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=-formula_reduced&page=70",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=68",
"results": [
{
"id": "jvasp-90774",
"created_at": "2022-09-04T14:36:04.053338Z",
"updated_at": "2022-09-04T14:36:04.053370Z",
"structure_string": "Zr6 Sn2\n1.0\n5.159215 0.000000 0.000000\n0.000000 6.089579 0.000000\n0.000000 0.000000 5.718808\nZr Sn\n6 2\ndirect\n0.000000 0.250018 0.647227 Zr\n0.000000 0.500000 0.136290 Zr\n0.000000 0.749982 0.647227 Zr\n0.500000 0.000000 0.863710 Zr\n0.500000 0.249982 0.352773 Zr\n0.500000 0.750018 0.352773 Zr\n0.000000 0.000000 0.162398 Sn\n0.500000 0.500000 0.837603 Sn\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Zr",
"Sn"
],
"chemical_system": "Sn-Zr",
"density": 7.252901142359848,
"density_atomic": 0.04452598907467721,
"volume": 179.67034907596818,
"volume_molar": 13.525001656672703,
"formula_full": "Zr6 Sn2",
"formula_reduced": "Zr3Sn",
"formula_anonymous": "AB3",
"energy_above_hull": 3.2491413,
"spacegroup": 59
},
{
"id": "jvasp-90770",
"created_at": "2022-09-04T14:38:06.917300Z",
"updated_at": "2022-09-04T14:38:06.917326Z",
"structure_string": "Zr6 Sn2\n1.0\n4.349942 0.000000 0.000000\n0.000000 4.349942 0.000000\n-0.000000 -0.000000 9.532048\nZr Sn\n6 2\ndirect\n0.500000 0.500000 0.000000 Zr\n0.500000 0.000000 0.250000 Zr\n0.000000 0.500000 0.250000 Zr\n0.000000 0.000000 0.500000 Zr\n0.000000 0.500000 0.750000 Zr\n0.500000 0.000000 0.750000 Zr\n0.000000 0.000000 0.000000 Sn\n0.500000 0.500000 0.500000 Sn\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Zr",
"Sn"
],
"chemical_system": "Sn-Zr",
"density": 7.224952835056686,
"density_atomic": 0.04435441276318327,
"volume": 180.36536844064506,
"volume_molar": 13.577320462235328,
"formula_full": "Zr6 Sn2",
"formula_reduced": "Zr3Sn",
"formula_anonymous": "AB3",
"energy_above_hull": 3.2505938,
"spacegroup": 139
},
{
"id": "jvasp-107720",
"created_at": "2022-09-04T14:37:03.746780Z",
"updated_at": "2022-09-04T14:37:03.746799Z",
"structure_string": "Zr6 Si4\n1.0\n7.114212 0.000000 0.000000\n0.000000 7.114212 0.000000\n-0.000000 0.000000 3.711598\nZr Si\n6 4\ndirect\n0.674546 0.174546 0.500000 Zr\n0.325453 0.825453 0.500000 Zr\n0.174546 0.325453 0.500000 Zr\n0.825453 0.674546 0.500000 Zr\n0.000000 0.000000 0.000000 Zr\n0.500000 0.500000 -0.000000 Zr\n0.122578 0.622577 -0.000000 Si\n0.877422 0.377422 -0.000000 Si\n0.622577 0.877422 -0.000000 Si\n0.377422 0.122578 -0.000000 Si\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Zr",
"Si"
],
"chemical_system": "Si-Zr",
"density": 5.8313865029571375,
"density_atomic": 0.05323355408316665,
"volume": 187.851443929087,
"volume_molar": 11.312678373102093,
"formula_full": "Zr6 Si4",
"formula_reduced": "Zr3Si2",
"formula_anonymous": "A2B3",
"energy_above_hull": 3.9190841400000007,
"spacegroup": 127
},
{
"id": "jvasp-101044",
"created_at": "2022-09-04T14:36:34.581437Z",
"updated_at": "2022-09-04T14:36:34.581451Z",
"structure_string": "Zr6 Si2\n1.0\n6.078656 0.000000 0.000000\n-3.039328 5.264270 0.000000\n-0.000000 -0.000000 4.984060\nZr Si\n6 2\ndirect\n0.171662 0.343324 0.250000 Zr\n0.656676 0.828338 0.250000 Zr\n0.171662 0.828338 0.250000 Zr\n0.828338 0.656676 0.750000 Zr\n0.343325 0.171662 0.750000 Zr\n0.828338 0.171662 0.750000 Zr\n0.333333 0.666667 0.750000 Si\n0.666667 0.333333 0.250000 Si\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Zr",
"Si"
],
"chemical_system": "Si-Zr",
