HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=27",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=25",
"results": [
{
"id": "jvasp-120345",
"created_at": "2022-09-04T14:38:53.809771Z",
"updated_at": "2022-09-04T14:38:53.809787Z",
"structure_string": "Sr1 Ta1 N1\n1.0\n6.604132 0.000000 0.000000\n0.000000 6.604132 0.000000\n0.000000 0.000000 4.762595\nSr Ta N\n1 1 1\ndirect\n0.000271 0.343415 0.000000 Sr\n-0.091518 -0.008860 0.000000 Ta\n0.305109 0.000777 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Ta",
"N"
],
"chemical_system": "N-Sr-Ta",
"density": 2.258952226219111,
"density_atomic": 0.01444262425987646,
"volume": 207.7184828753318,
"volume_molar": 41.696998077629914,
"formula_full": "Sr1 Ta1 N1",
"formula_reduced": "SrTaN",
"formula_anonymous": "ABC",
"energy_above_hull": 4.612262919999999,
"spacegroup": 6
},
{
"id": "jvasp-118725",
"created_at": "2022-09-04T14:38:47.020343Z",
"updated_at": "2022-09-04T14:38:47.020370Z",
"structure_string": "Mg1 Ta1 O1\n1.0\n6.604132 0.000000 0.000000\n0.000000 6.604132 0.000000\n0.000000 0.000000 4.762595\nMg Ta O\n1 1 1\ndirect\n0.334025 0.000270 0.000000 Mg\n-0.007434 -0.082740 0.000000 Ta\n0.000717 0.299680 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Mg",
"Ta",
"O"
],
"chemical_system": "Mg-O-Ta",
"density": 1.7687306850533195,
"density_atomic": 0.01444262425987646,
"volume": 207.7184828753318,
"volume_molar": 41.696998077629914,
"formula_full": "Mg1 Ta1 O1",
"formula_reduced": "MgTaO",
"formula_anonymous": "ABC",
"energy_above_hull": 3.3217005833333326,
"spacegroup": 6
},
{
"id": "jvasp-118772",
"created_at": "2022-09-04T14:38:47.495159Z",
"updated_at": "2022-09-04T14:38:47.495173Z",
"structure_string": "Sr1 Ti1 N1\n1.0\n6.604132 0.000000 0.000000\n0.000000 6.604132 0.000000\n0.000000 0.000000 4.762595\nSr Ti N\n1 1 1\ndirect\n0.000150 0.337481 0.000000 Sr\n-0.075088 -0.004067 0.000000 Ti\n0.274227 0.000518 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Ti",
"N"
],
"chemical_system": "N-Sr-Ti",
"density": 1.1950796367484005,
"density_atomic": 0.01444262425987646,
"volume": 207.7184828753318,
"volume_molar": 41.696998077629914,
"formula_full": "Sr1 Ti1 N1",
"formula_reduced": "SrTiN",
"formula_anonymous": "ABC",
"energy_above_hull": 3.3425459644444446,
"spacegroup": 6
},
{
"id": "jvasp-121149",
"created_at": "2022-09-04T14:38:54.254125Z",
"updated_at": "2022-09-04T14:38:54.254152Z",
"structure_string": "Na1 In1 S1\n1.0\n5.129162 -0.000000 -0.000000\n0.000000 5.129162 -0.000000\n-0.000000 -0.000000 7.894654\nNa In S\n1 1 1\ndirect\n0.000000 0.000000 0.686959 Na\n0.000000 0.000000 0.297832 In\n0.000000 0.000000 0.006452 S\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"In",
"S"
],
"chemical_system": "In-Na-S",
"density": 1.3581474769099715,
"density_atomic": 0.014444260812872005,
"volume": 207.69494810883987,
"volume_molar": 41.69227375507766,
"formula_full": "Na1 In1 S1",
"formula_reduced": "NaInS",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1921963233333334,
"spacegroup": 99
},
{
"id": "jvasp-38171",
"created_at": "2022-09-04T14:37:52.510198Z",
"updated_at": "2022-09-04T14:37:52.510224Z",
"structure_string": "Rb6 Ac2\n1.0\n4.566127 -7.908763 -0.000000\n4.566127 7.908763 -0.000000\n0.000000 -0.000000 7.553980\nRb Ac\n6 2\ndirect\n0.659822 0.829911 0.250000 Rb\n0.170090 0.829911 0.250000 Rb\n0.170089 0.340179 0.250000 Rb\n0.340179 0.170089 0.750000 Rb\n0.829911 0.170090 0.750000 Rb\n0.829911 0.659822 0.750000 Rb\n0.333333 0.666667 0.750000 Ac\n0.666667 0.333333 0.250000 Ac\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Rb",
"Ac"
],
"chemical_system": "Ac-Rb",
"density": 2.942567402451156,
"density_atomic": 0.014663161326107574,
"volume": 545.5849405241215,
"volume_molar": 41.0698663546561,
"formula_full": "Rb6 Ac2",
"formula_reduced": "Rb3Ac",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0012825,
"spacegroup": 194
},
{
"id": "jvasp-38261",
"created_at": "2022-09-04T14:37:56.282802Z",
"updated_at": "2022-09-04T14:37:56.282827Z",
"structure_string": "Rb3 Ac1\n1.0\n-3.112698 3.112698 6.984121\n3.112698 -3.112698 6.984121\n3.112698 3.112698 -6.984121\nRb Ac\n3 1\ndirect\n0.750000 0.250000 0.500000 Rb\n0.250000 0.750000 0.500000 Rb\n0.500000 0.500000 0.000000 Rb\n0.000000 0.000000 0.000000 Ac\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"Ac"
],
"chemical_system": "Ac-Rb",
"density": 2.965603452547371,
"density_atomic": 0.014777952687758535,
