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{
"id": "jvasp-37087",
"created_at": "2022-09-04T14:38:09.141175Z",
"updated_at": "2022-09-04T14:38:09.141202Z",
"structure_string": "Sm2 Ga2\n1.0\n0.000000 0.000000 4.118811\n4.406815 -0.000000 0.000000\n-2.203407 5.529296 -0.000000\nSm Ga\n2 2\ndirect\n0.250000 0.140178 0.280357 Sm\n0.750000 0.859821 0.719644 Sm\n0.250000 0.425601 0.851204 Ga\n0.750000 0.574397 0.148796 Ga\n",
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{
"id": "jvasp-14736",
"created_at": "2022-09-04T14:36:55.107285Z",
"updated_at": "2022-09-04T14:36:55.107306Z",
"structure_string": "Sm1 Ga2\n1.0\n2.117486 -3.667593 -0.000000\n2.117486 3.667593 0.000000\n0.000000 -0.000000 4.199243\nSm Ga\n1 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.666668 0.333334 0.500000 Ga\n0.333334 0.666668 0.500000 Ga\n",
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{
"id": "jvasp-40256",
"created_at": "2022-09-04T14:38:32.305384Z",
"updated_at": "2022-09-04T14:38:32.305410Z",
"structure_string": "Sm2 Ga6\n1.0\n3.205904 -5.552788 -0.000000\n3.205904 5.552788 0.000000\n-0.000000 0.000000 4.524085\nSm Ga\n2 6\ndirect\n0.333332 0.666666 0.749999 Sm\n0.666666 0.333332 0.250000 Sm\n0.709259 0.854629 0.250000 Ga\n0.145370 0.854629 0.250000 Ga\n0.145370 0.290740 0.250000 Ga\n0.290740 0.145370 0.749999 Ga\n0.854629 0.145370 0.749999 Ga\n0.854629 0.709259 0.749999 Ga\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sm",
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"chemical_system": "Ga-Sm",
"density": 7.412943022285414,
"density_atomic": 0.049666965770761,
"volume": 161.07285548555916,
"volume_molar": 12.125042604364692,
"formula_full": "Sm2 Ga6",
"formula_reduced": "SmGa3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-99933",
"created_at": "2022-09-04T14:36:38.240890Z",
"updated_at": "2022-09-04T14:36:38.240919Z",
"structure_string": "Sm1 Ga3 Pd1\n1.0\n3.932267 -0.011688 -4.722386\n-0.523736 3.897250 -4.722386\n0.010253 0.011688 6.145205\nSm Ga Pd\n1 3 1\ndirect\n0.000000 0.000000 0.000000 Sm\n0.613733 0.613733 -0.000001 Ga\n0.386267 0.386267 -0.000001 Ga\n0.750000 0.250000 0.499999 Ga\n0.249999 0.750000 0.499998 Pd\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sm",
"Ga",
"Pd"
],
"chemical_system": "Ga-Pd-Sm",
"density": 8.181259321737357,
"density_atomic": 0.052869193030343126,
"volume": 94.57303418893416,
"volume_molar": 11.390642479721079,
"formula_full": "Sm1 Ga3 Pd1",
"formula_reduced": "SmGa3Pd",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.2668243099999998,
"spacegroup": 119
},
{
"id": "jvasp-102325",
"created_at": "2022-09-04T14:36:48.611408Z",
"updated_at": "2022-09-04T14:36:48.611417Z",
"structure_string": "Sm1 Ga3 Pt1\n1.0\n3.917647 -0.028815 -4.754581\n-0.526744 3.882180 -4.754581\n0.025357 0.028815 6.160629\nSm Ga Pt\n1 3 1\ndirect\n0.000000 0.000000 0.000000 Sm\n0.613178 0.613176 0.000000 Ga\n0.386824 0.386823 0.000000 Ga\n0.750001 0.250000 0.500001 Ga\n0.250001 0.750000 0.500002 Pt\n",
"nsites": 5,
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"elements": [
"Sm",
"Ga",
"Pt"
],
"chemical_system": "Ga-Pt-Sm",
"density": 9.726635477915332,
"density_atomic": 0.052807243960616077,
"volume": 94.68397941254095,
