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{
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{
"id": "mp-1078372",
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"structure_string": "Na4 Mg2 Pb2\n1.0\n2.575317 -4.460580 0.000000\n2.575317 4.460580 0.000000\n0.000000 0.000000 10.199934\nNa Mg Pb\n4 2 2\ndirect\n0.333333 0.666667 0.919682 Na\n0.666667 0.333333 0.080318 Na\n0.666667 0.333333 0.419682 Na\n0.333333 0.666667 0.580318 Na\n0.000000 0.000000 0.250000 Mg\n0.000000 0.000000 0.750000 Mg\n0.333333 0.666667 0.250000 Pb\n0.666667 0.333333 0.750000 Pb\n",
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{
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"structure_string": "Na1 Mg1 Pb2\n1.0\n0.000000 3.807390 3.807390\n3.807390 0.000000 3.807390\n3.807390 3.807390 0.000000\nNa Mg Pb\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 Mg\n0.250000 0.250000 0.250000 Pb\n0.750000 0.750000 0.750000 Pb\n",
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"updated_at": "2021-11-28T01:38:03.986000Z",
"spacegroup": 225
},
{
"id": "mp-1017390",
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"structure_string": "Rb2 Na2 Mg12\n1.0\n5.479482 0.000000 0.000000\n0.000000 6.512223 0.000000\n0.000000 0.000000 13.127831\nRb Na Mg\n2 2 12\ndirect\n0.500000 0.500000 0.178970 Rb\n0.500000 0.000000 0.678970 Rb\n0.500000 0.000000 0.171554 Na\n0.500000 0.500000 0.671554 Na\n0.500000 0.250130 0.423565 Mg\n0.500000 0.749870 0.423565 Mg\n0.000000 0.758330 0.057727 Mg\n0.000000 0.241670 0.057727 Mg\n0.000000 0.000000 0.335254 Mg\n0.000000 0.500000 0.351634 Mg\n0.500000 0.750130 0.923565 Mg\n0.500000 0.249870 0.923565 Mg\n0.000000 0.258330 0.557727 Mg\n0.000000 0.741670 0.557727 Mg\n0.000000 0.500000 0.835254 Mg\n0.000000 0.000000 0.851634 Mg\n",
"nsites": 16,
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"elements": [
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],
"chemical_system": "Mg-Na-Rb",
"density": 1.8027789478029144,
"density_atomic": 0.03415531043794371,
"volume": 468.4483845951325,
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"formula_full": "Rb2 Na2 Mg12",
"formula_reduced": "RbNaMg6",
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"updated_at": "2021-11-28T01:37:04.057000Z",
"spacegroup": 38
},
{
"id": "mp-1026692",
"created_at": "2022-09-04T14:41:59.740501Z",
"structure_string": "Rb1 Na1 Mg14\n1.0\n6.660156 0.128779 0.000000\n-3.218552 5.574696 0.000000\n0.000000 0.000000 10.918725\nRb Na Mg\n1 1 14\ndirect\n0.166117 0.833058 0.125000 Rb\n0.168460 0.334229 0.125000 Na\n0.162748 0.331373 0.625000 Mg\n0.163715 0.831857 0.625000 Mg\n0.666295 0.335266 0.125000 Mg\n0.667571 0.332852 0.625000 Mg\n0.666295 0.831028 0.125000 Mg\n0.667571 0.834718 0.625000 Mg\n0.343122 0.176076 0.397755 Mg\n0.343122 0.176076 0.852245 Mg\n0.343122 0.667047 0.397755 Mg\n0.343122 0.667047 0.852245 Mg\n0.828388 0.164195 0.376719 Mg\n0.828388 0.164195 0.873281 Mg\n0.820982 0.660492 0.390152 Mg\n0.820982 0.660492 0.859848 Mg\n",
"nsites": 16,
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"elements": [
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"Na",
"Mg"
],
"chemical_system": "Mg-Na-Rb",
"density": 1.8177449682493527,
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"volume": 409.91980286845353,
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"formula_full": "Rb1 Na1 Mg14",
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"spacegroup": 38
},
{
"id": "mp-1026667",
"created_at": "2022-09-04T14:46:12.790121Z",
"structure_string": "Rb1 Na1 Mg14\n1.0\n6.736888 0.000000 0.000000\n-3.368444 5.834315 0.000000\n0.000000 0.000000 10.545821\nRb Na Mg\n1 1 14\ndirect\n0.166667 0.333333 0.625000 Rb\n0.166667 0.333333 0.125000 Na\n0.169137 0.834568 0.125000 Mg\n0.172590 0.836295 0.625000 Mg\n0.665432 0.330863 0.125000 Mg\n0.663705 0.327410 0.625000 Mg\n0.665432 0.834568 0.125000 Mg\n0.663705 0.836295 0.625000 Mg\n0.341617 0.158383 0.364584 Mg\n0.341617 0.158383 0.885416 Mg\n0.341617 0.683234 0.364584 Mg\n0.341617 0.683234 0.885416 Mg\n0.816766 0.158383 0.364584 Mg\n0.816766 0.158383 0.885416 Mg\n0.833333 0.666667 0.377784 Mg\n0.833333 0.666667 0.872216 Mg\n",
