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=energy_above_hull&page=371",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=369",
"results": [
{
"id": "jvasp-20439",
"created_at": "2022-09-04T14:38:35.095344Z",
"updated_at": "2022-09-04T14:38:35.095368Z",
"structure_string": "Er5 Mg24\n1.0\n9.136328 0.000000 -3.230180\n-4.568164 7.912293 -3.230180\n-0.000000 0.000000 9.690539\nEr Mg\n5 24\ndirect\n0.000000 0.000000 0.000000 Er\n0.372527 -0.000000 0.000000 Er\n0.000000 0.372527 -0.000000 Er\n0.000000 0.000000 0.372527 Er\n0.627473 0.627473 0.627473 Er\n0.809275 -0.000000 0.628913 Mg\n0.190726 0.819639 0.190726 Mg\n0.819639 0.190726 0.190726 Mg\n0.000000 0.809274 0.628913 Mg\n0.809275 0.628913 0.000000 Mg\n0.628914 0.809274 0.000000 Mg\n0.371087 0.371087 0.180361 Mg\n0.677478 0.677477 0.288550 Mg\n0.388928 0.711450 0.388927 Mg\n0.190726 0.190726 0.819639 Mg\n0.611073 -0.000000 0.322523 Mg\n0.322523 -0.000000 0.611073 Mg\n0.677477 0.288550 0.677477 Mg\n0.288550 0.677477 0.677477 Mg\n0.000000 0.322523 0.611073 Mg\n0.322523 0.611073 -0.000000 Mg\n0.611073 0.322523 0.000000 Mg\n0.388927 0.388927 0.711450 Mg\n0.628913 -0.000000 0.809274 Mg\n0.000000 0.628913 0.809274 Mg\n0.180361 0.371087 0.371087 Mg\n0.371087 0.180361 0.371087 Mg\n0.000000 0.611073 0.322523 Mg\n0.711450 0.388927 0.388927 Mg\n",
"nsites": 29,
"nelements": 2,
"elements": [
"Er",
"Mg"
],
"chemical_system": "Er-Mg",
"density": 3.365097867896682,
"density_atomic": 0.04139768163346639,
"volume": 700.5223204711069,
"volume_molar": 14.547048342754604,
"formula_full": "Er5 Mg24",
"formula_reduced": "Er5Mg24",
"formula_anonymous": "A5B24",
"energy_above_hull": 0.0,
"spacegroup": 217
},
{
"id": "jvasp-21551",
"created_at": "2022-09-04T14:38:32.615413Z",
"updated_at": "2022-09-04T14:38:32.615435Z",
"structure_string": "K8 Be4 F16\n1.0\n5.655905 0.000000 0.000000\n0.000000 7.316127 0.000000\n0.000000 0.000000 9.866943\nK Be F\n8 4 16\ndirect\n0.254058 0.486376 0.808706 K\n0.754058 0.513624 0.191294 K\n0.754058 0.013624 0.308706 K\n0.254058 0.986376 0.691294 K\n0.254064 0.657407 0.408045 K\n0.754063 0.342593 0.591954 K\n0.754063 0.842593 0.908045 K\n0.254064 0.157407 0.091955 K\n0.254020 0.233434 0.419890 Be\n0.754020 0.766567 0.580110 Be\n0.754020 0.266567 0.919889 Be\n0.254020 0.733434 0.080110 Be\n0.754113 0.690437 0.430621 F\n0.254114 0.309564 0.569379 F\n0.253953 0.520143 0.084816 F\n0.753953 0.479857 0.915183 F\n0.753953 0.979857 0.584816 F\n0.253953 0.020143 0.415183 F\n0.028361 0.810077 0.152618 F\n0.979628 0.189986 0.847291 F\n0.528361 0.689924 0.652618 F\n0.028361 0.310077 0.347382 F\n0.479628 0.310014 0.347291 F\n0.979628 0.689987 0.652709 F\n0.754113 0.190437 0.069379 F\n0.479628 0.810014 0.152709 F\n0.528361 0.189924 0.847382 F\n0.254114 0.809564 0.930621 F\n",
"nsites": 28,
"nelements": 3,
"elements": [
"K",
"Be",
"F"
],
"chemical_system": "Be-F-K",
"density": 2.6550313575616817,
