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{
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"results": [
{
"id": "mp-1028309",
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"structure_string": "Sr1 Mg14 V1\n1.0\n6.540842 0.024749 0.000000\n-3.248988 5.627411 0.000000\n0.000000 0.000000 10.431569\nSr Mg V\n1 14 1\ndirect\n0.164353 0.832176 0.125000 Sr\n0.165309 0.332654 0.625000 Mg\n0.167960 0.833980 0.625000 Mg\n0.660217 0.336228 0.125000 Mg\n0.666127 0.330694 0.625000 Mg\n0.660217 0.823988 0.125000 Mg\n0.666127 0.835433 0.625000 Mg\n0.336208 0.178990 0.381483 Mg\n0.336208 0.178990 0.868517 Mg\n0.336208 0.657218 0.381483 Mg\n0.336208 0.657218 0.868517 Mg\n0.840898 0.170449 0.365052 Mg\n0.840898 0.170449 0.884948 Mg\n0.825408 0.662704 0.387741 Mg\n0.825408 0.662704 0.862259 Mg\n0.172248 0.336123 0.125000 V\n",
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},
{
"id": "mp-1028294",
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"structure_string": "Sr1 Mg14 V1\n1.0\n6.526135 0.000000 0.000000\n-3.263067 5.651798 -0.000000\n0.000000 0.000000 10.370316\nSr Mg V\n1 14 1\ndirect\n0.166667 0.333333 0.625000 Sr\n0.164745 0.832372 0.125000 Mg\n0.178069 0.839034 0.625000 Mg\n0.667628 0.335255 0.125000 Mg\n0.660966 0.321931 0.625000 Mg\n0.667628 0.832372 0.125000 Mg\n0.660966 0.839034 0.625000 Mg\n0.334535 0.165465 0.358776 Mg\n0.334535 0.165465 0.891224 Mg\n0.334535 0.669071 0.358776 Mg\n0.334535 0.669071 0.891224 Mg\n0.830929 0.165465 0.358776 Mg\n0.830929 0.165465 0.891224 Mg\n0.833333 0.666667 0.381950 Mg\n0.833333 0.666667 0.868050 Mg\n0.166667 0.333333 0.125000 V\n",
"nsites": 16,
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"elements": [
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"chemical_system": "Mg-Sr-V",
"density": 2.078725459831524,
"density_atomic": 0.04182975372280979,
"volume": 382.50284967074026,
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"formula_full": "Sr1 Mg14 V1",
"formula_reduced": "SrMg14V",
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"energy": -31.08216824,
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"updated_at": "2021-11-28T01:35:22.557000Z",
"spacegroup": 187
},
{
"id": "mp-1187092",
"created_at": "2022-09-04T14:41:24.617397Z",
"structure_string": "Sr2 Mg1 Tl1\n1.0\n0.000000 4.117663 4.117663\n4.117663 0.000000 4.117663\n4.117663 4.117663 0.000000\nSr Mg Tl\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750000 Sr\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Tl\n",
"nsites": 4,
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"elements": [
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],
"chemical_system": "Mg-Sr-Tl",
"density": 4.803645874233384,
"density_atomic": 0.028646897606158,
"volume": 139.63117594765833,
"volume_molar": 21.02196490102812,
"formula_full": "Sr2 Mg1 Tl1",
"formula_reduced": "Sr2MgTl",
"formula_anonymous": "ABC2",
"energy": -8.35342139,
"energy_per_atom": -2.0883553475,
"energy_above_hull": null,
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"updated_at": "2021-11-28T01:35:14.545000Z",
"spacegroup": 225
},
{
"id": "mp-1095942",
"created_at": "2022-09-04T14:40:17.124441Z",
"structure_string": "Sr2 Mg1 Tl1\n1.0\n-6.910624 6.935824 9.719393\n6.910624 -6.935824 9.719393\n6.910624 6.935824 -9.719393\nSr Mg Tl\n2 1 1\ndirect\n0.000000 0.268139 0.268139 Sr\n0.000000 0.731861 0.731861 Sr\n0.000000 0.000000 0.000000 Mg\n0.000000 0.500000 0.500000 Tl\n",
"nsites": 4,
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"elements": [
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],
"chemical_system": "Mg-Sr-Tl",
"density": 0.3599472970033645,
"density_atomic": 0.0021465723391848324,
"volume": 1863.435919200847,
"volume_molar": 280.5468350666872,
"formula_full": "Sr2 Mg1 Tl1",
"formula_reduced": "Sr2MgTl",
"formula_anonymous": "ABC2",
"energy": -2.43945031,
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"updated_at": "2021-11-28T01:34:51.767000Z",
"spacegroup": 71
},
{
"id": "mp-867172",
"created_at": "2022-09-04T14:42:52.160319Z",
