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"results": [
{
"id": "jvasp-91569",
"created_at": "2022-09-04T14:36:06.500890Z",
"updated_at": "2022-09-04T14:36:06.500910Z",
"structure_string": "Sr2 Mn2 Sb4\n1.0\n0.000000 4.439854 -0.000000\n0.000000 0.000000 4.439725\n11.167885 0.000000 0.000000\nSr Mn Sb\n2 2 4\ndirect\n0.250000 0.749999 0.236483 Sr\n0.749999 0.250000 0.763517 Sr\n0.250000 0.250000 0.499996 Mn\n0.749999 0.749999 0.500005 Mn\n0.250000 0.250000 0.000015 Sb\n0.749999 0.749999 0.999985 Sb\n0.250000 0.749999 0.638427 Sb\n0.749999 0.250000 0.361573 Sb\n",
"nsites": 8,
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"elements": [
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],
"chemical_system": "Mn-Sb-Sr",
"density": 5.824498072777807,
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"volume": 220.13834272703323,
"volume_molar": 16.571301082191454,
"formula_full": "Sr2 Mn2 Sb4",
"formula_reduced": "SrMnSb2",
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{
"id": "jvasp-90845",
"created_at": "2022-09-04T14:36:19.412493Z",
"updated_at": "2022-09-04T14:36:19.412523Z",
"structure_string": "Sr2 Mn2 Sb2 F2\n1.0\n4.265625 -0.000000 0.000000\n0.000000 4.265625 -0.000000\n-0.000000 -0.000000 9.489257\nSr Mn Sb F\n2 2 2 2\ndirect\n0.749999 0.749999 0.859018 Sr\n0.250000 0.250000 0.140982 Sr\n0.250000 0.749999 0.500000 Mn\n0.749999 0.250000 0.500000 Mn\n0.749999 0.749999 0.325850 Sb\n0.250000 0.250000 0.674150 Sb\n0.250000 0.749999 0.000000 F\n0.749999 0.250000 0.000000 F\n",
"nsites": 8,
"nelements": 4,
"elements": [
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"chemical_system": "F-Mn-Sb-Sr",
"density": 5.4494582132052605,
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"volume": 172.66231322094728,
"volume_molar": 12.997459427046918,
"formula_full": "Sr2 Mn2 Sb2 F2",
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"formula_anonymous": "ABCD",
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"spacegroup": 129
},
{
"id": "jvasp-91677",
"created_at": "2022-09-04T14:35:47.455586Z",
"updated_at": "2022-09-04T14:35:47.455606Z",
"structure_string": "Sr2 Mn2 P2 F2\n1.0\n3.950238 -0.000000 0.000000\n-0.000000 3.950238 0.000000\n-0.000000 0.000000 8.605792\nSr Mn P F\n2 2 2 2\ndirect\n0.750000 0.750000 0.828969 Sr\n0.250000 0.250000 0.171031 Sr\n0.250000 0.750000 0.500000 Mn\n0.750000 0.250000 0.500000 Mn\n0.750000 0.750000 0.374437 P\n0.250000 0.250000 0.625563 P\n0.250000 0.750000 0.000000 F\n0.750000 0.250000 0.000000 F\n",
"nsites": 8,
"nelements": 4,
"elements": [
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"Mn",
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],
"chemical_system": "F-Mn-P-Sr",
"density": 4.7614651294227315,
"density_atomic": 0.059573431542692,
"volume": 134.28805077758489,
"volume_molar": 10.108769302108046,
"formula_full": "Sr2 Mn2 P2 F2",
"formula_reduced": "SrMnPF",
"formula_anonymous": "ABCD",
"energy_above_hull": 1.1180348334698276,
"spacegroup": 129
},
{
"id": "jvasp-17627",
"created_at": "2022-09-04T14:38:16.156984Z",
"updated_at": "2022-09-04T14:38:16.157013Z",
"structure_string": "Sr2 Mn2 Ge2\n1.0\n4.394160 0.000000 0.000000\n0.000000 4.394160 0.000000\n0.000000 -0.000000 7.291286\nSr Mn Ge\n2 2 2\ndirect\n0.000000 0.500000 0.330369 Sr\n0.500000 0.000000 0.669632 Sr\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.000000 Mn\n0.000000 0.500000 0.813214 Ge\n0.500000 0.000000 0.186786 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
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"Mn",
"Ge"
],
"chemical_system": "Ge-Mn-Sr",
"density": 5.07646677626083,
"density_atomic": 0.042618227550353764,
"volume": 140.78483186357184,
"volume_molar": 14.130434572589378,
"formula_full": "Sr2 Mn2 Ge2",
"formula_reduced": "SrMnGe",
"formula_anonymous": "ABC",
"energy_above_hull": 1.2361365004597702,
"spacegroup": 129
},
{