"density_atomic": 0.06857914559280137,
"volume": 408.2873847139196,
"volume_molar": 8.781300361712487,
"formula_full": "K8 Be4 F16",
"formula_reduced": "K2BeF4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-114592",
"created_at": "2022-09-04T14:38:42.573145Z",
"updated_at": "2022-09-04T14:38:42.573175Z",
"structure_string": "Ba1 Zn1 Te1\n1.0\n-0.000000 3.968779 3.968779\n3.968779 -0.000000 3.968779\n3.968779 3.968779 -0.000000\nBa Zn Te\n1 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.500000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Te\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"Te"
],
"chemical_system": "Ba-Te-Zn",
"density": 4.387369979867869,
"density_atomic": 0.023994986553775546,
"volume": 125.02611715479199,
"volume_molar": 25.097495872746936,
"formula_full": "Ba1 Zn1 Te1",
"formula_reduced": "BaZnTe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-120553",
"created_at": "2022-09-04T14:38:45.436278Z",
"updated_at": "2022-09-04T14:38:45.436308Z",
"structure_string": "Ag4 Hg4 S4 Br1 Cl3\n1.0\n4.523090 -0.004324 0.004703\n0.006751 6.901585 0.033823\n0.002323 0.003083 12.992741\nAg Hg S Br Cl\n4 4 4 1 3\ndirect\n-0.000863 0.791415 0.460286 Ag\n0.000946 0.208780 0.541747 Ag\n0.001209 0.291823 0.042169 Ag\n0.998701 0.700468 0.951448 Ag\n0.499985 0.623132 0.244786 Hg\n0.500024 0.374834 0.756181 Hg\n0.500300 0.125474 0.262602 Hg\n0.499675 0.876512 0.740134 Hg\n0.499526 0.857760 0.385180 S\n0.500544 0.140694 0.616874 S\n0.500754 0.359808 0.121287 S\n0.499122 0.638598 0.878672 S\n0.000646 0.873328 0.133513 Br\n-0.000540 0.137982 0.863052 Cl\n0.999709 0.370315 0.365356 Cl\n0.000255 0.629081 0.636707 Cl\n",
"nsites": 16,
"nelements": 5,
"elements": [
"Ag",
"Hg",
"S",
"Br",
"Cl"
],
"chemical_system": "Ag-Br-Cl-Hg-S",
"density": 6.339210758575263,
"density_atomic": 0.03944893752057689,
"volume": 405.58760274986537,
"volume_molar": 15.265660214191577,
"formula_full": "Ag4 Hg4 S4 Br1 Cl3",
"formula_reduced": "Ag4Hg4S4BrCl3",
"formula_anonymous": "AB3C4D4E4",
"energy_above_hull": 0.0,
"spacegroup": 6
},
{
"id": "jvasp-14242",
"created_at": "2022-09-04T14:38:32.620959Z",
"updated_at": "2022-09-04T14:38:32.620982Z",
"structure_string": "K4 Au4 I12\n1.0\n0.000000 7.175587 0.023082\n9.335518 0.000000 0.000000\n0.000000 -6.699783 -11.458743\nK Au I\n4 4 12\ndirect\n0.182096 0.119475 0.747814 K\n0.817904 0.619475 0.752185 K\n0.817904 0.880525 0.252186 K\n0.182096 0.380525 0.247814 K\n0.500000 0.500000 0.000000 Au\n0.500000 0.000000 0.500000 Au\n0.000000 0.500000 0.500000 Au\n0.000000 0.000000 0.000000 Au\n0.839515 0.662027 0.035648 I\n0.160486 0.162027 0.464352 I\n0.348063 0.504732 0.764889 I\n0.651938 0.004732 0.735111 I\n0.651938 0.495268 0.235111 I\n0.265578 0.654539 0.462042 I\n0.734423 0.345461 0.537958 I\n0.265578 0.845462 0.962042 I\n0.839515 0.837974 0.535648 I\n0.734423 0.154539 0.037958 I\n0.348063 0.995268 0.264889 I\n0.160486 0.337974 0.964351 I\n",