"density": 6.283594946841842,
"density_atomic": 0.05016040133124541,
"volume": 159.48835710404734,
"volume_molar": 12.005766700771488,
"formula_full": "Zr6 Si2",
"formula_reduced": "Zr3Si",
"formula_anonymous": "AB3",
"energy_above_hull": 3.921680525,
"spacegroup": 194
},
{
"id": "jvasp-99899",
"created_at": "2022-09-04T14:36:17.522355Z",
"updated_at": "2022-09-04T14:36:17.522380Z",
"structure_string": "Zr3 Se4\n1.0\n6.600217 -0.033414 0.000000\n-1.990970 6.292855 0.000000\n0.000000 0.000000 3.801261\nZr Se\n3 4\ndirect\n-0.000000 0.500000 0.000000 Zr\n0.000000 0.000000 0.500000 Zr\n0.500000 0.000000 0.000000 Zr\n0.736022 0.263978 0.500000 Se\n0.741960 0.741959 0.000000 Se\n0.263978 0.736022 0.500000 Se\n0.258041 0.258041 0.000000 Se\n",
"nsites": 7,
"nelements": 2,
"elements": [
"Zr",
"Se"
],
"chemical_system": "Se-Zr",
"density": 6.210181528814534,
"density_atomic": 0.04440793593212368,
"volume": 157.6294834035815,
"volume_molar": 13.560956242606455,
"formula_full": "Zr3 Se4",
"formula_reduced": "Zr3Se4",
"formula_anonymous": "A3B4",
"energy_above_hull": 2.822809566666667,
"spacegroup": 65
},
{
"id": "jvasp-110118",
"created_at": "2022-09-04T14:38:16.933905Z",
"updated_at": "2022-09-04T14:38:16.933925Z",
"structure_string": "Zr3 Se2\n1.0\n3.435343 0.000000 0.000000\n-1.717671 2.975095 0.000000\n0.000000 0.000000 10.621544\nZr Se\n3 2\ndirect\n0.000000 0.000000 0.355062 Zr\n0.000000 0.000000 0.000000 Zr\n0.000000 0.000000 0.644937 Zr\n0.666666 0.333333 0.178122 Se\n0.666666 0.333333 0.821878 Se\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Zr",
"Se"
],
"chemical_system": "Se-Zr",
"density": 6.601823167586391,
"density_atomic": 0.04605867161760821,
"volume": 108.55719073948502,
"volume_molar": 13.074933662866947,
"formula_full": "Zr3 Se2",
"formula_reduced": "Zr3Se2",
"formula_anonymous": "A2B3",
"energy_above_hull": 3.1722620466666664,
"spacegroup": 187
},
{
"id": "jvasp-104668",
"created_at": "2022-09-04T14:37:11.210696Z",
"updated_at": "2022-09-04T14:37:11.210723Z",
"structure_string": "Zr3 S4\n1.0\n6.295876 0.019199 0.000000\n-1.997143 5.970749 0.000000\n0.000000 0.000000 3.666577\nZr S\n3 4\ndirect\n0.500000 0.000000 0.500000 Zr\n0.000000 0.500000 0.500000 Zr\n0.000000 0.000000 0.000000 Zr\n0.255361 0.255361 0.500000 S\n0.744640 0.744639 0.500000 S\n0.738397 0.261603 -0.000000 S\n0.261604 0.738397 -0.000000 S\n",
"nsites": 7,
"nelements": 2,
"elements": [
"Zr",
"S"
],
"chemical_system": "S-Zr",
"density": 4.837412629065717,
"density_atomic": 0.050735213527541644,
"volume": 137.97123365214665,
"volume_molar": 11.869745569772515,
"formula_full": "Zr3 S4",
"formula_reduced": "Zr3S4",
"formula_anonymous": "A3B4",
"energy_above_hull": 3.0956247857142856,
"spacegroup": 65
},
{
"id": "jvasp-107264",
"created_at": "2022-09-04T14:37:01.875235Z",
"updated_at": "2022-09-04T14:37:01.875243Z",
"structure_string": "Zr3 S2\n1.0\n4.640474 0.013697 1.370566\n1.028078 4.525179 1.370566\n0.017106 0.013697 4.838610\nZr S\n3 2\ndirect\n0.160188 0.839813 0.500001 Zr\n0.500000 0.160189 0.839812 Zr\n0.839811 0.500001 0.160189 Zr\n0.335654 0.335654 0.335654 S\n0.664346 0.664347 0.664347 S\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Zr",
"S"
],
"chemical_system": "S-Zr",
"density": 5.5338452213745875,
"density_atomic": 0.0493271130406092,
"volume": 101.36413205215727,
"volume_molar": 12.208581424666376,
"formula_full": "Zr3 S2",
"formula_reduced": "Zr3S2",
"formula_anonymous": "A2B3",