"volume": 270.6734880342011,
"volume_molar": 40.75084612355337,
"formula_full": "Rb3 Ac1",
"formula_reduced": "Rb3Ac",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-114058",
"created_at": "2022-09-04T14:38:48.124247Z",
"updated_at": "2022-09-04T14:38:48.124285Z",
"structure_string": "Ba1 I1\n1.0\n5.922878 -0.000000 0.000000\n-2.961439 5.129362 -0.000000\n-0.000000 0.000000 4.429938\nBa I\n1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.333333 0.666666 0.000000 I\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ba",
"I"
],
"chemical_system": "Ba-I",
"density": 3.260167045467196,
"density_atomic": 0.014860595413333306,
"volume": 134.58410947690217,
"volume_molar": 40.52422256645774,
"formula_full": "Ba1 I1",
"formula_reduced": "BaI",
"formula_anonymous": "AB",
"energy_above_hull": 0.1877299999999999,
"spacegroup": 187
},
{
"id": "jvasp-109972",
"created_at": "2022-09-04T14:37:54.127506Z",
"updated_at": "2022-09-04T14:37:54.127530Z",
"structure_string": "K3 Ba1\n1.0\n5.694820 -0.173880 -5.764694\n-1.082883 5.593619 -5.764694\n0.147964 0.173880 8.101900\nK Ba\n3 1\ndirect\n0.750000 0.250000 0.500000 K\n0.250000 0.750000 0.500001 K\n0.500000 0.500000 0.000001 K\n0.000000 0.000000 0.000000 Ba\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Ba"
],
"chemical_system": "Ba-K",
"density": 1.5760546088046228,
"density_atomic": 0.014910300650412454,
"volume": 268.27091510655424,
"volume_molar": 40.389130314641996,
"formula_full": "K3 Ba1",
"formula_reduced": "K3Ba",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0010299999999999,
"spacegroup": 139
},
{
"id": "jvasp-102504",
"created_at": "2022-09-04T14:37:09.452251Z",
"updated_at": "2022-09-04T14:37:09.452271Z",
"structure_string": "K3 Ba1\n1.0\n6.268270 -0.000000 3.618987\n2.089423 5.909782 3.618987\n-0.000000 -0.000000 7.237975\nK Ba\n3 1\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Ba\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Ba"
],
"chemical_system": "Ba-K",
"density": 1.5769162091796032,
"density_atomic": 0.01491845184045352,
"volume": 268.12433641092883,
"volume_molar": 40.36706237620517,
"formula_full": "K3 Ba1",
"formula_reduced": "K3Ba",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0019325,
"spacegroup": 225
},
{
"id": "jvasp-101571",
"created_at": "2022-09-04T14:36:31.082872Z",
"updated_at": "2022-09-04T14:36:31.082894Z",
"structure_string": "K3 Ba1\n1.0\n6.439524 -0.000000 0.000000\n0.000000 6.439524 0.000000\n0.000000 0.000000 6.439524\nK Ba\n3 1\ndirect\n-0.000000 0.500000 0.500000 K\n0.500000 0.000000 0.500000 K\n0.500000 0.500000 -0.000000 K\n0.000000 0.000000 0.000000 Ba\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Ba"
],
"chemical_system": "Ba-K",
"density": 1.5833741614907204,
"density_atomic": 0.014979547445901997,
"volume": 267.03076407654044,
"volume_molar": 40.202421212981946,
"formula_full": "K3 Ba1",
"formula_reduced": "K3Ba",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-116064",
"created_at": "2022-09-04T14:38:40.703358Z",
"updated_at": "2022-09-04T14:38:40.703386Z",
"structure_string": "Y1 O1 F1\n1.0\n6.477130 -0.000000 0.000000\n-0.000000 6.477130 0.000000\n0.000000 0.000000 4.762595\nY O F\n1 1 1\ndirect\n-0.003874 0.308755 0.000000 Y\n0.232035 -0.005587 0.000000 O\n-0.056289 -0.060375 0.000000 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Y",
"O",
"F"
],
"chemical_system": "F-O-Y",
"density": 1.029732286086609,
"density_atomic": 0.015014551905253628,
"volume": 199.80616264347475,
"volume_molar": 40.10869453848196,
"formula_full": "Y1 O1 F1",
"formula_reduced": "YOF",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4787530775,
"spacegroup": 6
},
{
"id": "jvasp-117713",
"created_at": "2022-09-04T14:38:26.677298Z",
"updated_at": "2022-09-04T14:38:26.677331Z",
"structure_string": "Bi1 O1 F1\n1.0\n6.477130 -0.000000 0.000000\n-0.000000 6.477130 0.000000\n0.000000 0.000000 4.762595\nBi O F\n1 1 1\ndirect\n-0.020367 -0.032659 0.000000 Bi\n-0.001910 0.278786 0.000000 O\n0.280520 -0.001833 0.000000 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Bi",
"O",
"F"
],
"chemical_system": "Bi-F-O",
"density": 2.0276418527459463,
"density_atomic": 0.015014551905253628,
"volume": 199.80616264347475,
"volume_molar": 40.10869453848196,
"formula_full": "Bi1 O1 F1",
"formula_reduced": "BiOF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.7343626941666669,
"spacegroup": 6
}
]
}