .002 -.003 |
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Al1o .0068 .1769 .1091 .15 .013 .008 .007 -.004 .007 -.001 |
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Si1o .0068 .1769 .1091 .85 .013 .008 .007 -.004 .007 -.001 |
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Al1z .0027 .1799 .6162 .85 .008 .008 .007 -.003 .003 -.002 |
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Si1z .0027 .1799 .6162 .15 .008 .008 .007 -.003 .003 -.002 |
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Al2o .6968 .1195 .1720 .85 .006 .004 .011 .001 .002 -.001 |
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Si2o .6968 .1195 .1720 .15 .006 .004 .011 .001 .002 -.001 |
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Al2z .6883 .1148 .6734 .15 .006 .008 .010 .000 .005 .001 |
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Si2z .6883 .1148 .6734 .85 .006 .008 .010 .000 .005 .001 |
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Oa1 .0049 .1335 .0003 .022 .012 .008 -.001 .010 .000 |
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Oa2 .5988 -.0010 .1456 .013 .005 .021 .003 .004 .009 |
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Obo .8256 .1295 .1079 .030 .013 .024 -.008 .020 -.002 |
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Obz .8157 .1300 .6156 .011 .020 .028 -.004 .008 .004 |
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Oco .0158 .3004 .1207 .015 .019 .022 -.003 .010 .002 |
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Ocz .0205 .3109 .6320 .018 .017 .011 -.002 .004 -.005 |
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Odo .1856 .1254 .1964 .027 .023 .011 .002 .008 .007 |
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Odz .1958 .1211 .7010 .008 .021 .015 -.001 .000 -.003 |
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|
| Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink) |
| |
|
Feldspar |
| |
Tribaudino M, Benna P, Bruno E |
|
American Mineralogist 83 (1998) 159-166 |
|
Structural variations induced by thermal treatment in lead feldspar (PbAl2Si2O8) |
|
Sample: PbF_H136h, single Pb site |
|
_database_code_amcsd 0001959 |
|
8.418 13.076 14.365 90 115.28 90 I2/c |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Pb .2723 -.0045 .0715 .015 .098 .032 -.016 .006 -.005 |
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Al1o .0055 .1775 .1105 .29 .009 .016 .008 -.004 .002 .001 |
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Si1o .0055 .1775 .1105 .71 .009 .016 .008 -.004 .002 .001 |
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Al1z .0040 .1794 .6147 .71 .011 .012 .010 -.003 .006 -.001 |
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Si1z .0040 .1794 .6147 .29 .011 .012 .010 -.003 .006 -.001 |
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Al2o .6942 .1186 .1719 .71 .006 .007 .012 -.001 .004 -.001 |
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Si2o .6942 .1186 .1719 .29 .006 .007 .012 -.001 .004 -.001 |
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Al2z .6897 .1153 .6735 .29 .008 .012 .007 .000 .002 -.001 |
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Si2z .6897 .1153 .6735 .71 .008 .012 .007 .000 .002 -.001 |
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Oa1 .0021 .1342 -.0010 .019 .020 .012 -.001 .008 -.003 |
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Oa2 .5992 -.0003 .1462 .010 .010 .025 -.001 .006 -.002 |
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Obo .8219 .1311 .1084 .017 .024 .027 .004 .010 .001 |
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Obz .8169 .1305 .6146 .019 .022 .030 -.004 .014 -.001 |
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Oco .0160 .3025 .1233 .023 .020 .021 -.006 .009 .003 |
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Ocz .0206 .3092 .6310 .014 .017 .027 -.006 .005 -.002 |