"energy_above_hull": 3.3276347,
"spacegroup": 155
},
{
"id": "jvasp-85877",
"created_at": "2022-09-04T14:36:00.415203Z",
"updated_at": "2022-09-04T14:36:00.415219Z",
"structure_string": "Zr6 Rh10\n1.0\n5.616580 -0.034111 -0.000000\n-1.223700 5.481760 0.000000\n0.000000 0.000000 8.709762\nZr Rh\n6 10\ndirect\n0.569267 0.569267 0.750000 Zr\n0.430733 0.430733 0.250000 Zr\n0.207983 0.792017 0.500000 Zr\n0.792017 0.207983 0.000000 Zr\n0.792017 0.207983 0.500000 Zr\n0.207983 0.792017 0.000000 Zr\n0.710593 0.710593 0.028186 Rh\n0.710593 0.710593 0.471814 Rh\n0.289407 0.289407 0.971814 Rh\n0.289407 0.289407 0.528186 Rh\n0.026302 0.493448 0.750000 Rh\n0.973698 0.506552 0.250000 Rh\n0.013598 0.013598 0.250000 Rh\n0.986402 0.986402 0.750000 Rh\n0.493448 0.026302 0.750000 Rh\n0.506552 0.973698 0.250000 Rh\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Zr",
"Rh"
],
"chemical_system": "Rh-Zr",
"density": 9.77476184618441,
"density_atomic": 0.059746286825650065,
"volume": 267.79906919890686,
"volume_molar": 10.079523063204984,
"formula_full": "Zr6 Rh10",
"formula_reduced": "Zr3Rh5",
"formula_anonymous": "A3B5",
"energy_above_hull": 3.8847848125,
"spacegroup": 63
},
{
"id": "jvasp-103640",
"created_at": "2022-09-04T14:36:50.945818Z",
"updated_at": "2022-09-04T14:36:50.945842Z",
"structure_string": "Zr3 Rh1\n1.0\n3.750618 -0.009713 -4.342553\n-0.526486 3.713494 -4.342553\n0.008455 0.009713 5.738016\nZr Rh\n3 1\ndirect\n0.750000 0.250000 0.500000 Zr\n0.249999 0.749999 0.499999 Zr\n0.500000 0.500000 0.000000 Zr\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"Rh"
],
"chemical_system": "Rh-Zr",
"density": 7.7964192429637755,
"density_atomic": 0.04987141730063618,
"volume": 80.20626275541952,
"volume_molar": 12.075335103667046,
"formula_full": "Zr3 Rh1",
"formula_reduced": "Zr3Rh",
"formula_anonymous": "AB3",
"energy_above_hull": 3.880844125,
"spacegroup": 139
},
{
"id": "jvasp-79372",
"created_at": "2022-09-04T14:37:11.958195Z",
"updated_at": "2022-09-04T14:37:11.958225Z",
"structure_string": "Zr3 Pt1\n1.0\n4.332746 -0.000000 0.000000\n-0.000000 4.332746 0.000000\n-0.000000 -0.000000 4.332746\nZr Pt\n3 1\ndirect\n0.000000 0.500000 0.500000 Zr\n0.500000 0.000000 0.500000 Zr\n0.500000 0.500000 0.000000 Zr\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"Pt"
],
"chemical_system": "Pt-Zr",
"density": 9.569874603853277,
"density_atomic": 0.04917793644443571,
"volume": 81.3372884102091,
"volume_molar": 12.245614996074895,
"formula_full": "Zr3 Pt1",
"formula_reduced": "Zr3Pt",
"formula_anonymous": "AB3",
"energy_above_hull": 3.769988725,
"spacegroup": 221
},
{
"id": "jvasp-17327",
"created_at": "2022-09-04T14:38:04.554503Z",
"updated_at": "2022-09-04T14:38:04.554530Z",
"structure_string": "Zr3 P1 O2\n1.0\n1.715912 -2.972048 -0.000000\n1.715912 2.972048 0.000000\n0.000000 0.000000 8.389209\nZr P O\n3 1 2\ndirect\n0.666666 0.333332 0.701776 Zr\n0.333332 0.666666 0.298224 Zr\n0.000000 0.000000 0.000000 Zr\n0.000000 0.000000 0.500000 P\n0.666666 0.333332 0.142153 O\n0.333332 0.666666 0.857847 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Zr",
"P",
"O"
],
"chemical_system": "O-P-Zr",
"density": 6.533093301308667,
"density_atomic": 0.070121211354586,
"volume": 85.56612020946774,
"volume_molar": 8.58818700314159,
"formula_full": "Zr3 P1 O2",
"formula_reduced": "Zr3PO2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 3.488767666666667,
"spacegroup": 164
}
]
}