Ca2Co.9Zn.1Si2O7 Jia Z H, Schaper A K, Massa W, Treutmann W, Rager H Acta Crystallographica B62 (2006) 547-555 Structure and phase transitions in Ca2CoSi2O7-Ca2ZnSi2O7 solid-solution crystals _database_code_amcsd 0009941 23.5180 23.5180 5.0263 90 90 90 P2_12_12 atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) Ca1 .10820 .05357 .5006 .0132 .0139 .0120 .0136 .0006 .0007 -.0018 Ca2 .11500 .39195 .4888 .0150 .0121 .0148 .0180 .0007 .0014 -.0006 Ca3 .05507 .22526 .4983 .0139 .0141 .0130 .0146 -.0021 .0006 .0021 Ca4 .27532 .11121 .5111 .0137 .0138 .0115 .0158 -.0012 .0002 -.0002 Ca5 .26916 .45062 .4757 .0150 .0172 .0105 .0171 -.0028 .0003 -.0014 Ca6 .21553 .26589 .5205 .0159 .0145 .0180 .0151 .0029 -.0001 .0014 Ca7 .44149 .05279 .5221 .0163 .0178 .0133 .0177 .0028 -.0009 .0001 Ca8 .45043 .39740 .5132 .0153 .0150 .0170 .0138 .0035 .0030 -.0023 Ca9 .40127 .21271 .4951 .0152 .0168 .0105 .0183 -.0025 .0003 .0007 Co1 0 0 -.0059 .90 .0115 .0128 .0089 .0128 -.0011 0 0 Zn1 0 0 -.0059 .10 .0115 .0128 .0089 .0128 -.0011 0 0 Co2 .00651 .33616 .0069 .90 .0114 .0114 .0092 .0136 .0007 -.0010 .0009 Zn2 .00651 .33616 .0069 .10 .0114 .0114 .0092 .0136 .0007 -.0010 .0009 Co3 .16332 .16158 .0100 .90 .0117 .0111 .0098 .0142 -.0005 .0005 -.0013 Zn3 .16332 .16158 .0100 .10 .0117 .0111 .0098 .0142 -.0005 .0005 -.0013 Co4 .33358 .00207 .0105 .90 .0127 .0114 .0092 .0173 .0007 .0002 -.0001 Zn4 .33358 .00207 .0105 .10 .0127 .0114 .0092 .0173 .0007 .0002 -.0001 Co5 .33476 .33043 .0049 .90 .01260 .0107 .0093 .0178 .0006 -.0008 .0014 Zn5 .33476 .33043 .0049 .10 .01260 .0107 .0093 .0178 .0006 -.0008 .0014 Si1 .04227 .12069 -.0725 .0120 .0107 .0097 .0157 -.0012 -.0002 -.0015 Si2 .04896 .45591 -.0822 .0124 .0123 .0113 .0135 .0003 -.0003 .0003 Si3 .12568 .28568 .0680 .0114 .0087 .0122 .0133 -.0017 .0004 -.0005 Si4 .21245 .04163 .0737 .0115 .0102 .0128 .0114 -.0007 .0024 .0005 Si5 .21494 .38200 .0454 .0113 .0080 .0104 .0154 -.0012 -.0015 -.0006 Si6 .28315 .20981 -.0427 .0116 .0093 .0140 .0116 -.0007 -.0004 .0028 Si7 .38118 .12307 -.0531 .0120 .0101 .0113 .0147 .0012 -.0004 .0014 Si8 .38259 .45151 -.0519 .0110 .0087 .0128 .0116 .0007 -.0010 -.0006 Si9 .45545 .28014 .0585 .0132 .0101 .0102 .0194 -.0019 -.0009 .0006 O1 -.0077 .1650 .8211 .0162 O2 .1740 -.0145 .1769 .0157 O3 .1788 .3266 .1690 .0160 O4 .3388 .1753 .8348 .0181 O5 .5 0 .201 .015 O6 .0430 .1191 .241 .021 O7 .0505 .4577 .2360 .0154 O8 .1235 .2826 .753 .021 O9 .2160 .0430 .7517 .0137 O10 .2094 .3838 .7248 .0140 O11 .2775 .2035 .2734 .0158 O12 .3854 .1223 .2634 .0148 O13 .3868 .4587 .2623 .0155 O14 .4611 .2756 .7465 .0219 O15 .0246 .0627 .7697 .0168 O16 .0988 .1430 .7793 .0175 O17 .0334 .3964 .7707 .0157 O18 .1047 .4789 .7639 .0153 O19 .1384 .2262 .2229 .0170 O20 .0708 .3119 .2203 .0130 O21 .1831 .0954 .2315 .0167 O22 .2720 .0292 .2311 .0142 O23 .1861 .4359 .2058 .0129 O24 .2783 .3778 .1714 .0185 O25 .2874 .2725 .8290 .0155 O26 .2311 .1803 .7981 .0162 O27 .3558 .0673 .7931 .0124 O28 .4404 .1369 .7894 .0137 O29 .3800 .3885 .8242 .0160 O30 .4345 .4818 .7833 .0162 O31 .4837 .2268 .2258 .0124 O32 .3922 .2848 .1753 .0185