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Odo .1876 .1242 .1980 .018 .027 .015 .004 .002 .003 |
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Odz .1946 .1222 .7007 .016 .026 .016 -.002 .003 -.001 |
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|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Feldspar |
| |
Tribaudino M, Benna P, Bruno E |
|
American Mineralogist 83 (1998) 159-166 |
|
Structural variations induced by thermal treatment in lead feldspar (PbAl2Si2O8) |
|
Sample: PbF_H136h, split Pb site |
|
_database_code_amcsd 0001960 |
|
8.418 13.076 14.365 90 115.28 90 I2/c |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Pb' .2717 -.0141 .0743 .6 .013 .046 .023 -.011 .005 .005 |
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Pb" .2760 .0171 .0656 .4 .019 .072 .044 .014 .011 .020 |
|
Al1o .0055 .1775 .1105 .29 .009 .016 .008 -.004 .002 .001 |
|
Si1o .0055 .1775 .1105 .71 .009 .016 .008 -.004 .002 .001 |
|
Al1z .0040 .1794 .6147 .71 .011 .012 .010 -.003 .006 -.001 |
|
Si1z .0040 .1794 .6147 .29 .011 .012 .010 -.003 .006 -.001 |
|
Al2o .6942 .1186 .1719 .71 .006 .007 .012 -.001 .004 -.001 |
|
Si2o .6942 .1186 .1719 .29 .006 .007 .012 -.001 .004 -.001 |
|
Al2z .6897 .1153 .6735 .29 .008 .012 .007 .000 .002 -.001 |
|
Si2z .6897 .1153 .6735 .71 .008 .012 .007 .000 .002 -.001 |
|
Oa1 .0021 .1342 -.0010 .019 .020 .012 -.001 .008 -.003 |
|
Oa2 .5992 -.0003 .1462 .010 .010 .025 -.001 .006 -.002 |
|
Obo .8219 .1311 .1084 .017 .024 .027 .004 .010 .001 |
|
Obz .8169 .1305 .6146 .019 .022 .030 -.004 .014 -.001 |
|
Oco .0160 .3025 .1233 .023 .020 .021 -.006 .009 .003 |
|
Ocz .0206 .3092 .6310 .014 .017 .027 -.006 .005 -.002 |
|
Odo .1876 .1242 .1980 .018 .027 .015 .004 .002 .003 |
|
Odz .1946 .1222 .7007 .016 .026 .016 -.002 .003 -.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) |
| |
|
Feldspar |
| |
Benna P, Tribaudino M, Bruno E |
|
American Mineralogist 84 (1999) 120-129 |
|
High-temperature in situ structural investigation on lead feldspar |
|
Sample at T = 20 C, single Pb atom model |
|
_database_code_amcsd 0002065 |
|
8.402 13.043 14.308 90 115.30 90 I2/c |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Pb .2709 -.0080 .0723 .012 .055 .028 -.004 .005 -.002 |
|
Si1(O) .0062 .1767 .1097 .71 .009 .013 .010 -.002 .004 -.000 |
|
Al1(O) .0062 .1767 .1097 .29 .009 .013 .010 -.002 .004 -.000 |
|
Si1(z) .0033 .1794 .6156 .71 .005 .012 .007 -.002 .001 -.000 |
|
Al1(z) .0033 .1794 .6156 .29 .005 .012 .007 -.002 .001 -.000 |
|
Si2(O) .6950 .1192 .1717 .71 .004 .009 .008 .000 .000 .000 |
|
Al2(O) .6950 .1192 .1717 .29 .004 .009 .008 .000 .000 .000 |
|
Si2(z) .6883 .1147 .6739 .71 .006 .010 .012 .000 .004 -.001 |
|
Al2(z) .6883 .1147 .6739 .29 .006 .010 .012 .000 .004 -.001 |
|
OA(1) .0041 .1342 .0012 .018 .024 .006 -.003 .005 .000 |
|
OA(2) .5986 -.0011 .1470 .008 .010 .020 -.001 .001 .000 |
|
OB(O) .8248 .1297 .1074 .011 .022 .024 -.003 .008 .000 |
|
OB(z) .8144 .1311 .6170 .017 .025 .029 -.005 .013 .001 |
|
OC(O) .0178 .3006 .1224 .012 .022 .020 -.005 .005 -.003 |
|
OC(z) .0183 .3103 .6323 .021 .015 .018 -.009 .005 -.003 |
|
OD(O) .1857 .1240 .1969 .013 .026 .011 .001 -.001 .002 |
|
OD(z) .1987 .1212 .7010 .014 .021 .013 -.002 .000 .003 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Feldspar |
| |
Benna P, Tribaudino M, Bruno E |
|
American Mineralogist 84 (1999) 120-129 |
|
High-temperature in situ structural investigation on lead feldspar |
|
Sample at T = 230 C, single Pb atom model |
|
_database_code_amcsd 0002066 |
|
8.422 13.045 14.310 90 115.34 90 I2/c |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Pb .2731 -.0063 .0713 .021 .084 .044 -.006 .008 -.004 |
|
Si1(O) .0059 .1777 .1100 .71 .016 .019 .012 -.004 .005 .001 |
|
Al1(O) .0059 .1777 .1100 .29 .016 .019 .012 -.004 .005 .001 |
|
Si1(z) .0039 .1798 .6158 .71 .011 .017 .013 -.003 .005 .001 |
|
Al1(z) .0039 .1798 .6158 .29 .011 .017 .013 -.003 .005 .001 |
