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{
"id": "jvasp-30910",
"created_at": "2022-09-04T14:38:35.990382Z",
"updated_at": "2022-09-04T14:38:35.990403Z",
"structure_string": "Sr4 Mg4 Sn4\n1.0\n4.874607 0.000000 0.000000\n0.000000 8.165110 0.000000\n0.000000 0.000000 8.860021\nSr Mg Sn\n4 4 4\ndirect\n0.750000 0.988594 0.810388 Sr\n0.250000 0.511407 0.310388 Sr\n0.250000 0.011406 0.189612 Sr\n0.750000 0.488594 0.689612 Sr\n0.750000 0.350352 0.068420 Mg\n0.250000 0.649648 0.931580 Mg\n0.750000 0.850352 0.431580 Mg\n0.250000 0.149648 0.568420 Mg\n0.250000 0.777334 0.606991 Sn\n0.250000 0.277334 0.893009 Sn\n0.750000 0.722666 0.106991 Sn\n0.750000 0.222666 0.393009 Sn\n",
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"formula_full": "Sr4 Mg4 Sn4",
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{
"id": "jvasp-118731",
"created_at": "2022-09-04T14:38:51.390539Z",
"updated_at": "2022-09-04T14:38:51.390564Z",
"structure_string": "Mg1 Ta1 Sn1\n1.0\n2.931162 -0.000000 0.000000\n-0.000000 2.931162 -0.000000\n0.000000 -0.000000 8.467002\nMg Ta Sn\n1 1 1\ndirect\n0.000000 0.000000 0.347190 Mg\n0.000000 0.000000 0.679208 Ta\n0.000000 0.000000 0.008678 Sn\n",
"nsites": 3,
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"elements": [
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"volume": 72.7460314283773,
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"formula_full": "Mg1 Ta1 Sn1",
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{
"id": "jvasp-76201",
"created_at": "2022-09-04T14:35:48.991800Z",
"updated_at": "2022-09-04T14:35:48.991817Z",
"structure_string": "Tb2 Mg2 Sn2\n1.0\n4.393716 -0.000000 0.000000\n-0.000000 4.393716 0.000000\n-2.196859 -2.196859 7.934907\nTb Mg Sn\n2 2 2\ndirect\n0.666275 0.666275 0.332549 Tb\n0.333725 0.333725 0.667452 Tb\n0.500000 -0.000000 -0.000000 Mg\n-0.000000 0.500000 -0.000000 Mg\n0.863448 0.863448 0.726897 Sn\n0.136552 0.136552 0.273104 Sn\n",
"nsites": 6,
"nelements": 3,
"elements": [
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"Mg",
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],
"chemical_system": "Mg-Sn-Tb",
"density": 6.5462779759721395,
"density_atomic": 0.03916926714731807,
"volume": 153.18131884963853,
"volume_molar": 15.374657731916075,
"formula_full": "Tb2 Mg2 Sn2",
"formula_reduced": "TbMgSn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0939797166666667,
"spacegroup": 139
},
{
"id": "jvasp-76202",
"created_at": "2022-09-04T14:35:56.983513Z",
"updated_at": "2022-09-04T14:35:56.983532Z",
"structure_string": "Tm2 Mg2 Sn2\n1.0\n4.340462 -0.000000 -0.000000\n-0.000000 4.340462 -0.000000\n-2.170230 -2.170230 7.856821\nTm Mg Sn\n2 2 2\ndirect\n0.667094 0.667094 0.334188 Tm\n0.332906 0.332906 0.665812 Tm\n0.500000 0.000000 0.000000 Mg\n0.000000 0.500000 0.000000 Mg\n0.862195 0.862195 0.724392 Sn\n0.137804 0.137804 0.275608 Sn\n",
"nsites": 6,
"nelements": 3,
"elements": [
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"Mg",
"Sn"
],
"chemical_system": "Mg-Sn-Tm",
"density": 6.999132378208775,
"density_atomic": 0.04053521442866887,
"volume": 148.01944641389264,
"volume_molar": 14.856565692028978,
"formula_full": "Tm2 Mg2 Sn2",
"formula_reduced": "TmMgSn",
"formula_anonymous": "ABC",
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"spacegroup": 139
},
{
"id": "jvasp-94081",
"created_at": "2022-09-04T14:35:43.504591Z",