"nsites": 20,
"nelements": 3,
"elements": [
"K",
"Au",
"I"
],
"chemical_system": "Au-I-K",
"density": 5.347156686265777,
"density_atomic": 0.026104461958197264,
"volume": 766.1525463358438,
"volume_molar": 23.069392388334368,
"formula_full": "K4 Au4 I12",
"formula_reduced": "KAuI3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 14
},
{
"id": "jvasp-40536",
"created_at": "2022-09-04T14:38:32.621515Z",
"updated_at": "2022-09-04T14:38:32.621533Z",
"structure_string": "Ac2 Ga6\n1.0\n3.439125 -5.956739 -0.000000\n3.439125 5.956739 0.000000\n-0.000000 -0.000000 4.617433\nAc Ga\n2 6\ndirect\n0.333332 0.666666 0.250000 Ac\n0.666666 0.333332 0.750000 Ac\n0.728775 0.864387 0.750000 Ga\n0.135611 0.271223 0.750000 Ga\n0.135611 0.864388 0.750000 Ga\n0.271223 0.135611 0.250000 Ga\n0.864387 0.728775 0.250000 Ga\n0.864388 0.135611 0.250000 Ga\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ac",
"Ga"
],
"chemical_system": "Ac-Ga",
"density": 7.656790385912629,
"density_atomic": 0.042286608621626295,
"volume": 189.1851879535363,
"volume_molar": 14.24124789454065,
"formula_full": "Ac2 Ga6",
"formula_reduced": "AcGa3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-115560",
"created_at": "2022-09-04T14:38:42.461665Z",
"updated_at": "2022-09-04T14:38:42.461692Z",
"structure_string": "Ba1 Tl1 Cl2\n1.0\n3.782057 0.000000 0.000000\n0.000000 3.782057 0.000000\n0.000000 0.000000 9.310380\nBa Tl Cl\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Ba\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.184580 Cl\n0.000000 0.000000 0.815419 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Cl"
],
"chemical_system": "Ba-Cl-Tl",
"density": 5.1448406870452885,
"density_atomic": 0.030035609175758576,
"volume": 133.17525796108566,
"volume_molar": 20.05000372977421,
"formula_full": "Ba1 Tl1 Cl2",
"formula_reduced": "BaTlCl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 123
},
{
"id": "jvasp-117568",
"created_at": "2022-09-04T14:38:35.924129Z",
"updated_at": "2022-09-04T14:38:35.924153Z",
"structure_string": "Ba1 Sn1 Cl2\n1.0\n4.329196 0.000000 -0.000000\n0.000000 4.329196 0.000000\n-0.000000 0.000000 6.788044\nBa Sn Cl\n1 1 2\ndirect\n0.500000 0.500000 0.558046 Ba\n0.000000 0.000000 0.883376 Sn\n0.000000 0.000000 0.446417 Cl\n0.500000 0.500000 0.122160 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Sn",
"Cl"
],
"chemical_system": "Ba-Cl-Sn",
"density": 4.267386658068577,
"density_atomic": 0.031441325418945704,
"volume": 127.22109983282407,
"volume_molar": 19.153584270881975,
"formula_full": "Ba1 Sn1 Cl2",
"formula_reduced": "BaSnCl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-12544",
"created_at": "2022-09-04T14:38:35.723428Z",
"updated_at": "2022-09-04T14:38:35.723447Z",
