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=chemical_system&page=4427",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=4425",
"results": [
{
"id": "jvasp-16740",
"created_at": "2022-09-04T14:37:42.407069Z",
"updated_at": "2022-09-04T14:37:42.407100Z",
"structure_string": "Pr2 S4\n1.0\n4.882640 0.000000 2.818994\n1.627547 4.603398 2.818994\n-0.000000 0.000000 5.637988\nPr S\n2 4\ndirect\n0.125000 0.125000 0.125000 Pr\n0.875000 0.875000 0.874999 Pr\n0.500000 -0.000000 0.500000 S\n0.000000 0.500000 0.500000 S\n0.500000 0.500000 0.499999 S\n0.500000 0.500000 -0.000001 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Pr",
"S"
],
"chemical_system": "Pr-S",
"density": 5.373476231593011,
"density_atomic": 0.047347153435015964,
"volume": 126.72356339721686,
"volume_molar": 12.719118939780394,
"formula_full": "Pr2 S4",
"formula_reduced": "PrS2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.4880266166666667,
"spacegroup": 227
},
{
"id": "jvasp-38402",
"created_at": "2022-09-04T14:38:05.906832Z",
"updated_at": "2022-09-04T14:38:05.906848Z",
"structure_string": "Pr2 S6\n1.0\n2.910325 -5.040831 0.000000\n2.910325 5.040831 -0.000000\n-0.000000 -0.000000 5.650628\nPr S\n2 6\ndirect\n0.333334 0.666668 0.750000 Pr\n0.666668 0.333334 0.250000 Pr\n0.175717 0.351435 0.250000 S\n0.648567 0.824285 0.250000 S\n0.175718 0.824284 0.250000 S\n0.824285 0.648567 0.750000 S\n0.351435 0.175717 0.750000 S\n0.824284 0.175718 0.750000 S\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pr",
"S"
],
"chemical_system": "Pr-S",
"density": 4.7494701318322665,
"density_atomic": 0.04825248082076502,
"volume": 165.79458431818645,
"volume_molar": 12.480479050122593,
"formula_full": "Pr2 S6",
"formula_reduced": "PrS3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.5910649625,
"spacegroup": 194
},
{
"id": "jvasp-4370",
"created_at": "2022-09-04T14:37:08.450289Z",
"updated_at": "2022-09-04T14:37:08.450315Z",
"structure_string": "Pr1 Sb1\n1.0\n4.155313 0.000000 0.000000\n0.000000 4.155313 0.000000\n0.000000 0.000000 3.428519\nPr Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Pr\n0.500000 0.500000 0.500000 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pr",
"Sb"
],
"chemical_system": "Pr-Sb",
"density": 7.367864666922827,
"density_atomic": 0.03378437972104538,
"volume": 59.198955745638145,
"volume_molar": 17.825222217262183,
"formula_full": "Pr1 Sb1",
"formula_reduced": "PrSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.613662975,
"spacegroup": 123
},
{
"id": "jvasp-19790",
"created_at": "2022-09-04T14:38:28.585570Z",
"updated_at": "2022-09-04T14:38:28.585592Z",
"structure_string": "Pr1 Sb1\n1.0\n4.155313 0.000000 0.000000\n0.000000 4.155313 0.000000\n0.000000 0.000000 3.428519\nPr Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Pr\n0.500000 0.500000 0.500000 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pr",
"Sb"
],
"chemical_system": "Pr-Sb",
"density": 7.367864666922827,
"density_atomic": 0.03378437972104538,
"volume": 59.198955745638145,
"volume_molar": 17.825222217262183,
"formula_full": "Pr1 Sb1",
"formula_reduced": "PrSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.613662975,
"spacegroup": 123
},
{
"id": "jvasp-38426",
"created_at": "2022-09-04T14:37:46.146560Z",
"updated_at": "2022-09-04T14:37:46.146586Z",