"updated_at": "2022-09-04T14:35:43.504619Z",
"structure_string": "Mg6 V1 Sn1\n1.0\n6.254189 0.034223 0.000000\n-3.097457 5.433398 0.000000\n0.000000 0.000000 5.016328\nMg V Sn\n6 1 1\ndirect\n0.164079 0.825920 0.250000 Mg\n0.674080 0.335920 0.250000 Mg\n0.665253 0.834747 0.250000 Mg\n0.328686 0.658412 0.750000 Mg\n0.841588 0.171314 0.750000 Mg\n0.830924 0.669075 0.750000 Mg\n0.168121 0.331879 0.250000 V\n0.327267 0.172733 0.750000 Sn\n",
"nsites": 8,
"nelements": 3,
"elements": [
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"V",
"Sn"
],
"chemical_system": "Mg-Sn-V",
"density": 3.063669329545871,
"density_atomic": 0.04678524211656388,
"volume": 170.99409211281338,
"volume_molar": 12.871881147897101,
"formula_full": "Mg6 V1 Sn1",
"formula_reduced": "Mg6VSn",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-94079",
"created_at": "2022-09-04T14:36:16.785801Z",
"updated_at": "2022-09-04T14:36:16.785822Z",
"structure_string": "Mg6 V1 Sn1\n1.0\n6.293028 0.115789 0.000000\n-3.046238 5.276238 0.000000\n0.000000 0.000000 5.093258\nMg V Sn\n6 1 1\ndirect\n0.664104 0.330365 0.250000 Mg\n0.664104 0.833738 0.250000 Mg\n0.335382 0.177531 0.750000 Mg\n0.335382 0.657852 0.750000 Mg\n0.846406 0.173204 0.750000 Mg\n0.829435 0.664718 0.750000 Mg\n0.162585 0.331292 0.250000 V\n0.162602 0.831300 0.250000 Sn\n",
"nsites": 8,
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"elements": [
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],
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"density": 3.065166710024417,
"density_atomic": 0.04680810858833151,
"volume": 170.91055890248614,
"volume_molar": 12.865593038513035,
"formula_full": "Mg6 V1 Sn1",
"formula_reduced": "Mg6VSn",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.00066625,
"spacegroup": 38
},
{
"id": "jvasp-56301",
"created_at": "2022-09-04T14:37:57.466474Z",
"updated_at": "2022-09-04T14:37:57.466493Z",
"structure_string": "Yb3 Mg3 Sn3\n1.0\n3.803256 -6.587433 0.000000\n3.803256 6.587433 -0.000000\n0.000000 0.000000 4.664380\nYb Mg Sn\n3 3 3\ndirect\n0.427572 0.427572 0.500000 Yb\n0.000000 0.572428 0.500000 Yb\n0.572428 0.000000 0.500000 Yb\n0.249228 0.000000 0.000000 Mg\n0.750772 0.750772 0.000000 Mg\n0.000000 0.249228 0.000000 Mg\n0.333334 0.666667 0.000000 Sn\n0.666667 0.333334 0.000000 Sn\n0.000000 0.000000 0.500000 Sn\n",
"nsites": 9,
"nelements": 3,
"elements": [
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"Mg",
"Sn"
],
"chemical_system": "Mg-Sn-Yb",
"density": 6.736546735866089,
"density_atomic": 0.03850763255799501,
"volume": 233.71989920298037,
"volume_molar": 15.63882368237066,
"formula_full": "Yb3 Mg3 Sn3",
"formula_reduced": "YbMgSn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 189
},
{
"id": "jvasp-94375",
"created_at": "2022-09-04T14:36:05.652214Z",
"updated_at": "2022-09-04T14:36:05.652238Z",
"structure_string": "Sr4 Mg2\n1.0\n4.116028 -0.000000 0.000000\n-2.058013 3.564584 -0.000000\n-0.000000 -0.000000 17.980906\nSr Mg\n4 2\ndirect\n0.333333 0.666666 0.790798 Sr\n0.666667 0.333333 0.596503 Sr\n0.333333 0.666666 0.403497 Sr\n0.666667 0.333333 0.209202 Sr\n0.666667 0.333333 0.942656 Mg\n0.333333 0.666666 0.057345 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Sr",
"Mg"
],
"chemical_system": "Mg-Sr",
"density": 2.5120090445859495,
"density_atomic": 0.022743248984616257,
"volume": 263.8145501576514,
"volume_molar": 26.478805926424283,
