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{
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"results": [
{
"id": "mp-756580",
"created_at": "2022-09-04T14:47:56.717683Z",
"structure_string": "Sr2 Lu4 O8\n1.0\n1.656307 -5.473285 0.000000\n1.656307 5.473285 0.000000\n0.000000 0.000000 11.024856\nSr Lu O\n2 4 8\ndirect\n0.389298 0.610702 0.250000 Sr\n0.610702 0.389298 0.750000 Sr\n0.866034 0.133966 0.928256 Lu\n0.866034 0.133966 0.571744 Lu\n0.133966 0.866034 0.071744 Lu\n0.133966 0.866034 0.428256 Lu\n0.500000 0.500000 0.000000 O\n0.500000 0.500000 0.500000 O\n0.946139 0.053861 0.750000 O\n0.763846 0.236154 0.106844 O\n0.763846 0.236154 0.393156 O\n0.236154 0.763846 0.606844 O\n0.236154 0.763846 0.893156 O\n0.053861 0.946139 0.250000 O\n",
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{
"id": "mp-13189",
"created_at": "2022-09-04T14:42:58.206668Z",
"structure_string": "Sr2 Lu2 Cu2 S6\n1.0\n1.949862 -6.512047 0.000000\n1.949862 6.512047 0.000000\n0.000000 0.000000 10.036072\nSr Lu Cu S\n2 2 2 6\ndirect\n0.748897 0.251103 0.750000 Sr\n0.251103 0.748897 0.250000 Sr\n0.000000 0.000000 0.000000 Lu\n0.000000 0.000000 0.500000 Lu\n0.527960 0.472040 0.250000 Cu\n0.472040 0.527960 0.750000 Cu\n0.075331 0.924669 0.750000 S\n0.924669 0.075331 0.250000 S\n0.634761 0.365239 0.064419 S\n0.634761 0.365239 0.435581 S\n0.365239 0.634761 0.564419 S\n0.365239 0.634761 0.935581 S\n",
"nsites": 12,
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"elements": [
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"S"
],
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"density": 5.503181074774239,
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"volume": 254.86791489877123,
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"formula_full": "Sr2 Lu2 Cu2 S6",
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"energy": -68.64930065,
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"updated_at": "2021-11-28T01:35:58.471000Z",
"spacegroup": 63
},
{
"id": "mp-568191",
"created_at": "2022-09-04T14:41:18.310228Z",
"structure_string": "Sr2 Lu2 Cu2 Se6\n1.0\n2.029715 -6.773814 0.000000\n2.029715 6.773814 0.000000\n0.000000 0.000000 10.446202\nSr Lu Cu Se\n2 2 2 6\ndirect\n0.751295 0.248705 0.250000 Sr\n0.248705 0.751295 0.750000 Sr\n0.000000 0.000000 0.000000 Lu\n0.000000 0.000000 0.500000 Lu\n0.529238 0.470762 0.750000 Cu\n0.470762 0.529238 0.250000 Cu\n0.362206 0.637794 0.438470 Se\n0.922585 0.077415 0.750000 Se\n0.637794 0.362206 0.938470 Se\n0.362206 0.637794 0.061530 Se\n0.077415 0.922585 0.250000 Se\n0.637794 0.362206 0.561530 Se\n",
"nsites": 12,
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"chemical_system": "Cu-Lu-Se-Sr",
"density": 6.509397190413869,
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"volume": 287.24782162024565,
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"formula_full": "Sr2 Lu2 Cu2 Se6",
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"updated_at": "2021-11-28T01:35:15.091000Z",
"spacegroup": 63
},
{
"id": "mp-1192751",
"created_at": "2022-09-04T14:47:43.829792Z",