|
Si2(O) .6959 .1194 .1714 .71 .013 .013 .015 .002 .002 .002 |
|
Al2(O) .6959 .1194 .1714 .29 .013 .013 .015 .002 .002 .002 |
|
Si2(z) .6901 .1148 .6732 .71 .008 .018 .015 -.003 .003 -.003 |
|
Al2(z) .6901 .1148 .6732 .29 .008 .018 .015 -.003 .003 -.003 |
|
OA(1) .0041 .1342 .0011 .029 .031 .014 -.001 .009 -.001 |
|
OA(2) .6023 -.0016 .1462 .011 .016 .038 .000 .004 -.001 |
|
OB(O) .8236 .1310 .1078 .017 .037 .029 -.008 .008 .001 |
|
OB(z) .8153 .1320 .6159 .031 .039 .052 -.007 .028 .001 |
|
OC(O) .0200 .3011 .1217 .020 .032 .026 -.008 .012 -.002 |
|
OC(z) .0176 .3101 .6332 .026 .027 .036 -.010 .011 -.006 |
|
OD(O) .1815 .1252 .1976 .028 .037 .022 .004 .005 -.001 |
|
OD(z) .1982 .1208 .7011 .012 .035 .016 -.001 -.002 .005 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Feldspar |
| |
Benna P, Tribaudino M, Bruno E |
|
American Mineralogist 84 (1999) 120-129 |
|
High-temperature in situ structural investigation on lead feldspar |
|
Sample at T = 465 C, single Pb atom model |
|
_database_code_amcsd 0002067 |
|
8.440 13.051 14.325 90 115.33 90 I2/c |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Pb .2745 -.0050 .0706 .026 .104 .056 -.009 .011 -.007 |
|
Si1(O) .0061 .1786 .1095 .71 .024 .024 .019 -.004 .012 .000 |
|
Al1(O) .0061 .1786 .1095 .29 .024 .024 .019 -.004 .012 .000 |
|
Si1(z) .0039 .1802 .6160 .71 .011 .018 .014 -.006 .003 -.001 |
|
Al1(z) .0039 .1802 .6160 .29 .011 .018 .014 -.006 .003 -.001 |
|
Si2(O) .6980 .1194 .1727 .71 .006 .018 .017 .001 .001 .002 |
|
Al2(O) .6980 .1194 .1727 .29 .006 .018 .017 .001 .001 .002 |
|
Si2(z) .6890 .1152 .6726 .71 .019 .019 .024 -.005 .010 -.005 |
|
Al2(z) .6890 .1152 .6726 .29 .019 .019 .024 -.005 .010 -.005 |
|
OA(1) .0028 .1347 .0009 .034 .041 .015 .001 .011 -.007 |
|
OA(2) .6037 -.0012 .1468 .018 .019 .046 .015 .008 .000 |
|
OB(O) .8287 .1308 .1100 .036 .043 .041 -.012 .020 -.007 |
|
OB(z) .8128 .1329 .6134 .022 .051 .062 -.010 .024 .008 |
|
OC(O) .0138 .3023 .1207 .024 .040 .027 -.005 .010 -.010 |
|
OC(z) .0265 .3096 .6356 .034 .020 .058 -.019 .012 -.006 |
|
OD(O) .1789 .1261 .1969 .042 .048 .036 .015 .010 -.002 |
|
OD(z) .1983 .1217 .7015 .013 .046 .016 -.002 -.003 .008 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Feldspar |
| |
Benna P, Tribaudino M, Bruno E |
|
American Mineralogist 84 (1999) 120-129 |
|
High-temperature in situ structural investigation on lead feldspar |
|
Sample at T = 700 C, single Pb atom model |
|
_database_code_amcsd 0002068 |
|
8.448 13.057 7.166 90 115.25 90 C2/m |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Pb .2760 -.0041 .1404 .038 .130 .076 -.011 .016 -.011 |
|
Si1 .0051 .1798 .2253 .71 .029 .032 .031 -.005 .012 .001 |
|
Al1 .0051 .1798 .2253 .29 .029 .032 .031 -.005 .012 .001 |
|
Si2 .6948 .1174 .3453 .71 .019 .024 .030 -.001 .007 -.001 |
|
Al2 .6948 .1174 .3453 .29 .019 .024 .030 -.001 .007 -.001 |
|
OA(1) 0 .1351 0 .049 .055 .029 0 .022 0 |
|
OA(2) .6057 0 .2918 .030 .024 .066 0 .013 0 |
|
OB .8203 .1334 .2243 .041 .063 .064 -.015 .025 -.001 |
|
OC .0215 .3072 .2543 .041 .039 .066 -.011 .021 -.003 |
|
OD .1899 .1248 .3983 .043 .060 .038 .006 .009 .002 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Feldspar |
| |
Benna P, Tribaudino M, Bruno E |
|
American Mineralogist 84 (1999) 120-129 |
|
High-temperature in situ structural investigation on lead feldspar |
|
Sample at T = 20 C, split Pb atom model |
|
_database_code_amcsd 0002069 |
|
8.402 13.043 14.308 90 115.30 90 I2/c |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Pb' .2698 -.0113 .0730 .74 .012 .040 .023 -.008 .005 -.001 |
|
Pb" .2768 .0103 .0687 .26 .011 .080 .047 .009 .008 .004 |
|
Si1(O) .0062 .1767 .1097 .71 .009 .013 .010 -.002 .004 -.000 |
|
Al1(O) .0062 .1767 .1097 .29 .009 .013 .010 -.002 .004 -.000 |
|
Si1(z) .0033 .1794 .6156 .71 .005 .012 .007 -.002 .001 -.000 |
|
Al1(z) .0033 .1794 .6156 .29 .005 .012 .007 -.002 .001 -.000 |
|
