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{
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{
"id": "mp-867179",
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"structure_string": "Sr1 Cd1 Hg2\n1.0\n0.000000 3.799919 3.799919\n3.799919 0.000000 3.799919\n3.799919 3.799919 0.000000\nSr Cd Hg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Cd\n0.250000 0.250000 0.250000 Hg\n0.750000 0.750000 0.750000 Hg\n",
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{
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{
"id": "mp-1180180",
"created_at": "2022-09-04T14:44:15.597387Z",
"structure_string": "Rb2 Cu4 I6\n1.0\n20.957172 -0.000000 0.000000\n-0.000000 30.582269 -6.883468\n-0.000000 -0.001255 31.347366\nRb Cu I\n2 4 6\ndirect\n0.750000 0.183195 0.816805 Rb\n0.250000 0.816805 0.183195 Rb\n0.500000 0.839994 0.839994 Cu\n-0.000000 0.160006 0.160006 Cu\n0.000000 0.839994 0.839994 Cu\n0.500000 0.160006 0.160006 Cu\n0.750000 0.164396 0.413003 I\n0.250000 0.884296 0.115704 I\n0.250000 0.835604 0.586997 I\n0.750000 0.586997 0.835604 I\n0.250000 0.413003 0.164396 I\n0.750000 0.115704 0.884296 I\n",
"nsites": 12,
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"density": 0.09806957832472514,
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"volume": 20090.906052643048,
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"formula_full": "Rb2 Cu4 I6",
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"formula_anonymous": "AB2C3",
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"updated_at": "2021-11-28T01:36:27.966000Z",
"spacegroup": 63
},
{
"id": "mp-975298",
"created_at": "2022-09-04T14:42:48.811944Z",
"structure_string": "Rb1 Na3\n1.0\n-2.964841 2.964841 5.452560\n2.964841 -2.964841 5.452560\n2.964841 2.964841 -5.452560\nRb Na\n1 3\ndirect\n0.000000 0.000000 0.000000 Rb\n0.750000 0.250000 0.500000 Na\n0.250000 0.750000 0.500000 Na\n0.500000 0.500000 0.000000 Na\n",
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"volume": 191.71816347439585,
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"formula_full": "Rb1 Na3",
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{
"id": "mp-877684",
"created_at": "2022-09-04T14:46:24.999235Z",
"structure_string": "K3 Li3 Sb9 O24\n1.0\n8.803738 0.000000 0.000000\n-3.310790 8.160766 0.000000\n-2.691712 -4.113243 7.497049\nK Li Sb O\n3 3 9 24\ndirect\n0.951250 0.912364 0.929069 K\n0.478306 0.473438 0.016977 K\n0.090946 0.081362 0.038555 K\n0.812341 0.607762 0.542660 Li\n0.427549 0.223100 0.541646 Li\n0.451092 0.970055 0.747226 Li\n0.670649 0.153302 0.166347 Sb\n0.556268 0.673470 0.477775 Sb\n0.128931 0.317002 0.517223 Sb\n0.185988 0.001065 0.491732 Sb\n0.000452 0.508690 0.823798 Sb\n0.681518 0.189929 0.823929 Sb\n0.035106 0.674367 0.317680 Sb\n0.009791 0.491672 0.166488 Sb\n0.792404 0.980284 0.518021 Sb\n0.485168 0.763046 0.346646 O\n0.171747 0.221803 0.635498 O\n0.816128 0.874907 0.657264 O\n0.584676 0.206884 0.290183 O\n0.066326 0.430069 0.721813 O\n0.784074 0.178335 0.688715 O\n0.445701 0.407455 0.364529 O\n0.164488 0.868674 0.639974 O\n0.874004 0.577778 0.639853 O\n0.050634 0.410219 0.067014 O\n0.431954 0.766035 0.024508 O\n0.820579 0.155789 0.025103 O\n0.263597 0.916893 0.953298 O\n0.882874 0.537168 0.953760 O\n0.574693 0.206074 0.960291 O\n0.052933 0.373099 0.411909 O\n0.856799 0.135329 0.347832 O\n0.533208 0.583469 0.635354 O\n0.258618 0.895680 0.309091 O\n0.841922 0.480160 0.306906 O\n0.417416 0.811691 0.688905 O\n0.957752 0.874417 0.276662 O\n0.160767 0.122577 0.364778 O\n0.617555 0.330788 0.570988 O\n",
"nsites": 39,
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"elements": [
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],
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"density": 4.987972668415143,