"volume_molar": 11.404005034785273,
"formula_full": "Sm1 Ga3 Pt1",
"formula_reduced": "SmGa3Pt",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.45896345,
"spacegroup": 119
},
{
"id": "jvasp-17575",
"created_at": "2022-09-04T14:37:32.448003Z",
"updated_at": "2022-09-04T14:37:32.448030Z",
"structure_string": "Sm1 Ga5 Co1\n1.0\n4.253338 -0.000000 0.000000\n0.000000 4.253338 0.000000\n-0.000000 0.000000 6.912515\nSm Ga Co\n1 5 1\ndirect\n0.000000 0.000000 0.000000 Sm\n0.500000 0.500000 0.000000 Ga\n0.000000 0.500000 0.313862 Ga\n0.500000 0.000000 0.313862 Ga\n0.000000 0.500000 0.686138 Ga\n0.500000 0.000000 0.686138 Ga\n0.000000 0.000000 0.500000 Co\n",
"nsites": 7,
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"elements": [
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"Ga",
"Co"
],
"chemical_system": "Co-Ga-Sm",
"density": 7.4082556196627705,
"density_atomic": 0.055976038674537494,
"volume": 125.0535079965238,
"volume_molar": 10.758426109812172,
"formula_full": "Sm1 Ga5 Co1",
"formula_reduced": "SmGa5Co",
"formula_anonymous": "ABC5",
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"spacegroup": 123
},
{
"id": "jvasp-39063",
"created_at": "2022-09-04T14:37:53.259802Z",
"updated_at": "2022-09-04T14:37:53.259813Z",
"structure_string": "Sm1 Ga1 Au2\n1.0\n0.000000 3.478358 3.478358\n3.478358 0.000000 3.478358\n3.478358 3.478358 -0.000000\nSm Ga Au\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Sm\n0.250000 0.250000 0.250000 Ga\n0.500000 0.500000 0.500000 Au\n0.000000 0.000000 0.000000 Au\n",
"nsites": 4,
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"elements": [
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"Ga",
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],
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"formula_full": "Sm1 Ga1 Au2",
"formula_reduced": "SmGaAu2",
"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-116473",
"created_at": "2022-09-04T14:38:43.256823Z",
"updated_at": "2022-09-04T14:38:43.256852Z",
"structure_string": "Sm4 Ga4 Ni4\n1.0\n4.335996 -0.000000 0.000000\n0.000000 6.968804 0.000000\n0.000000 -0.000000 7.378017\nSm Ga Ni\n4 4 4\ndirect\n0.250000 0.023726 0.805967 Sm\n0.250000 0.523725 0.694033 Sm\n0.750001 0.976274 0.194033 Sm\n0.750001 0.476274 0.305967 Sm\n0.250000 0.172488 0.421008 Ga\n0.250000 0.672488 0.078992 Ga\n0.750001 0.827512 0.578992 Ga\n0.750001 0.327512 0.921008 Ga\n0.250000 0.792896 0.405320 Ni\n0.250000 0.292896 0.094680 Ni\n0.750001 0.207103 0.594680 Ni\n0.750001 0.707103 0.905321 Ni\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Sm",
"Ga",
"Ni"
],
"chemical_system": "Ga-Ni-Sm",
"density": 8.305739767402205,
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"volume": 222.93937253509492,
"volume_molar": 11.18810235293683,
"formula_full": "Sm4 Ga4 Ni4",
"formula_reduced": "SmGaNi",
"formula_anonymous": "ABC",
"energy_above_hull": 0.4142545333333333,
"spacegroup": 62
},
{
"id": "jvasp-37219",
"created_at": "2022-09-04T14:37:55.311624Z",
"updated_at": "2022-09-04T14:37:55.311634Z",
"structure_string": "Sm1 Ga1 O3\n1.0\n3.850268 0.000000 0.000000\n0.000000 3.850268 0.000000\n-0.000000 -0.000000 3.850268\nSm Ga O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Sm\n0.500000 0.500000 0.500000 Ga\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