Si2(O) .6950 .1192 .1717 .71 .004 .009 .008 .000 .000 .000 |
|
Al2(O) .6950 .1192 .1717 .29 .004 .009 .008 .000 .000 .000 |
|
Si2(z) .6883 .1147 .6739 .71 .006 .010 .012 .000 .004 -.001 |
|
Al2(z) .6883 .1147 .6739 .29 .006 .010 .012 .000 .004 -.001 |
|
OA(1) .0041 .1342 .0012 .018 .024 .006 -.003 .005 .000 |
|
OA(2) .5986 -.0011 .1470 .008 .010 .020 -.001 .001 .000 |
|
OB(O) .8248 .1297 .1074 .011 .022 .024 -.003 .008 .000 |
|
OB(z) .8144 .1311 .6170 .017 .025 .029 -.005 .013 .001 |
|
OC(O) .0178 .3006 .1224 .012 .022 .020 -.005 .005 -.003 |
|
OC(z) .0183 .3103 .6323 .021 .015 .018 -.009 .005 -.003 |
|
OD(O) .1857 .1240 .1969 .013 .026 .011 .001 -.001 .002 |
|
OD(z) .1987 .1212 .7010 .014 .021 .013 -.002 .000 .003 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Feldspar |
| |
Benna P, Tribaudino M, Bruno E |
|
American Mineralogist 84 (1999) 120-129 |
|
High-temperature in situ structural investigation on lead feldspar |
|
Sample at T = 230 C, split Pb atom model |
|
_database_code_amcsd 0002070 |
|
8.422 13.045 14.310 90 115.34 90 I2/c |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Pb' .2705 -.0136 .0726 .59 .021 .054 .034 -.013 .007 -.001 |
|
Pb" .2787 .0089 .0686 .41 .019 .081 .061 .006 .012 .005 |
|
Si1(O) .0059 .1777 .1100 .71 .016 .019 .012 -.004 .005 .001 |
|
Al1(O) .0059 .1777 .1100 .29 .016 .019 .012 -.004 .005 .001 |
|
Si1(z) .0039 .1798 .6158 .71 .011 .017 .013 -.003 .005 .001 |
|
Al1(z) .0039 .1798 .6158 .29 .011 .017 .013 -.003 .005 .001 |
|
Si2(O) .6959 .1194 .1714 .71 .013 .013 .015 .002 .002 .002 |
|
Al2(O) .6959 .1194 .1714 .29 .013 .013 .015 .002 .002 .002 |
|
Si2(z) .6901 .1148 .6732 .71 .008 .018 .015 -.003 .003 -.003 |
|
Al2(z) .6901 .1148 .6732 .29 .008 .018 .015 -.003 .003 -.003 |
|
OA(1) .0041 .1342 .0011 .029 .031 .014 -.001 .009 -.001 |
|
OA(2) .6023 -.0016 .1462 .011 .016 .038 .000 .004 -.001 |
|
OB(O) .8236 .1310 .1078 .017 .037 .029 -.008 .008 .001 |
|
OB(z) .8153 .1320 .6159 .031 .039 .052 -.007 .028 .001 |
|
OC(O) .0200 .3011 .1217 .020 .032 .026 -.008 .012 -.002 |
|
OC(z) .0176 .3101 .6332 .026 .027 .036 -.010 .011 -.006 |
|
OD(O) .1815 .1252 .1976 .028 .037 .022 .004 .005 -.001 |
|
OD(z) .1982 .1208 .7011 .012 .035 .016 -.001 -.002 .005 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Feldspar |
| |
Benna P, Tribaudino M, Bruno E |
|
American Mineralogist 84 (1999) 120-129 |
|
High-temperature in situ structural investigation on lead feldspar |
|
Sample at T = 465 C, split Pb atom model |
|
_database_code_amcsd 0002071 |
|
8.440 13.051 14.325 90 115.33 90 I2/c |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Pb' .2703 -.0157 .0717 .44 .024 .063 .043 -.021 .010 -.005 |
|
Pb" .2798 .0068 .0693 .56 .026 .098 .071 .004 .013 -.000 |
|
Si1(O) .0061 .1786 .1095 .71 .024 .024 .019 -.004 .012 .000 |
|
Al1(O) .0061 .1786 .1095 .29 .024 .024 .019 -.004 .012 .000 |
|
Si1(z) .0039 .1802 .6160 .71 .011 .018 .014 -.006 .003 -.001 |
|
Al1(z) .0039 .1802 .6160 .29 .011 .018 .014 -.006 .003 -.001 |
|
Si2(O) .6980 .1194 .1727 .71 .006 .018 .017 .001 .001 .002 |
|
Al2(O) .6980 .1194 .1727 .29 .006 .018 .017 .001 .001 .002 |
|
Si2(z) .6890 .1152 .6726 .71 .019 .019 .024 -.005 .010 -.005 |
|
Al2(z) .6890 .1152 .6726 .29 .019 .019 .024 -.005 .010 -.005 |
|
OA(1) .0028 .1347 .0009 .034 .041 .015 .001 .011 -.007 |
|
OA(2) .6037 -.0012 .1468 .018 .019 .046 .015 .008 .000 |
|
OB(O) .8287 .1308 .1100 .036 .043 .041 -.012 .020 -.007 |
|
OB(z) .8128 .1329 .6134 .022 .051 .062 -.010 .024 .008 |
|
OC(O) .0138 .3023 .1207 .024 .040 .027 -.005 .010 -.010 |
|
OC(z) .0265 .3096 .6356 .034 .020 .058 -.019 .012 -.006 |
|
OD(O) .1789 .1261 .1969 .042 .048 .036 .015 .010 -.002 |
|
OD(z) .1983 .1217 .7015 .013 .046 .016 -.002 -.003 .008 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Feldspar |
| |
Benna P, Tribaudino M, Bruno E |
|
American Mineralogist 84 (1999) 120-129 |
|
