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=nelements&page=599",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=597",
"results": [
{
"id": "jvasp-116286",
"created_at": "2022-09-04T14:38:49.125033Z",
"updated_at": "2022-09-04T14:38:49.125058Z",
"structure_string": "Li3 H1\n1.0\n2.811353 -0.469547 0.029342\n1.073239 -2.654798 -0.270743\n-0.044877 -0.624163 -7.644950\nLi H\n3 1\ndirect\n0.223287 -0.139872 0.047745 Li\n0.437282 0.427267 0.703200 Li\n0.012057 0.294036 0.392202 Li\n0.724849 0.860572 0.547726 H\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"H"
],
"chemical_system": "H-Li",
"density": 0.6878492058085692,
"density_atomic": 0.07589823874674956,
"volume": 52.70214521507991,
"volume_molar": 7.934493420979292,
"formula_full": "Li3 H1",
"formula_reduced": "Li3H",
"formula_anonymous": "AB3",
"energy_above_hull": 1.10145,
"spacegroup": 166
},
{
"id": "jvasp-111288",
"created_at": "2022-09-04T14:38:49.518384Z",
"updated_at": "2022-09-04T14:38:49.518412Z",
"structure_string": "Nd6 Er2\n1.0\n7.284662 0.000000 0.000000\n-3.642332 6.308702 0.000000\n0.000000 -0.000000 5.834108\nNd Er\n6 2\ndirect\n0.167819 0.335638 0.250000 Nd\n0.664362 0.832181 0.250000 Nd\n0.167819 0.832181 0.250000 Nd\n0.832181 0.664362 0.750000 Nd\n0.335638 0.167819 0.750000 Nd\n0.832181 0.167819 0.750000 Nd\n0.333333 0.666666 0.750000 Er\n0.666667 0.333333 0.250000 Er\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Nd",
"Er"
],
"chemical_system": "Er-Nd",
"density": 7.431827186064917,
"density_atomic": 0.029837752233101953,
"volume": 268.11671125564254,
"volume_molar": 20.182957191121947,
"formula_full": "Nd6 Er2",
"formula_reduced": "Nd3Er",
"formula_anonymous": "AB3",
"energy_above_hull": 1.5710736250000004,
"spacegroup": 194
},
{
"id": "jvasp-117625",
"created_at": "2022-09-04T14:38:51.928939Z",
"updated_at": "2022-09-04T14:38:51.928967Z",
"structure_string": "Ba3 Se1\n1.0\n4.338195 0.551697 -0.371328\n0.600346 -8.014236 -4.870288\n-0.123522 -4.571102 -8.208125\nBa Se\n3 1\ndirect\n0.908198 0.734557 0.053009 Ba\n0.408192 0.069940 0.387770 Ba\n0.408190 0.394445 0.714090 Ba\n0.908176 0.917532 0.237300 Se\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ba",
"Se"
],
"chemical_system": "Ba-Se",
"density": 4.2188973741306635,
"density_atomic": 0.020700486492502588,
"volume": 193.23217362300838,
"volume_molar": 29.09178372296289,
"formula_full": "Ba3 Se1",
"formula_reduced": "Ba3Se",
"formula_anonymous": "AB3",
"energy_above_hull": 0.2802604849999999,
"spacegroup": 38
},
{
"id": "jvasp-119500",
"created_at": "2022-09-04T14:38:52.992134Z",
"updated_at": "2022-09-04T14:38:52.992157Z",