"structure_string": "Sr4 Lu8 S16\n1.0\n3.927743 0.000000 0.000000\n0.000000 11.981812 0.000000\n0.000000 0.000000 14.135395\nSr Lu S\n4 8 16\ndirect\n0.250000 0.760808 0.334253 Sr\n0.250000 0.260808 0.165747 Sr\n0.750000 0.239192 0.665747 Sr\n0.750000 0.739192 0.834253 Sr\n0.250000 0.438916 0.389967 Lu\n0.250000 0.938916 0.110033 Lu\n0.750000 0.561084 0.610033 Lu\n0.750000 0.061084 0.889967 Lu\n0.250000 0.417861 0.901221 Lu\n0.250000 0.917861 0.598779 Lu\n0.750000 0.582139 0.098779 Lu\n0.750000 0.082139 0.401221 Lu\n0.250000 0.204591 0.834029 S\n0.250000 0.704591 0.665971 S\n0.750000 0.795409 0.165971 S\n0.750000 0.295409 0.334029 S\n0.250000 0.125861 0.528914 S\n0.250000 0.625861 0.971086 S\n0.750000 0.874139 0.471086 S\n0.750000 0.374139 0.028914 S\n0.250000 0.026670 0.284478 S\n0.250000 0.526670 0.215522 S\n0.750000 0.973330 0.715522 S\n0.750000 0.473330 0.784478 S\n0.250000 0.411414 0.577017 S\n0.250000 0.911414 0.922983 S\n0.750000 0.588586 0.422983 S\n0.750000 0.088586 0.077017 S\n",
"nsites": 28,
"nelements": 3,
"elements": [
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],
"chemical_system": "Lu-S-Sr",
"density": 5.649490264478433,
"density_atomic": 0.04209054198851075,
"volume": 665.2325837867097,
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"formula_full": "Sr4 Lu8 S16",
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"formula_anonymous": "AB2C4",
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"updated_at": "2021-11-28T01:38:22.088000Z",
"spacegroup": 62
},
{
"id": "mp-1194337",
"created_at": "2022-09-04T14:47:38.134432Z",
"structure_string": "Sr4 Lu8 Se16\n1.0\n4.089803 0.000000 0.000000\n0.000000 12.530582 0.000000\n0.000000 0.000000 14.777105\nSr Lu Se\n4 8 16\ndirect\n0.250000 0.759976 0.333788 Sr\n0.250000 0.259976 0.166212 Sr\n0.750000 0.240024 0.666212 Sr\n0.750000 0.740024 0.833788 Sr\n0.250000 0.439255 0.389199 Lu\n0.250000 0.939255 0.110801 Lu\n0.750000 0.560745 0.610801 Lu\n0.750000 0.060745 0.889199 Lu\n0.250000 0.417201 0.902649 Lu\n0.250000 0.917201 0.597351 Lu\n0.750000 0.582799 0.097351 Lu\n0.750000 0.082799 0.402649 Lu\n0.250000 0.204698 0.831575 Se\n0.250000 0.704698 0.668425 Se\n0.750000 0.795302 0.168425 Se\n0.750000 0.295302 0.331575 Se\n0.250000 0.128033 0.530393 Se\n0.250000 0.628033 0.969607 Se\n0.750000 0.871967 0.469607 Se\n0.750000 0.371967 0.030393 Se\n0.250000 0.028212 0.284569 Se\n0.250000 0.528212 0.215431 Se\n0.750000 0.971788 0.715431 Se\n0.750000 0.471788 0.784569 Se\n0.250000 0.409344 0.576461 Se\n0.250000 0.909344 0.923539 Se\n0.750000 0.590656 0.423539 Se\n0.750000 0.090656 0.076461 Se\n",
"nsites": 28,
"nelements": 3,
"elements": [
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"Lu",
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],
"chemical_system": "Lu-Se-Sr",
"density": 6.607972922299021,
"density_atomic": 0.03697388108091341,
"volume": 757.2913413856927,
"volume_molar": 16.287553764835195,
"formula_full": "Sr4 Lu8 Se16",
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"formula_anonymous": "AB2C4",
"energy": -160.42444471,
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"updated_at": "2021-11-28T01:38:11.845000Z",
"spacegroup": 62
},
{
"id": "mp-1094286",
"created_at": "2022-09-04T14:40:56.364914Z",