High-temperature in situ structural investigation on lead feldspar |
|
Sample at T = 700 C, split Pb atom model |
|
_database_code_amcsd 0002072 |
|
8.448 13.057 7.166 90 115.25 90 C2/m |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Pb' .2771 -.0158 .1405 .5 .039 .083 .076 -.013 .016 -.003 |
|
Pb" .2771 .0158 .1405 .5 .039 .083 .076 .013 .016 .003 |
|
Si1 .0051 .1798 .2253 .71 .029 .032 .031 -.005 .012 .001 |
|
Al1 .0051 .1798 .2253 .29 .029 .032 .031 -.005 .012 .001 |
|
Si2 .6948 .1174 .3453 .71 .019 .024 .030 -.001 .007 -.001 |
|
Al2 .6948 .1174 .3453 .29 .019 .024 .030 -.001 .007 -.001 |
|
OA(1) 0 .1351 0 .049 .055 .029 0 .022 0 |
|
OA(2) .6057 0 .2918 .030 .024 .066 0 .013 0 |
|
OB .8203 .1334 .2243 .041 .063 .064 -.015 .025 -.001 |
|
OC .0215 .3072 .2543 .041 .039 .066 -.011 .021 -.003 |
|
OD .1899 .1248 .3983 .043 .060 .038 .006 .009 .002 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Feldspar |
| |
Benna P, Bruno E |
|
American Mineralogist 88 (2003) 1532-1541 |
|
Single-crystal in situ high-temperature structural investigation of the I-1 - I2/c phase |
|
transition in Ca0.2Sr0.8Al2Si2O8 feldspar |
|
T = 20 C |
|
_database_code_amcsd 0003177 |
|
8.361 12.973 14.259 90.79 115.55 90.62 I-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) |
|
Ca(0) .2694 .0014 .0669 .2 .020 .008 .028 .022 .000 .003 -.011 |
|
Sr(0) .2694 .0014 .0669 .8 .020 .008 .028 .022 .000 .003 -.011 |
|
Ca(z) .2678 .0072 .5629 .2 .016 .008 .020 .017 .000 .004 -.003 |
|
Sr(z) .2678 .0072 .5629 .8 .016 .008 .020 .017 .000 .004 -.003 |
|
SiT1(00) .0070 .1698 .1072 .010 .009 .011 .009 -.003 .005 .000 |
|
AlT1(0z) .0029 .1737 .6154 .009 .010 .010 .009 -.002 .005 .000 |
|
AlT1(m0) .0022 .8194 .1176 .009 .010 .010 .009 .001 .005 .000 |
|
SiT1(mz) .0068 .8222 .6095 .009 .009 .011 .008 .002 .004 .001 |
|
AlT2(00) .6919 .1185 .1669 .009 .008 .008 .010 .000 .003 .000 |
|
SiT2(0z) .6830 .1112 .6681 .009 .008 .008 .011 -.001 .004 .000 |
|
SiT2(m0) .6844 .8852 .1754 .009 .008 .008 .010 .000 .004 .000 |
|
AlT2(mz) .6927 .8781 .6724 .008 .008 .008 .010 .000 .004 .000 |
|
OA(10) .0064 .1279 .9978 .014 .017 .017 .009 -.003 .007 .000 |
|
OA(1z) .9945 .1287 .4966 .013 .014 .016 .010 .002 .008 .002 |
|
OA(20) .5884 .9965 .1421 .013 .012 .008 .018 .000 .006 .002 |
|
OA(2z) .5874 .9967 .6422 .013 .010 .008 .019 -.001 .006 .002 |
|
OB(00) .8251 .1190 .1012 .016 .013 .017 .021 -.004 .011 -.001 |
|
OB(0z) .8061 .1194 .6067 .015 .015 .017 .018 -.003 .011 .000 |
|
OB(m0) .8100 .8675 .1174 .018 .015 .022 .024 .003 .013 -.003 |
|
OB(mz) .8275 .8679 .6087 .016 .014 .020 .018 .005 .011 .002 |
|
OC(00) .0148 .2924 .1242 .016 .015 .013 .019 -.006 .007 -.004 |
|
OC(0z) .0193 .3047 .6381 .016 .015 .012 .020 -.006 .007 -.003 |
|
OC(m0) .0144 .6865 .1229 .015 .014 .011 .019 .003 .006 .001 |
|
OC(mz) .0094 .6979 .6119 .015 .013 .012 .018 .002 .005 .000 |
|
OD(00) .1857 .1184 .1930 .017 .014 .023 .012 .001 .004 .002 |
|
OD(0z) .1979 .1132 .6995 .016 .015 .017 .012 .002 .001 .002 |
|
OD(m0) .1991 .8768 .2078 .015 .012 .017 .013 .000 .001 -.001 |
|
OD(mz) .1877 .8697 .7000 .018 .015 .021 .015 -.002 .002 -.003 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Feldspar |
| |
Benna P, Bruno E |
|
American Mineralogist 88 (2003) 1532-1541 |
|
Single-crystal in situ high-temperature structural investigation of the I-1 - I2/c phase |
|
transition in Ca0.2Sr0.8Al2Si2O8 feldspar |
|
T = 200 C |
|
_database_code_amcsd 0003178 |
|
8.367 12.968 14.266 90.68 115.51 90.54 I-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) |
|
Ca(0) .2704 .0010 .0667 .2 .027 .011 .037 .029 .000 .005 -.012 |
|
Sr(0) .2704 .0010 .0667 .8 .027 .011 .037 .029 .000 .005 -.012 |
|
Ca(z) .2690 .0059 .5640 .2 .023 .012 .029 .025 .001 .006 -.004 |
|
Sr(z) .2690 .0059 .5640 .8 .023 .012 .029 .025 .001 .006 -.004 |
|
SiT1(00) .0073 .1708 .1074 .013 .014 .015 .011 -.003 .007 -.001 |
|
AlT1(0z) .0031 .1746 .6155 .012 .012 .013 .012 -.002 .006 .000 |