"nsites": 16,
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"elements": [
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"Na",
"Mg"
],
"chemical_system": "Mg-Na-Rb",
"density": 1.7976380584518201,
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"volume": 414.5048306841178,
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"formula_full": "Rb1 Na1 Mg14",
"formula_reduced": "RbNaMg14",
"formula_anonymous": "ABC14",
"energy": -22.15380622,
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"updated_at": "2021-11-28T01:37:24.635000Z",
"spacegroup": 187
},
{
"id": "mp-1017345",
"created_at": "2022-09-04T14:45:06.743135Z",
"structure_string": "Rb2 Na2 Mg12\n1.0\n5.436357 0.000000 0.000000\n0.000000 7.156013 0.000000\n0.000000 0.000000 12.048076\nRb Na Mg\n2 2 12\ndirect\n0.500000 0.500000 0.172885 Rb\n0.500000 0.000000 0.672885 Rb\n0.000000 0.500000 0.340626 Na\n0.000000 0.000000 0.840626 Na\n0.000000 0.220992 0.072843 Mg\n0.000000 0.779008 0.072843 Mg\n0.000000 0.500000 0.832719 Mg\n0.500000 0.260759 0.922733 Mg\n0.500000 0.739241 0.922733 Mg\n0.500000 0.500000 0.662619 Mg\n0.000000 0.720992 0.572843 Mg\n0.000000 0.279008 0.572843 Mg\n0.000000 0.000000 0.332719 Mg\n0.500000 0.760759 0.422733 Mg\n0.500000 0.239241 0.422733 Mg\n0.500000 0.000000 0.162619 Mg\n",
"nsites": 16,
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"elements": [
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"Mg"
],
"chemical_system": "Mg-Na-Rb",
"density": 1.8018035390192464,
"density_atomic": 0.034136830418609855,
"volume": 468.70197976193845,
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"formula_full": "Rb2 Na2 Mg12",
"formula_reduced": "RbNaMg6",
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"spacegroup": 38
},
{
"id": "mp-1026659",
"created_at": "2022-09-04T14:43:00.617453Z",
"structure_string": "Na1 Mg14 Sb1\n1.0\n6.448197 0.047573 0.000000\n-3.182899 5.512942 0.000000\n0.000000 0.000000 10.504121\nNa Mg Sb\n1 14 1\ndirect\n0.165990 0.332994 0.125000 Na\n0.167290 0.333644 0.625000 Mg\n0.165831 0.832915 0.625000 Mg\n0.667592 0.331397 0.125000 Mg\n0.666233 0.334284 0.625000 Mg\n0.667592 0.836194 0.125000 Mg\n0.666233 0.831948 0.625000 Mg\n0.335589 0.167224 0.379814 Mg\n0.335589 0.167224 0.870186 Mg\n0.335589 0.668366 0.379814 Mg\n0.335589 0.668366 0.870186 Mg\n0.829541 0.164771 0.380394 Mg\n0.829541 0.164771 0.869606 Mg\n0.830082 0.665042 0.375278 Mg\n0.830082 0.665042 0.874722 Mg\n0.171639 0.835819 0.125000 Sb\n",
"nsites": 16,
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"elements": [
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"Mg",
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],
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"density": 2.147737202756752,
"density_atomic": 0.042667046827092256,
"volume": 374.9966587760298,
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"formula_full": "Na1 Mg14 Sb1",
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},
{
"id": "mp-1210706",
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"structure_string": "Na2 Mg1 Sb2\n1.0\n6.430466 0.000000 0.000000\n0.000000 6.430466 0.000000\n0.000000 0.000000 14.943479\nNa Mg Sb\n2 1 2\ndirect\n0.500000 0.500000 0.620520 Na\n0.500000 0.500000 0.379480 Na\n0.500000 0.500000 0.000000 Mg\n0.500000 0.500000 0.180068 Sb\n0.500000 0.500000 0.819932 Sb\n",
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"volume": 617.9262008353782,
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"spacegroup": 123
},
{
"id": "mp-7090",