"structure_string": "Pr1 Sb3\n1.0\n4.853136 0.000000 0.000000\n0.000000 4.853136 -0.000000\n0.000000 0.000000 4.853136\nPr Sb\n1 3\ndirect\n0.000000 0.000000 0.000000 Pr\n0.000000 0.500000 0.500000 Sb\n0.500000 0.000000 0.500000 Sb\n0.500000 0.500000 0.000000 Sb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pr",
"Sb"
],
"chemical_system": "Pr-Sb",
"density": 7.353485783875946,
"density_atomic": 0.034993920916453335,
"volume": 114.30556780275778,
"volume_molar": 17.20910547399828,
"formula_full": "Pr1 Sb3",
"formula_reduced": "PrSb3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.5054145375,
"spacegroup": 221
},
{
"id": "jvasp-19975",
"created_at": "2022-09-04T14:37:43.714375Z",
"updated_at": "2022-09-04T14:37:43.714399Z",
"structure_string": "Pr1 Sb1\n1.0\n3.941082 0.000000 2.275384\n1.313694 3.715687 2.275384\n0.000000 0.000000 4.550769\nPr Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Pr\n0.499999 0.500000 0.499999 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pr",
"Sb"
],
"chemical_system": "Pr-Sb",
"density": 6.545100220591818,
"density_atomic": 0.030011700969138865,
"volume": 66.64067465075061,
"volume_molar": 20.065976154409203,
"formula_full": "Pr1 Sb1",
"formula_reduced": "PrSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.481107975,
"spacegroup": 225
},
{
"id": "jvasp-20158",
"created_at": "2022-09-04T14:38:17.104008Z",
"updated_at": "2022-09-04T14:38:17.104026Z",
"structure_string": "Pr8 Sb6\n1.0\n7.820766 0.000000 -2.765058\n-3.910384 6.772982 -2.765058\n-0.000000 -0.000000 8.295175\nPr Sb\n8 6\ndirect\n0.359048 0.500000 -0.000000 Pr\n0.640952 0.640952 0.640952 Pr\n0.500000 -0.000000 0.359048 Pr\n0.000000 0.359048 0.500000 Pr\n0.500000 0.000000 0.859049 Pr\n0.000000 0.859048 0.500000 Pr\n0.859049 0.500000 -0.000000 Pr\n0.140952 0.140952 0.140952 Pr\n0.750001 0.875000 0.125000 Sb\n0.625000 0.375000 0.250000 Sb\n0.875000 0.125000 0.750000 Sb\n0.125000 0.750000 0.875000 Sb\n0.375000 0.250000 0.625000 Sb\n0.250000 0.625000 0.375000 Sb\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Pr",
"Sb"
],
"chemical_system": "Pr-Sb",
"density": 7.0209882465690105,
"density_atomic": 0.03186201735326198,
"volume": 439.3946511540238,
"volume_molar": 18.900688846004485,
"formula_full": "Pr8 Sb6",
"formula_reduced": "Pr4Sb3",
"formula_anonymous": "A3B4",
"energy_above_hull": 1.735209671428572,
"spacegroup": 220
},
{
"id": "jvasp-78407",
"created_at": "2022-09-04T14:37:14.436690Z",
"updated_at": "2022-09-04T14:37:14.436718Z",
"structure_string": "Pr1 Sb1\n1.0\n-3.217882 -3.217882 -0.000000\n-3.217882 -0.000000 -3.217882\n0.000000 -3.217882 -3.217882\nPr Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Pr\n0.500000 0.500000 0.500000 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pr",
"Sb"
],
"chemical_system": "Pr-Sb",
"density": 6.545085844815897,
"density_atomic": 0.030011635050898714,
"volume": 66.64082102184929,
"volume_molar": 20.066020227777177,
"formula_full": "Pr1 Sb1",
"formula_reduced": "PrSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.481107975,
"spacegroup": 225
},
{
"id": "jvasp-35036",
"created_at": "2022-09-04T14:37:29.137355Z",
"updated_at": "2022-09-04T14:37:29.137380Z",
"structure_string": "Pr2 Sb2 Te2\n1.0\n4.387518 0.000000 -0.000000\n0.000000 4.387518 0.000000\n0.000000 0.000000 9.575120\nPr Sb Te\n2 2 2\ndirect\n0.500000 0.000000 0.725089 Pr\n0.000000 0.500000 0.274911 Pr\n0.500000 0.500000 0.000000 Sb\n0.000000 0.000000 0.000000 Sb\n0.500000 0.000000 0.374827 Te\n0.000000 0.500000 0.625173 Te\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Pr",