"density_atomic": 0.07240627794096431,
"volume": 538.6273277546214,
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"formula_full": "K3 Li3 Sb9 O24",
"formula_reduced": "KLiSb3O8",
"formula_anonymous": "ABC3D8",
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{
"id": "mp-1096753",
"created_at": "2022-09-04T14:43:41.491287Z",
"structure_string": "Ca2 Hg1 Au1\n1.0\n-6.173282 6.180593 8.729117\n6.173282 -6.180593 8.729117\n6.173282 6.180593 -8.729117\nCa Hg Au\n2 1 1\ndirect\n0.000000 0.232748 0.232748 Ca\n0.000000 0.767252 0.767252 Ca\n0.000000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Au\n",
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"density": 0.5954416338424503,
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"volume": 1332.2218977389127,
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"formula_full": "Ca2 Hg1 Au1",
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{
"id": "mp-1184887",
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"structure_string": "K3 Ba1\n1.0\n0.000000 5.243629 5.243629\n5.243629 0.000000 5.243629\n5.243629 5.243629 0.000000\nK Ba\n3 1\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Ba\n",
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"density": 1.466287007290255,
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"volume": 288.35392393149834,
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{
"id": "mp-1093975",
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"structure_string": "Tl1 Cd1 In2\n1.0\n-5.986041 6.264683 8.858761\n5.986041 -6.264683 8.858761\n5.986041 6.264683 -8.858761\nTl Cd In\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Cd\n0.000000 0.252300 0.252300 In\n0.000000 0.747700 0.747700 In\n",
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"volume": 1328.837157619825,
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{
"id": "mp-1184910",
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"structure_string": "K3 Ba1\n1.0\n-3.138507 3.138507 7.190885\n3.138507 -3.138507 7.190885\n3.138507 3.138507 -7.190885\nK Ba\n3 1\ndirect\n0.750000 0.250000 0.500000 K\n0.250000 0.750000 0.500000 K\n0.500000 0.500000 0.000000 K\n0.000000 0.000000 0.000000 Ba\n",
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{
"id": "mp-1096508",
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"structure_string": "K2 Hg1 Au1\n1.0\n-6.232290 6.723906 8.798057\n6.232290 -6.723906 8.798057\n6.232290 6.723906 -8.798057\nK Hg Au\n2 1 1\ndirect\n0.228499 0.000000 0.228499 K\n0.771501 0.000000 0.771501 K\n0.500000 0.000000 0.500000 Hg\n0.000000 0.000000 0.000000 Au\n",
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{
"id": "mp-975109",
"created_at": "2022-09-04T14:40:02.790227Z",
"structure_string": "Rb2 Na6\n1.0\n4.168099 -7.219360 0.000000\n4.168099 7.219360 0.000000\n0.000000 0.000000 6.557049\nRb Na\n2 6\ndirect\n0.333333 0.666667 0.750000 Rb\n0.666667 0.333333 0.250000 Rb\n0.153392 0.306785 0.250000 Na\n0.693215 0.846608 0.250000 Na\n0.153392 0.846608 0.250000 Na\n0.846608 0.693215 0.750000 Na\n0.306785 0.153392 0.750000 Na\n0.846608 0.153392 0.750000 Na\n",
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"formula_full": "Rb2 Na6",
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{
"id": "mp-975110",
"created_at": "2022-09-04T14:45:35.057402Z",
"structure_string": "Rb2 Mg6\n1.0\n4.245118 -7.352760 0.000000\n4.245118 7.352760 0.000000\n0.000000 0.000000 5.107639\nRb Mg\n2 6\ndirect\n0.666667 0.333333 0.250000 Rb\n0.333333 0.666667 0.750000 Rb\n0.123524 0.247049 0.250000 Mg\n0.752951 0.876476 0.250000 Mg\n0.123524 0.876476 0.250000 Mg\n0.876476 0.123524 0.750000 Mg\n0.247049 0.123524 0.750000 Mg\n0.876476 0.752951 0.750000 Mg\n",
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]
}