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"structure_string": "Na2 Mg2 Sb2\n1.0\n4.658766 0.000000 0.000000\n0.000000 4.658766 0.000000\n0.000000 0.000000 7.719064\nNa Mg Sb\n2 2 2\ndirect\n0.500000 0.000000 0.357647 Na\n0.000000 0.500000 0.642353 Na\n0.500000 0.500000 0.000000 Mg\n0.000000 0.000000 0.000000 Mg\n0.500000 0.000000 0.772297 Sb\n0.000000 0.500000 0.227703 Sb\n",
"nsites": 6,
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"formula_full": "Na2 Mg2 Sb2",
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},
{
"id": "mp-1026637",
"created_at": "2022-09-04T14:45:08.018681Z",
"structure_string": "Na1 Mg14 Sb1\n1.0\n6.406300 -0.000000 -0.000000\n-3.203150 5.548018 0.000000\n0.000000 -0.000000 10.503917\nNa Mg Sb\n1 14 1\ndirect\n0.166667 0.333333 0.125000 Na\n0.169918 0.834958 0.125000 Mg\n0.163916 0.831957 0.625000 Mg\n0.665042 0.330082 0.125000 Mg\n0.668043 0.336084 0.625000 Mg\n0.665042 0.834958 0.125000 Mg\n0.668043 0.831957 0.625000 Mg\n0.335118 0.164882 0.375970 Mg\n0.335118 0.164882 0.874030 Mg\n0.335118 0.670236 0.375970 Mg\n0.335118 0.670236 0.874030 Mg\n0.829764 0.164882 0.375970 Mg\n0.829764 0.164882 0.874030 Mg\n0.833333 0.666667 0.373775 Mg\n0.833333 0.666667 0.876225 Mg\n0.166667 0.333333 0.625000 Sb\n",
"nsites": 16,
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"elements": [
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],
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"volume": 373.3330300533334,
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"formula_full": "Na1 Mg14 Sb1",
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"spacegroup": 187
},
{
"id": "mp-1017245",
"created_at": "2022-09-04T14:39:58.516042Z",
"structure_string": "Na2 Mg12 Sb2\n1.0\n5.173061 0.000000 0.000000\n0.000000 6.571868 0.000000\n0.000000 0.000000 11.266012\nNa Mg Sb\n2 12 2\ndirect\n0.000000 0.500000 0.333648 Na\n0.000000 0.000000 0.833648 Na\n0.000000 0.247451 0.081192 Mg\n0.000000 0.752549 0.081192 Mg\n0.000000 0.500000 0.835508 Mg\n0.500000 0.253578 0.917410 Mg\n0.500000 0.746422 0.917410 Mg\n0.500000 0.500000 0.667097 Mg\n0.000000 0.747451 0.581192 Mg\n0.000000 0.252549 0.581192 Mg\n0.000000 0.000000 0.335508 Mg\n0.500000 0.753578 0.417410 Mg\n0.500000 0.246422 0.417410 Mg\n0.500000 0.000000 0.167097 Mg\n0.500000 0.500000 0.166545 Sb\n0.500000 0.000000 0.666545 Sb\n",
"nsites": 16,
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],
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"density": 2.519636127974444,
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"volume": 383.00693778427075,
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"formula_full": "Na2 Mg12 Sb2",
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"spacegroup": 38
},
{
"id": "mp-1017305",
"created_at": "2022-09-04T14:46:12.187018Z",
"structure_string": "Na2 Mg12 Sb2\n1.0\n5.272577 0.000000 0.000000\n0.000000 6.353668 0.000000\n0.000000 0.000000 11.435557\nNa Mg Sb\n2 12 2\ndirect\n0.000000 0.000000 0.167170 Na\n0.000000 0.500000 0.667170 Na\n0.000000 0.248225 0.416305 Mg\n0.000000 0.751775 0.416305 Mg\n0.500000 0.750636 0.081232 Mg\n0.500000 0.249364 0.081232 Mg\n0.500000 0.000000 0.335724 Mg\n0.500000 0.500000 0.336299 Mg\n0.000000 0.748225 0.916305 Mg\n0.000000 0.251775 0.916305 Mg\n0.500000 0.250636 0.581232 Mg\n0.500000 0.749364 0.581232 Mg\n0.500000 0.500000 0.835724 Mg\n0.500000 0.000000 0.836299 Mg\n0.000000 0.500000 0.165729 Sb\n0.000000 0.000000 0.665729 Sb\n",
"nsites": 16,
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"elements": [
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],
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"volume": 383.09348963695135,
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"formula_full": "Na2 Mg12 Sb2",
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"updated_at": "2021-11-28T01:37:23.662000Z",
"spacegroup": 38
}
]
}