"structure_string": "Sr3 Mg3\n1.0\n2.126466 -3.683148 0.000000\n2.126466 3.683148 0.000000\n0.000000 0.000000 15.813813\nSr Mg\n3 3\ndirect\n0.666667 0.333333 0.723069 Sr\n0.000000 0.000000 0.500000 Sr\n0.666667 0.333333 0.276931 Sr\n0.666667 0.333333 0.000000 Mg\n0.000000 0.000000 0.888442 Mg\n0.000000 0.000000 0.111558 Mg\n",
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],
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"density": 2.2508846889671776,
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"volume": 247.71038153156383,
"volume_molar": 24.862446421606364,
"formula_full": "Sr3 Mg3",
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"updated_at": "2021-11-28T01:35:01.177000Z",
"spacegroup": 187
},
{
"id": "mp-1094299",
"created_at": "2022-09-04T14:48:12.026403Z",
"structure_string": "Sr3 Mg3\n1.0\n3.524513 -5.413170 0.000000\n3.524513 5.413170 0.000000\n0.000000 0.000000 5.872271\nSr Mg\n3 3\ndirect\n0.611149 0.611149 0.000000 Sr\n0.694817 0.062507 0.500000 Sr\n0.062507 0.694817 0.500000 Sr\n0.310072 0.010086 0.000000 Mg\n0.010086 0.310072 0.000000 Mg\n0.311368 0.311368 0.500000 Mg\n",
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"density": 2.4883449616374973,
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"updated_at": "2021-11-28T01:38:29.714000Z",
"spacegroup": 38
},
{
"id": "mp-1094712",
"created_at": "2022-09-04T14:41:56.415541Z",
"structure_string": "Sr2 Mg2\n1.0\n3.009909 -5.213316 0.000000\n3.009909 5.213316 0.000000\n0.000000 0.000000 7.102601\nSr Mg\n2 2\ndirect\n0.333333 0.666667 0.250000 Sr\n0.666667 0.333333 0.750000 Sr\n0.333333 0.666667 0.750000 Mg\n0.666667 0.333333 0.250000 Mg\n",
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{
"id": "mp-1094774",
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"structure_string": "Sr1 Mg1\n1.0\n2.025837 -3.508853 0.000000\n2.025837 3.508853 0.000000\n0.000000 0.000000 5.589380\nSr Mg\n1 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.666667 0.333333 0.500000 Mg\n",
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{
"id": "mp-1094790",
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"structure_string": "Sr2 Mg2\n1.0\n2.035092 -3.524882 0.000000\n2.035092 3.524882 0.000000\n0.000000 0.000000 11.109896\nSr Mg\n2 2\ndirect\n0.666667 0.333333 0.161368 Sr\n0.333333 0.666667 0.838632 Sr\n0.333333 0.666667 0.408498 Mg\n0.666667 0.333333 0.591502 Mg\n",
"nsites": 4,
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"volume": 159.3927704366746,
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"spacegroup": 164
},
{
"id": "mp-2564",
"created_at": "2022-09-04T14:46:24.792274Z",
"structure_string": "Sr1 Mg1\n1.0\n4.195784 0.000000 0.000000\n0.000000 4.195784 0.000000\n0.000000 0.000000 4.195784\nSr Mg\n1 1\ndirect\n0.500000 0.500000 0.500000 Sr\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 2,
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"spacegroup": 221
},
{
"id": "mp-1094336",
"created_at": "2022-09-04T14:44:16.222527Z",
"structure_string": "Sr1 Mg1\n1.0\n0.000000 3.924116 3.924116\n3.924116 0.000000 3.924116\n3.924116 3.924116 0.000000\nSr Mg\n1 1\ndirect\n0.750000 0.750000 0.750000 Sr\n0.000000 0.000000 0.000000 Mg\n",
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"updated_at": "2021-11-28T01:36:26.928000Z",
"spacegroup": 216
}
]
}