"structure_string": "Sr1 Mg1 Tl2\n1.0\n0.000000 3.886229 3.886229\n3.886229 0.000000 3.886229\n3.886229 3.886229 0.000000\nSr Mg Tl\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Mg\n0.250000 0.250000 0.250000 Tl\n0.750000 0.750000 0.750000 Tl\n",
"nsites": 4,
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"elements": [
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],
"chemical_system": "Mg-Sr-Tl",
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"density_atomic": 0.034075703513957965,
"volume": 117.38569090324239,
"volume_molar": 17.67282884572943,
"formula_full": "Sr1 Mg1 Tl2",
"formula_reduced": "SrMgTl2",
"formula_anonymous": "ABC2",
"energy": -9.15156078,
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"updated_at": "2021-11-28T01:35:52.431000Z",
"spacegroup": 225
},
{
"id": "mp-1021571",
"created_at": "2022-09-04T14:44:25.903291Z",
"structure_string": "Sr2 Mg12 Ti2\n1.0\n5.224641 0.000000 0.000000\n0.000000 6.713845 0.000000\n0.000000 0.000000 11.460217\nSr Mg Ti\n2 12 2\ndirect\n0.500000 0.500000 0.160283 Sr\n0.500000 0.000000 0.660283 Sr\n0.000000 0.232811 0.080259 Mg\n0.000000 0.767189 0.080259 Mg\n0.000000 0.500000 0.839748 Mg\n0.500000 0.230193 0.911735 Mg\n0.500000 0.769807 0.911735 Mg\n0.500000 0.500000 0.665785 Mg\n0.000000 0.732811 0.580259 Mg\n0.000000 0.267189 0.580259 Mg\n0.000000 0.000000 0.339748 Mg\n0.500000 0.730193 0.411735 Mg\n0.500000 0.269807 0.411735 Mg\n0.500000 0.000000 0.165785 Mg\n0.000000 0.500000 0.350196 Ti\n0.000000 0.000000 0.850196 Ti\n",
"nsites": 16,
"nelements": 3,
"elements": [
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"Mg",
"Ti"
],
"chemical_system": "Mg-Sr-Ti",
"density": 2.3240981478802047,
"density_atomic": 0.03980149423298734,
"volume": 401.9949579365102,
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"formula_full": "Sr2 Mg12 Ti2",
"formula_reduced": "SrMg6Ti",
"formula_anonymous": "ABC6",
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"updated_at": "2021-11-28T01:36:35.634000Z",
"spacegroup": 38
},
{
"id": "mp-1026475",
"created_at": "2022-09-04T14:45:39.368205Z",
"structure_string": "Sr1 Mg14 Ti1\n1.0\n6.558571 0.011918 0.000000\n-3.268964 5.662011 0.000000\n0.000000 0.000000 10.400076\nSr Mg Ti\n1 14 1\ndirect\n0.160838 0.830418 0.125000 Sr\n0.164012 0.332006 0.625000 Mg\n0.167603 0.833801 0.625000 Mg\n0.658989 0.333236 0.125000 Mg\n0.666658 0.330092 0.625000 Mg\n0.658989 0.825751 0.125000 Mg\n0.666658 0.836565 0.625000 Mg\n0.335784 0.178399 0.381060 Mg\n0.335784 0.178399 0.868940 Mg\n0.335784 0.657386 0.381060 Mg\n0.335784 0.657386 0.868940 Mg\n0.841203 0.170602 0.366430 Mg\n0.841203 0.170602 0.883570 Mg\n0.823027 0.661514 0.386577 Mg\n0.823027 0.661514 0.863423 Mg\n0.184657 0.342328 0.125000 Ti\n",
"nsites": 16,
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"elements": [
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"Ti"
],
"chemical_system": "Mg-Sr-Ti",
"density": 2.0434425921683745,
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"volume": 386.60889605423324,
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"formula_full": "Sr1 Mg14 Ti1",
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"updated_at": "2021-11-28T01:37:07.149000Z",
"spacegroup": 38
},
{
"id": "mp-1026443",
"created_at": "2022-09-04T14:41:22.217287Z",
"structure_string": "Sr1 Mg14 Ti1\n1.0\n6.562548 0.000000 -0.000000\n-3.281274 5.683333 0.000000\n0.000000 -0.000000 10.326384\nSr Mg Ti\n1 14 1\ndirect\n0.166667 0.333333 0.625000 Sr\n0.166791 0.833395 0.125000 Mg\n0.176477 0.838238 0.625000 Mg\n0.666605 0.333209 0.125000 Mg\n0.661762 0.323523 0.625000 Mg\n0.666605 0.833395 0.125000 Mg\n0.661762 0.838238 0.625000 Mg\n0.334658 0.165342 0.360970 Mg\n0.334658 0.165342 0.889030 Mg\n0.334658 0.669317 0.360970 Mg\n0.334658 0.669317 0.889030 Mg\n0.830683 0.165342 0.360970 Mg\n0.830683 0.165342 0.889030 Mg\n0.833333 0.666667 0.379921 Mg\n0.833333 0.666667 0.870079 Mg\n0.166667 0.333333 0.125000 Ti\n",
"nsites": 16,
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],
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"density": 2.0512113810471804,
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"volume": 385.144647698425,