"formula_full": "Sr4 Mg2",
"formula_reduced": "Sr2Mg",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1772356862745098,
"spacegroup": 164
},
{
"id": "jvasp-94361",
"created_at": "2022-09-04T14:36:05.956716Z",
"updated_at": "2022-09-04T14:36:05.956748Z",
"structure_string": "Sr4 Mg2\n1.0\n6.886301 0.000000 0.000000\n-3.443150 5.963712 0.000000\n0.000000 0.000000 6.126896\nSr Mg\n4 2\ndirect\n0.643504 -0.000000 0.500000 Sr\n0.356496 0.356496 0.500000 Sr\n-0.000000 0.643504 0.500000 Sr\n0.000000 0.000000 0.000000 Sr\n0.666667 0.333333 0.000000 Mg\n0.333333 0.666667 0.000000 Mg\n",
"nsites": 6,
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"elements": [
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"Mg"
],
"chemical_system": "Mg-Sr",
"density": 2.633763475371661,
"density_atomic": 0.02384559029198845,
"volume": 251.61884971310008,
"volume_molar": 25.254735514026237,
"formula_full": "Sr4 Mg2",
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"formula_anonymous": "AB2",
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"spacegroup": 189
},
{
"id": "jvasp-91871",
"created_at": "2022-09-04T14:36:06.724705Z",
"updated_at": "2022-09-04T14:36:06.724713Z",
"structure_string": "Sr1 Mg7\n1.0\n6.832477 -0.000000 0.000000\n-3.416239 5.917098 -0.000000\n-0.000000 0.000000 5.248951\nSr Mg\n1 7\ndirect\n0.166667 0.333333 0.250000 Sr\n0.177901 0.838950 0.250000 Mg\n0.661051 0.322099 0.250000 Mg\n0.661051 0.838950 0.250000 Mg\n0.343686 0.156314 0.750000 Mg\n0.343686 0.687372 0.750000 Mg\n0.812629 0.156314 0.750000 Mg\n0.833333 0.666667 0.750000 Mg\n",
"nsites": 8,
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"elements": [
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],
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"volume": 212.20687952731114,
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"formula_full": "Sr1 Mg7",
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},
{
"id": "jvasp-92313",
"created_at": "2022-09-04T14:36:06.411103Z",
"updated_at": "2022-09-04T14:36:06.411121Z",
"structure_string": "Sr4 Mg4\n1.0\n12.962680 0.000000 0.781972\n0.000000 3.941254 0.000000\n-2.527937 0.000000 5.517353\nSr Mg\n4 4\ndirect\n0.897565 0.499999 0.672120 Sr\n0.602434 0.000000 0.327879 Sr\n0.397565 0.000000 0.672120 Sr\n0.102435 0.499999 0.327879 Sr\n0.653314 0.499999 0.867508 Mg\n0.846686 0.000000 0.132491 Mg\n0.153314 0.000000 0.867508 Mg\n0.346686 0.499999 0.132491 Mg\n",
"nsites": 8,
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"density_atomic": 0.027617804858647337,
"volume": 289.66820646844934,
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"formula_full": "Sr4 Mg4",
"formula_reduced": "SrMg",
"formula_anonymous": "AB",
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"spacegroup": 12
},
{
"id": "jvasp-94372",
"created_at": "2022-09-04T14:36:31.013445Z",
"updated_at": "2022-09-04T14:36:31.013467Z",
"structure_string": "Sr2 Mg4\n1.0\n3.829774 -0.000000 -0.000000\n-1.914887 3.316682 -0.000000\n-0.000000 0.000000 16.025113\nSr Mg\n2 4\ndirect\n0.666666 0.333333 0.180277 Sr\n0.666666 0.333333 0.819723 Sr\n0.666666 0.333333 0.500000 Mg\n0.000000 0.000000 0.358303 Mg\n0.000000 0.000000 0.000000 Mg\n0.000000 0.000000 0.641696 Mg\n",
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"formula_full": "Sr2 Mg4",
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"spacegroup": 187
}
]
}