|
AlT1(m0) .0021 .8197 .1173 .012 .013 .014 .011 .002 .006 .000 |
|
SiT1(mz) .0069 .8224 .6093 .012 .013 .014 .011 .003 .006 .001 |
|
AlT2(00) .6933 .1190 .1679 .012 .010 .012 .013 .000 .005 .000 |
|
SiT2(0z) .6838 .1115 .6687 .012 .011 .011 .014 -.001 .006 -.001 |
|
SiT2(m0) .6852 .8854 .1748 .012 .010 .011 .013 .001 .004 .000 |
|
AlT2(mz) .6936 .8782 .6724 .012 .012 .011 .013 .001 .006 .000 |
|
OA(10) .0059 .1285 .9983 .018 .023 .019 .013 -.001 .010 .001 |
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OA(1z) .9953 .1292 .4972 .018 .022 .022 .012 .001 .010 .002 |
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OA(20) .5906 .9970 .1425 .017 .016 .010 .025 .001 .008 .002 |
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OA(2z) .5893 .9974 .6421 .017 .011 .011 .027 -.001 .005 .000 |
|
OB(00) .8265 .1205 .1024 .022 .019 .025 .026 -.005 .014 -.001 |
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OB(0z) .8069 .1207 .6076 .022 .020 .024 .027 -.005 .016 .001 |
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OB(m0) .8099 .8677 .1165 .024 .018 .029 .031 .005 .016 -.003 |
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OB(mz) .8286 .8683 .6091 .022 .021 .026 .027 .007 .016 .003 |
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OC(00) .0142 .2933 .1232 .021 .021 .018 .025 -.006 .010 -.005 |
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OC(0z) .0195 .3059 .6369 .021 .019 .016 .030 -.007 .011 -.006 |
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OC(m0) .0153 .6868 .1242 .020 .018 .015 .025 .005 .008 .002 |
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OC(mz) .0115 .6986 .6129 .021 .020 .017 .025 .005 .008 .002 |
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OD(00) .1865 .1201 .1935 .024 .021 .031 .016 .003 .004 .002 |
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OD(0z) .1966 .1144 .6999 .021 .018 .024 .015 .002 .002 .001 |
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OD(m0) .1987 .8775 .2071 .022 .018 .026 .016 -.001 .001 -.002 |
|
OD(mz) .1879 .8704 .6991 .024 .018 .029 .017 -.001 .002 -.003 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Feldspar |
| |
Benna P, Bruno E |
|
American Mineralogist 88 (2003) 1532-1541 |
|
Single-crystal in situ high-temperature structural investigation of the I-1 - I2/c phase |
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transition in Ca0.2Sr0.8Al2Si2O8 feldspar |
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T = 400 C |
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_database_code_amcsd 0003179 |
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8.377 12.971 14.275 90.46 115.49 90.30 I-1 |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Ca(0) .2713 -.0002 .0665 .2 .034 .017 .045 .037 .000 .008 -.011 |
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Sr(0) .2713 -.0002 .0665 .8 .034 .017 .045 .037 .000 .008 -.011 |
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Ca(z) .2702 .0041 .5650 .2 .031 .017 .040 .034 .001 .009 -.001 |
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Sr(z) .2702 .0041 .5650 .8 .031 .017 .040 .034 .001 .009 -.001 |
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SiT1(00) .0074 .1725 .1079 .016 .017 .019 .015 -.003 .009 -.001 |
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AlT1(0z) .0027 .1762 .6158 .016 .019 .016 .017 -.003 .010 -.001 |
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AlT1(m0) .0024 .8205 .1168 .016 .019 .018 .015 .004 .010 .001 |
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SiT1(mz) .0073 .8234 .6090 .016 .017 .018 .015 .004 .009 .000 |
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AlT2(00) .6945 .1197 .1691 .016 .015 .016 .018 -.001 .008 .000 |
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SiT2(0z) .6846 .1123 .6700 .015 .014 .013 .018 -.001 .007 -.001 |