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"formula_full": "Sr1 Mg14 Ti1",
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"updated_at": "2021-11-28T01:35:26.213000Z",
"spacegroup": 187
},
{
"id": "mp-1021478",
"created_at": "2022-09-04T14:47:30.364767Z",
"structure_string": "Sr1 Mg6 Ti1\n1.0\n6.625079 0.000000 0.000000\n0.000000 6.625079 0.000000\n0.000000 0.000000 4.578264\nSr Mg Ti\n1 6 1\ndirect\n0.000000 0.000000 0.500000 Sr\n0.500000 0.000000 0.500000 Mg\n0.000000 0.500000 0.500000 Mg\n0.277408 0.722592 0.000000 Mg\n0.722592 0.277408 0.000000 Mg\n0.277408 0.277408 0.000000 Mg\n0.722592 0.722592 0.000000 Mg\n0.500000 0.500000 0.500000 Ti\n",
"nsites": 8,
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"elements": [
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"formula_full": "Sr1 Mg6 Ti1",
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},
{
"id": "mp-1116",
"created_at": "2022-09-04T14:47:24.642082Z",
"structure_string": "Sr4 Mg34\n1.0\n5.254352 -9.100805 0.000000\n5.254352 9.100805 0.000000\n0.000000 0.000000 10.311687\nSr Mg\n4 34\ndirect\n0.666667 0.333333 0.250000 Sr\n0.333333 0.666667 0.750000 Sr\n0.000000 0.000000 0.750000 Sr\n0.000000 0.000000 0.250000 Sr\n0.165131 0.330262 0.520814 Mg\n0.669738 0.834869 0.520814 Mg\n0.165131 0.834869 0.520814 Mg\n0.834869 0.165131 0.020814 Mg\n0.333333 0.666667 0.102127 Mg\n0.666667 0.333333 0.602127 Mg\n0.666667 0.333333 0.897873 Mg\n0.333333 0.666667 0.397873 Mg\n0.500000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.000000 0.500000 0.500000 Mg\n0.000000 0.500000 0.000000 Mg\n0.500000 0.500000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.329013 0.961487 0.250000 Mg\n0.367526 0.329013 0.750000 Mg\n0.961487 0.632474 0.750000 Mg\n0.038513 0.367526 0.250000 Mg\n0.632474 0.670987 0.250000 Mg\n0.367526 0.038513 0.750000 Mg\n0.670987 0.632474 0.750000 Mg\n0.670987 0.038513 0.750000 Mg\n0.961487 0.329013 0.750000 Mg\n0.038513 0.670987 0.250000 Mg\n0.632474 0.961487 0.250000 Mg\n0.329013 0.367526 0.250000 Mg\n0.165131 0.834869 0.979186 Mg\n0.330262 0.165131 0.479186 Mg\n0.834869 0.669738 0.479186 Mg\n0.165131 0.330262 0.979186 Mg\n0.669738 0.834869 0.979186 Mg\n0.330262 0.165131 0.020814 Mg\n0.834869 0.669738 0.020814 Mg\n0.834869 0.165131 0.479186 Mg\n",
"nsites": 38,
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"elements": [
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],
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"density": 1.981579582434847,
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"volume": 986.1856762406676,
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"formula_full": "Sr4 Mg34",
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"spacegroup": 194
},
{
"id": "mp-1094335",
"created_at": "2022-09-04T14:47:30.056967Z",
"structure_string": "Sr4 Mg2\n1.0\n2.088739 -9.851046 0.000000\n2.088739 9.851046 0.000000\n0.000000 0.000000 6.456338\nSr Mg\n4 2\ndirect\n0.632224 0.367776 0.250000 Sr\n0.932393 0.067607 0.250000 Sr\n0.067607 0.932393 0.750000 Sr\n0.367776 0.632224 0.750000 Sr\n0.278097 0.721903 0.250000 Mg\n0.721903 0.278097 0.750000 Mg\n",
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],
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"volume": 265.6946299479189,
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"updated_at": "2021-11-28T01:38:14.719000Z",
"spacegroup": 63
},
{
"id": "mp-1094352",
"created_at": "2022-09-04T14:47:26.603213Z",
"structure_string": "Sr4 Mg2\n1.0\n2.035628 6.701930 0.000000\n-2.035628 6.701930 0.000000\n0.000000 3.809972 9.441567\nSr Mg\n4 2\ndirect\n0.166458 0.166458 0.886304 Sr\n0.487601 0.487601 0.696207 Sr\n0.512399 0.512399 0.303793 Sr\n0.833542 0.833542 0.113696 Sr\n0.804093 0.804093 0.567198 Mg\n0.195907 0.195907 0.432802 Mg\n",
"nsites": 6,
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"elements": [
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],
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"formula_full": "Sr4 Mg2",
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"updated_at": "2021-11-28T01:38:09.428000Z",
"spacegroup": 12
}
]
}