"id": "jvasp-93831",
"created_at": "2022-09-04T14:35:43.542039Z",
"updated_at": "2022-09-04T14:35:43.542060Z",
"structure_string": "Sr2 Mn2 Ge2\n1.0\n4.393288 0.000000 0.000000\n0.000000 4.393288 0.000000\n0.000000 0.000000 7.291392\nSr Mn Ge\n2 2 2\ndirect\n0.000000 0.500000 0.330342 Sr\n0.500000 0.000000 0.669658 Sr\n0.500000 0.500000 0.000000 Mn\n0.000000 0.000000 0.000000 Mn\n0.000000 0.500000 0.813306 Ge\n0.500000 0.000000 0.186694 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
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"Mn",
"Ge"
],
"chemical_system": "Ge-Mn-Sr",
"density": 5.078408347780782,
"density_atomic": 0.04263452753624741,
"volume": 140.7310071607775,
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"formula_full": "Sr2 Mn2 Ge2",
"formula_reduced": "SrMnGe",
"formula_anonymous": "ABC",
"energy_above_hull": 1.2360898337931034,
"spacegroup": 129
},
{
"id": "jvasp-18519",
"created_at": "2022-09-04T14:35:47.166543Z",
"updated_at": "2022-09-04T14:35:47.166571Z",
"structure_string": "Sr2 Mn2 Bi4\n1.0\n4.550579 -0.000000 -0.883904\n-0.171689 4.547339 -0.883904\n-0.116863 -0.121359 11.554118\nSr Mn Bi\n2 2 4\ndirect\n0.879635 0.879634 0.759270 Sr\n0.120366 0.120366 0.240731 Sr\n0.250000 0.750000 0.500000 Mn\n0.750000 0.250000 0.500000 Mn\n0.500000 0.000000 0.000000 Bi\n-0.000000 0.500000 0.000000 Bi\n0.323556 0.323555 0.647110 Bi\n0.676445 0.676445 0.352891 Bi\n",
"nsites": 8,
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"elements": [
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"Mn",
"Bi"
],
"chemical_system": "Bi-Mn-Sr",
"density": 7.817817205756454,
"density_atomic": 0.033597440004205455,
"volume": 238.11338003724765,
"volume_molar": 17.92440364279599,
"formula_full": "Sr2 Mn2 Bi4",
"formula_reduced": "SrMnBi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.300483037844827,
"spacegroup": 139
},
{
"id": "jvasp-40993",
"created_at": "2022-09-04T14:37:33.272684Z",
"updated_at": "2022-09-04T14:37:33.272709Z",
"structure_string": "Sr2 Mn1 Zn2 As2 O2\n1.0\n0.000000 -4.131335 0.000000\n-4.131335 0.000000 0.000000\n2.065667 2.065667 -9.389516\nSr Mn Zn As O\n2 1 2 2 2\ndirect\n0.587650 0.587650 0.175299 Sr\n0.412351 0.412351 0.824701 Sr\n0.000000 0.000000 0.000000 Mn\n0.750001 0.250000 0.500000 Zn\n0.250000 0.750001 0.500000 Zn\n0.166671 0.166671 0.333344 As\n0.833329 0.833329 0.666656 As\n0.500001 0.000000 0.000000 O\n0.000000 0.500001 0.000000 O\n",
"nsites": 9,
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"elements": [
"Sr",
"Mn",
"Zn",
"As",
"O"
],
"chemical_system": "As-Mn-O-Sr-Zn",
"density": 5.624647942117509,
"density_atomic": 0.05615888525301023,
"volume": 160.25959132651377,
"volume_molar": 10.723397967870454,
"formula_full": "Sr2 Mn1 Zn2 As2 O2",
"formula_reduced": "Sr2MnZn2(AsO)2",
"formula_anonymous": "AB2C2D2E2",
"energy_above_hull": 1.0794845734865903,
"spacegroup": 139
},
{
"id": "jvasp-100544",
"created_at": "2022-09-04T14:38:39.656454Z",
"updated_at": "2022-09-04T14:38:39.656475Z",
"structure_string": "Sr2 Mn1 Sb1 O6\n1.0\n4.814811 -0.031884 -3.075183\n-1.461620 4.587710 -3.075183\n0.023468 0.031884 5.713021\nSr Mn Sb O\n2 1 1 6\ndirect\n0.250000 0.750000 0.500000 Sr\n0.750000 0.250000 0.500001 Sr\n0.500000 0.500000 0.000001 Mn\n0.000000 0.000000 0.000000 Sb\n0.238568 0.238568 0.000000 O\n0.761432 0.761433 0.000001 O\n0.209386 0.301583 0.510969 O\n0.790615 0.698417 0.489033 O\n0.301583 0.790615 0.092198 O\n0.698417 0.209385 0.907803 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
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"Mn",
"Sb",
"O"
],
"chemical_system": "Mn-O-Sb-Sr",
"density": 5.862460132590528,
"density_atomic": 0.07881635476938803,
"volume": 126.87722020714362,
"volume_molar": 7.640724793249353,
"formula_full": "Sr2 Mn1 Sb1 O6",
"formula_reduced": "Sr2MnSbO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.058349696137931,