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SiT2(m0) .6862 .8860 .1740 .016 .016 .013 .018 .002 .007 .000 |
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AlT2(mz) .6942 .8786 .6717 .016 .016 .015 .018 .001 .009 .000 |
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OA(10) .0054 .1292 .9994 .024 .031 .026 .018 .000 .014 -.001 |
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OA(1z) .9950 .1298 .4979 .025 .033 .029 .017 .002 .016 .002 |
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OA(20) .5920 .9983 .1431 .024 .020 .014 .036 .002 .009 .003 |
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OA(2z) .5913 .9985 .6426 .024 .019 .014 .036 .000 .010 .000 |
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OB(00) .8278 .1237 .1039 .029 .025 .035 .033 -.009 .020 -.004 |
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OB(0z) .8079 .1241 .6097 .031 .027 .034 .041 -.005 .024 .002 |
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OB(m0) .8100 .8696 .1149 .034 .029 .040 .043 .008 .026 -.002 |
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OB(mz) .8292 .8700 .6080 .029 .025 .035 .035 .008 .021 .003 |
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OC(00) .0147 .2953 .1212 .030 .033 .019 .038 -.008 .015 -.005 |
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OC(0z) .0188 .3080 .6340 .028 .025 .020 .038 -.008 .014 -.005 |
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OC(m0) .0172 .6879 .1274 .028 .024 .021 .035 .008 .009 .002 |
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OC(mz) .0127 .7001 .6150 .029 .032 .019 .035 .008 .013 .004 |
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OD(00) .1863 .1221 .1943 .032 .028 .041 .024 .006 .008 .004 |
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OD(0z) .1966 .1161 .7012 .029 .030 .031 .020 .004 .004 .003 |
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OD(m0) .1977 .8794 .2058 .030 .025 .034 .024 -.001 .004 -.004 |
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OD(mz) .1877 .8717 .6979 .032 .028 .042 .020 -.001 .004 -.005 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Feldspar |
| |
Benna P, Bruno E |
|
American Mineralogist 88 (2003) 1532-1541 |
|
Single-crystal in situ high-temperature structural investigation of the I-1 - I2/c phase |
|
transition in Ca0.2Sr0.8Al2Si2O8 feldspar |
|
T = 500 C |
|
_database_code_amcsd 0003180 |
|
8.379 12.971 14.278 90.11 115.48 90.06 I-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) |
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Ca(0) .2715 -.0017 .0661 .2 .037 .019 .046 .043 -.001 .011 -.007 |
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Sr(0) .2715 -.0017 .0661 .8 .037 .019 .046 .043 -.001 .011 -.007 |
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Ca(z) .2714 .0024 .5660 .2 .037 .020 .046 .042 -.001 .011 .001 |
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Sr(z) .2714 .0024 .5660 .8 .037 .020 .046 .042 -.001 .011 .001 |
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SiT1(00) .0073 .1746 .1082 .019 .020 .020 .021 -.005 .012 -.003 |
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AlT1(0z) .0027 .1777 .6163 .019 .018 .020 .021 -.004 .011 -.002 |
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AlT1(m0) .0025 .8218 .1166 .019 .020 .019 .021 .003 .012 .000 |
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SiT1(mz) .0075 .8250 .6085 .019 .018 .021 .019 .003 .010 -.001 |
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AlT2(00) .6950 .1207 .1706 .018 .016 .018 .022 -.002 .009 -.002 |
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SiT2(0z) .6853 .1130 .6719 .018 .017 .014 .025 -.003 .010 -.003 |
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SiT2(m0) .6858 .8867 .1724 .018 .017 .015 .024 .001 .010 -.001 |
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AlT2(mz) .6948 .8792 .6707 .018 .017 .017 .023 -.001 .010 -.002 |