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"elements": [
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"O"
],
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"density": 7.799065660949779,
"density_atomic": 0.08759859181276572,
"volume": 57.07854311958644,
"volume_molar": 6.8747004208375815,
"formula_full": "Sm1 Ga1 O3",
"formula_reduced": "SmGaO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.2258043399999998,
"spacegroup": 221
},
{
"id": "jvasp-119560",
"created_at": "2022-09-04T14:38:50.268468Z",
"updated_at": "2022-09-04T14:38:50.268495Z",
"structure_string": "Sm4 Ga4 Pd4\n1.0\n4.508330 -0.000000 0.000000\n0.000000 7.071324 0.000000\n-0.000000 -0.000000 7.711077\nSm Ga Pd\n4 4 4\ndirect\n0.250000 0.017597 0.300331 Sm\n0.250000 0.517597 0.199669 Sm\n0.750000 0.982402 0.699669 Sm\n0.750000 0.482403 0.800332 Sm\n0.250000 0.677963 0.578519 Ga\n0.250000 0.177963 0.921482 Ga\n0.750000 0.322037 0.421482 Ga\n0.750000 0.822036 0.078519 Ga\n0.250000 0.285562 0.593459 Pd\n0.250000 0.785562 0.906542 Pd\n0.750000 0.714438 0.406542 Pd\n0.750000 0.214438 0.093458 Pd\n",
"nsites": 12,
"nelements": 3,
"elements": [
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"Ga",
"Pd"
],
"chemical_system": "Ga-Pd-Sm",
"density": 8.82195403115859,
"density_atomic": 0.048814604128212626,
"volume": 245.82807162548605,
"volume_molar": 12.336760417400324,
"formula_full": "Sm4 Ga4 Pd4",
"formula_reduced": "SmGaPd",
"formula_anonymous": "ABC",
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"spacegroup": 62
},
{
"id": "jvasp-18798",
"created_at": "2022-09-04T14:36:57.544642Z",
"updated_at": "2022-09-04T14:36:57.544664Z",
"structure_string": "Sm1 Ga2 Pd2\n1.0\n3.988940 -0.000000 -1.497173\n-0.561935 3.949161 -1.497173\n-0.017108 -0.019714 6.016901\nSm Ga Pd\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.620612 0.620613 0.241227 Ga\n0.379386 0.379388 0.758773 Ga\n0.249999 0.750000 0.500000 Pd\n0.749999 0.250001 0.500000 Pd\n",
"nsites": 5,
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"elements": [
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"volume": 94.5485658903806,
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"formula_full": "Sm1 Ga2 Pd2",
"formula_reduced": "Sm(GaPd)2",
"formula_anonymous": "AB2C2",
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"spacegroup": 139
},
{
"id": "jvasp-15972",
"created_at": "2022-09-04T14:37:51.990532Z",
"updated_at": "2022-09-04T14:37:51.990562Z",
"structure_string": "Sm2 Ga2 Sb4\n1.0\n4.258478 -0.000000 -0.830512\n-0.000000 4.371809 0.000000\n0.010242 0.000000 11.385517\nSm Ga Sb\n2 2 4\ndirect\n0.137613 0.750000 0.275225 Sm\n0.862387 0.250000 0.724775 Sm\n0.156433 0.000000 0.000000 Ga\n0.843568 0.500000 0.000000 Ga\n0.750260 0.750000 0.500519 Sb\n0.249740 0.250000 0.499481 Sb\n0.592928 0.250000 0.185856 Sb\n0.407072 0.750000 0.814144 Sb\n",
"nsites": 8,
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"density": 7.262410643601341,
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"formula_full": "Sm2 Ga2 Sb4",
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"spacegroup": 20
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}