"spacegroup": 87
},
{
"id": "jvasp-106737",
"created_at": "2022-09-04T14:36:52.438007Z",
"updated_at": "2022-09-04T14:36:52.438038Z",
"structure_string": "Sr2 Mn1 Ru1 O6\n1.0\n4.702659 -0.127353 -2.898839\n-1.529876 4.448674 -2.898839\n0.093505 0.127353 5.523543\nSr Mn Ru O\n2 1 1 6\ndirect\n0.749999 0.250000 0.499999 Sr\n0.249999 0.749999 0.499998 Sr\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 -0.000000 Ru\n0.794613 0.713989 0.508603 O\n0.205385 0.286010 0.491394 O\n0.286010 0.794613 0.080623 O\n0.713988 0.205386 0.919374 O\n0.751418 0.751419 -0.000001 O\n0.248581 0.248581 -0.000000 O\n",
"nsites": 10,
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"elements": [
"Sr",
"Mn",
"Ru",
"O"
],
"chemical_system": "Mn-O-Ru-Sr",
"density": 6.01127499262564,
"density_atomic": 0.08473075446345422,
"volume": 118.02090118663071,
"volume_molar": 7.107384795679412,
"formula_full": "Sr2 Mn1 Ru1 O6",
"formula_reduced": "Sr2MnRuO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.4153391361379306,
"spacegroup": 87
},
{
"id": "jvasp-7869",
"created_at": "2022-09-04T14:36:45.932363Z",
"updated_at": "2022-09-04T14:36:45.932383Z",
"structure_string": "Sr2 Mn1 O4\n1.0\n3.666654 -0.000000 -1.065555\n-0.309657 3.653555 -1.065555\n-0.008371 -0.009110 6.812587\nSr Mn O\n2 1 4\ndirect\n0.643797 0.643796 0.287595 Sr\n0.356201 0.356202 0.712406 Sr\n0.000000 0.000000 0.000000 Mn\n0.844174 0.844174 0.688353 O\n0.155824 0.155824 0.311649 O\n0.000001 0.500000 0.000001 O\n0.499999 0.000000 0.000000 O\n",
"nsites": 7,
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"elements": [
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"density": 5.356696767903871,
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"volume": 91.19242177225274,
"volume_molar": 7.845337145111353,
"formula_full": "Sr2 Mn1 O4",
"formula_reduced": "Sr2MnO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.692289123054187,
"spacegroup": 139
},
{
"id": "jvasp-102180",
"created_at": "2022-09-04T14:36:41.845421Z",
"updated_at": "2022-09-04T14:36:41.845447Z",
"structure_string": "Sr2 Mn1 Ga1 O5 F1\n1.0\n3.838734 -0.000000 0.000000\n0.000000 3.944790 0.000000\n0.000000 0.000000 7.743032\nSr Mn Ga O F\n2 1 1 5 1\ndirect\n0.499999 0.500000 0.763187 Sr\n0.499999 0.500000 0.236813 Sr\n0.000000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Ga\n0.499999 0.000000 0.000000 O\n0.000000 0.500000 0.000000 O\n0.000000 0.000000 0.754749 O\n0.000000 0.000000 0.245250 O\n0.499999 0.000000 0.500000 O\n0.000000 0.500000 0.500000 F\n",
"nsites": 10,
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"elements": [
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],
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"density": 5.649191601889364,
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"volume": 117.25272967242785,
"volume_molar": 7.061124425815891,
"formula_full": "Sr2 Mn1 Ga1 O5 F1",
"formula_reduced": "Sr2MnGaO5F",
"formula_anonymous": "ABCD2E5",
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"spacegroup": 47
},
{
"id": "jvasp-90782",
"created_at": "2022-09-04T14:36:00.965528Z",
"updated_at": "2022-09-04T14:36:00.965551Z",
"structure_string": "Sr2 Mg6\n1.0\n7.187371 0.000000 0.000000\n-3.593686 6.224446 0.000000\n0.000000 -0.000000 5.339219\nSr Mg\n2 6\ndirect\n0.333333 0.666667 0.250000 Sr\n0.666667 0.333333 0.750000 Sr\n0.301557 0.150778 0.250000 Mg\n0.849222 0.150778 0.250000 Mg\n0.849221 0.698443 0.250000 Mg\n0.698442 0.849222 0.750000 Mg\n0.150778 0.301558 0.750000 Mg\n0.150778 0.849222 0.750000 Mg\n",
"nsites": 8,
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],
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"volume": 238.86279035414202,
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"formula_full": "Sr2 Mg6",
"formula_reduced": "SrMg3",
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"spacegroup": 194
}
]
}