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OA(10) .0047 .1294 .0004 .027 .036 .031 .019 -.001 .017 -.004 |
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OA(1z) .9950 .1296 .4992 .028 .035 .031 .021 .002 .016 .001 |
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OA(20) .5919 .0002 .1423 .028 .023 .015 .045 .000 .014 -.001 |
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OA(2z) .5917 0 .6425 .027 .019 .014 .045 -.003 .011 -.003 |
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OB(00) .8295 .1261 .1062 .035 .029 .039 .045 -.009 .025 -.005 |
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OB(0z) .8092 .1267 .6117 .036 .029 .040 .051 -.008 .027 .001 |
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OB(m0) .8094 .8723 .1130 .037 .031 .039 .050 .011 .026 -.004 |
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OB(mz) .8291 .8730 .6065 .036 .034 .040 .049 .011 .032 .001 |
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OC(00) .0136 .2972 .1190 .033 .031 .023 .043 -.008 .014 -.006 |
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OC(0z) .0189 .3096 .6317 .032 .029 .023 .045 -.008 .016 -.007 |
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OC(m0) .0174 .6896 .1302 .032 .028 .022 .047 .005 .017 .002 |
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OC(mz) .0132 .7020 .6176 .034 .033 .025 .041 .007 .015 .004 |
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OD(00) .1870 .1246 .1958 .038 .037 .045 .028 .005 .010 .004 |
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OD(0z) .1965 .1187 .7026 .034 .026 .041 .024 -.001 .002 .000 |
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OD(m0) .1974 .8803 .2038 .034 .032 .038 .025 -.004 .005 -.007 |
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OD(mz) .1867 .8743 .6960 .036 .027 .048 .025 -.003 .003 -.008 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Feldspar |
| |
Benna P, Bruno E |
|
American Mineralogist 88 (2003) 1532-1541 |
|
Single-crystal in situ high-temperature structural investigation of the I-1 - I2/c phase |
|
transition in Ca0.2Sr0.8Al2Si2O8 feldspar |
|
T = 620 C |
|
_database_code_amcsd 0003181 |
|
8.386 12.970 14.283 90 115.46 90 I2/c |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Ca .2723 -.0019 .0661 .2 .041 .022 .055 .043 .000 .009 -.004 |
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Sr .2723 -.0019 .0661 .8 .041 .022 .055 .043 .000 .009 -.004 |
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SiT1(0) .0070 .1752 .1082 .020 .021 .025 .017 -.004 .010 -.001 |
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AlT1(z) .0030 .1781 .6165 .020 .022 .023 .018 -.004 .010 -.001 |
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AlT2(0) .6955 .1209 .1708 .020 .019 .020 .021 -.001 .008 .000 |
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SiT2(z) .6863 .1133 .6722 .019 .018 .018 .022 -.002 .008 -.001 |
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OA(1) .0053 .1303 .0005 .030 .039 .036 .018 -.001 .016 -.002 |
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OA(2) .5930 .0002 .1426 .030 .023 .019 .044 .001 .010 .001 |
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OB(0) .8290 .1273 .1062 .038 .032 .045 .045 -.012 .025 -.005 |
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OB(z) .8098 .1276 .6125 .040 .030 .050 .051 -.007 .027 .005 |
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OC(0) .0137 .2985 .1180 .037 .035 .028 .043 -.010 .013 -.007 |
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OC(z) .0198 .3100 .6311 .035 .030 .026 .048 -.011 .016 -.006 |
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OD(0) .1865 .1252 .1957 .042 .035 .055 .024 .005 .003 .005 |
|
OD(z) .1979 .1190 .7038 .039 .035 .043 .027 .003 .004 .002 |
|
|
| 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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