"structure_string": "K2 Br2 F8\n1.0\n5.540860 -0.000000 -2.691991\n-1.307886 5.384289 -2.691991\n0.015022 0.019108 7.079225\nK Br F\n2 2 8\ndirect\n0.250000 0.250000 0.500000 K\n0.749999 0.750000 0.500000 K\n-0.000000 0.500000 -0.000000 Br\n0.500000 0.000000 0.000000 Br\n0.965160 0.465160 0.246044 F\n0.719116 0.219116 0.753956 F\n0.034839 0.534840 0.753956 F\n0.219116 0.034840 0.753956 F\n0.280883 0.780884 0.246044 F\n0.465160 0.280884 0.246044 F\n0.780883 0.965161 0.246044 F\n0.534839 0.719116 0.753956 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"K",
"Br",
"F"
],
"chemical_system": "Br-F-K",
"density": 3.058037200884255,
"density_atomic": 0.05666558918584329,
"volume": 211.76873253085225,
"volume_molar": 10.627509298896529,
"formula_full": "K2 Br2 F8",
"formula_reduced": "KBrF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 140
},
{
"id": "jvasp-115556",
"created_at": "2022-09-04T14:38:42.462119Z",
"updated_at": "2022-09-04T14:38:42.462135Z",
"structure_string": "Ba1 Te1 Cl1\n1.0\n0.000000 3.942556 3.942556\n3.942556 0.000000 3.942556\n3.942556 3.942556 0.000000\nBa Te Cl\n1 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.500000 0.500000 0.500000 Te\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Te",
"Cl"
],
"chemical_system": "Ba-Cl-Te",
"density": 4.069644771710152,
"density_atomic": 0.02447696950553236,
"volume": 122.56419240633244,
"volume_molar": 24.603293960221905,
"formula_full": "Ba1 Te1 Cl1",
"formula_reduced": "BaTeCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-105003",
"created_at": "2022-09-04T14:38:45.385016Z",
"updated_at": "2022-09-04T14:38:45.385041Z",
"structure_string": "K3 Tm1 Cl6\n1.0\n6.698045 -0.000000 3.867118\n2.232682 6.314978 3.867118\n-0.000000 -0.000000 7.734237\nK Tm Cl\n3 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Tm\n0.764383 0.235618 0.235617 Cl\n0.235617 0.235618 0.764383 Cl\n0.235617 0.764383 0.764383 Cl\n0.235617 0.764383 0.235618 Cl\n0.764383 0.235618 0.764383 Cl\n0.764383 0.764383 0.235618 Cl\n",
"nsites": 10,
"nelements": 3,
"elements": [
"K",
"Tm",
"Cl"
],
"chemical_system": "Cl-K-Tm",
"density": 2.5325978276821335,
"density_atomic": 0.030567690054448215,
"volume": 327.1428093581052,
"volume_molar": 19.70100046576355,
"formula_full": "K3 Tm1 Cl6",
"formula_reduced": "K3TmCl6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-110744",
"created_at": "2022-09-04T14:38:36.608396Z",
"updated_at": "2022-09-04T14:38:36.608417Z",
"structure_string": "Yb1 Ac1 Ag2\n1.0\n4.648988 -0.000000 2.684094\n1.549663 4.383108 2.684094\n-0.000000 -0.000000 5.368189\nYb Ac Ag\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.499999 Ac\n0.750000 0.750000 0.749999 Ag\n0.250000 0.250000 0.250000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Ac",
"Ag"
],
"chemical_system": "Ac-Ag-Yb",
"density": 9.347677981226648,
"density_atomic": 0.03656719068905739,
"volume": 109.38767579968858,
"volume_molar": 16.468699526874257,
"formula_full": "Yb1 Ac1 Ag2",
"formula_reduced": "AcYbAg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}