"Sb",
"Te"
],
"chemical_system": "Pr-Sb-Te",
"density": 7.031688097040471,
"density_atomic": 0.032551364825212696,
"volume": 184.32406850580634,
"volume_molar": 18.50042476663081,
"formula_full": "Pr2 Sb2 Te2",
"formula_reduced": "PrSbTe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.8386712388888891,
"spacegroup": 129
},
{
"id": "jvasp-116596",
"created_at": "2022-09-04T14:38:41.363408Z",
"updated_at": "2022-09-04T14:38:41.363434Z",
"structure_string": "Pr4 V4 Sb12\n1.0\n6.061363 0.000000 0.000000\n0.000000 6.333960 0.000000\n-0.000000 0.000000 13.281911\nPr V Sb\n4 4 12\ndirect\n0.250000 0.503322 0.309671 Pr\n0.750000 0.496678 0.690329 Pr\n0.250000 0.003322 0.690329 Pr\n0.750000 0.996678 0.309671 Pr\n-0.000000 0.750000 0.907263 V\n-0.000000 0.250000 0.092736 V\n0.500000 0.250000 0.092736 V\n0.500000 0.750000 0.907263 V\n0.750000 -0.002389 0.781188 Sb\n0.250000 0.002389 0.218812 Sb\n0.750000 0.897822 0.065100 Sb\n0.250000 0.102178 0.934900 Sb\n0.750000 0.397822 0.934900 Sb\n-0.000000 0.250000 0.498570 Sb\n0.500000 0.750000 0.501430 Sb\n0.500000 0.250000 0.498570 Sb\n0.250000 0.502389 0.781188 Sb\n-0.000000 0.750000 0.501430 Sb\n0.250000 0.602178 0.065100 Sb\n0.750000 0.497611 0.218812 Sb\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Pr",
"V",
"Sb"
],
"chemical_system": "Pr-Sb-V",
"density": 7.257027939756341,
"density_atomic": 0.039221465765674125,
"volume": 509.92484879296927,
"volume_molar": 15.354196082264885,
"formula_full": "Pr4 V4 Sb12",
"formula_reduced": "PrVSb3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.20819847,
"spacegroup": 57
},
{
"id": "jvasp-99839",
"created_at": "2022-09-04T14:36:50.281455Z",
"updated_at": "2022-09-04T14:36:50.281479Z",
"structure_string": "Pr6 Sc2\n1.0\n7.228905 -0.000000 -0.000000\n-3.614452 6.260416 -0.000000\n-0.000000 0.000000 5.771502\nPr Sc\n6 2\ndirect\n0.170787 0.341574 0.250000 Pr\n0.170788 0.829213 0.250000 Pr\n0.658427 0.829213 0.250000 Pr\n0.829214 0.658426 0.750000 Pr\n0.341575 0.170787 0.750000 Pr\n0.829214 0.170787 0.750000 Pr\n0.333334 0.666667 0.750000 Sc\n0.666668 0.333333 0.250000 Sc\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pr",
"Sc"
],
"chemical_system": "Pr-Sc",
"density": 5.946511645726846,
"density_atomic": 0.030628478713602195,
"volume": 261.19482050694137,
"volume_molar": 19.661899685946697,
"formula_full": "Pr6 Sc2",
"formula_reduced": "Pr3Sc",
"formula_anonymous": "AB3",
"energy_above_hull": 1.9306112,
"spacegroup": 194
},
{
"id": "jvasp-35279",
"created_at": "2022-09-04T14:37:30.808965Z",
"updated_at": "2022-09-04T14:37:30.808985Z",
"structure_string": "Pr2 Sc2 Si2\n1.0\n4.311350 0.000000 0.000000\n0.000000 4.311350 -0.000000\n-2.155675 -2.155675 7.957097\nPr Sc Si\n2 2 2\ndirect\n0.323545 0.323545 0.647089 Pr\n0.676456 0.676456 0.352911 Pr\n0.000000 0.500000 0.000000 Sc\n0.500000 0.000000 0.000000 Sc\n0.121196 0.121196 0.242391 Si\n0.878806 0.878806 0.757610 Si\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Pr",
"Sc",
"Si"
],
"chemical_system": "Pr-Sc-Si",
"density": 4.8040582654671224,
"density_atomic": 0.040566733268336035,
"volume": 147.9044408212983,
"volume_molar": 14.845022694249138,
"formula_full": "Pr2 Sc2 Si2",
"formula_reduced": "PrScSi",
"formula_anonymous": "ABC",
"energy_above_hull": 1.9911512333333332,
"spacegroup": 139
}
]
}