"structure_string": "Hf4 Pt16\n1.0\n4.019586 0.000000 0.000000\n0.000000 4.019586 0.000000\n0.000000 0.000000 20.195094\nHf Pt\n4 16\ndirect\n0.000000 0.000000 0.196139 Hf\n0.000000 0.000000 0.399248 Hf\n0.000000 0.000000 0.600752 Hf\n0.000000 0.000000 0.803860 Hf\n-0.000000 0.500000 0.699617 Pt\n-0.000000 0.500000 0.500000 Pt\n-0.000000 0.500000 0.300383 Pt\n-0.000000 0.500000 0.101668 Pt\n0.500000 0.000000 0.898332 Pt\n0.500000 0.000000 0.699617 Pt\n0.500000 0.000000 0.500000 Pt\n0.500000 0.000000 0.101668 Pt\n-0.000000 0.500000 0.898332 Pt\n0.500000 0.500000 0.799134 Pt\n0.500000 0.500000 0.599762 Pt\n0.500000 0.500000 0.400238 Pt\n0.500000 0.500000 0.200865 Pt\n0.500000 0.500000 -0.000000 Pt\n0.500000 0.000000 0.300383 Pt\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 20,
"nelements": 2,
"elements": [
"Hf",
"Pt"
],
"chemical_system": "Hf-Pt",
"density": 19.51822688368246,
"density_atomic": 0.06129449437112247,
"volume": 326.29357995687377,
"volume_molar": 9.824929337923045,
"formula_full": "Hf4 Pt16",
"formula_reduced": "HfPt4",
"formula_anonymous": "AB4",
"energy_above_hull": 3.2225777200000003,
"spacegroup": 123
},
{
"id": "jvasp-119416",
"created_at": "2022-09-04T14:38:49.966905Z",
"updated_at": "2022-09-04T14:38:49.966938Z",
"structure_string": "La14 Pd6\n1.0\n10.360576 -0.000000 0.000000\n-5.180288 8.972522 0.000000\n0.000000 0.000000 6.548482\nLa Pd\n14 6\ndirect\n0.333333 0.666667 0.447287 La\n0.461730 0.923460 0.947615 La\n0.076540 0.538270 0.947615 La\n0.461730 0.538270 0.947615 La\n0.538270 0.076540 0.447615 La\n0.538270 0.461730 0.447615 La\n0.874639 0.749278 0.742249 La\n0.923460 0.461730 0.447615 La\n0.874639 0.125361 0.742249 La\n0.125361 0.250722 0.242249 La\n0.749278 0.874639 0.242249 La\n0.125361 0.874639 0.242249 La\n0.666667 0.333333 0.947287 La\n0.250722 0.125361 0.742249 La\n0.623121 0.811560 0.692004 Pd\n0.811560 0.188440 0.192004 Pd\n0.376879 0.188440 0.192004 Pd\n0.811560 0.623121 0.192004 Pd\n0.188440 0.811560 0.692004 Pd\n0.188440 0.376879 0.692004 Pd\n",
"nsites": 20,
"nelements": 2,
"elements": [
"La",
"Pd"
],
"chemical_system": "La-Pd",
"density": 7.04640309469932,
"density_atomic": 0.03285420213946192,
"volume": 608.750135373933,
"volume_molar": 18.329895014454397,
"formula_full": "La14 Pd6",
"formula_reduced": "La7Pd3",
"formula_anonymous": "A3B7",
"energy_above_hull": 2.12002821,
"spacegroup": 186
},
{
"id": "jvasp-123613",
"created_at": "2022-09-04T14:38:52.096510Z",
"updated_at": "2022-09-04T14:38:52.096534Z",
"structure_string": "P3 Ru1\n1.0\n2.995789 -0.000000 -0.959289\n-0.226217 3.577999 -0.706459\n0.223561 -0.800856 5.855621\nP Ru\n3 1\ndirect\n0.586527 0.125317 0.173054 P\n0.138476 0.573807 0.276951 P\n0.908799 0.423933 0.817600 P\n0.366196 0.876941 0.732394 Ru\n",
"nsites": 4,
"nelements": 2,
"elements": [
"P",
"Ru"
],
"chemical_system": "P-Ru",
"density": 5.2239063078799175,
"density_atomic": 0.06486703555122852,
"volume": 61.66460307625764,
"volume_molar": 9.283822990868813,
"formula_full": "P3 Ru1",
"formula_reduced": "P3Ru",
"formula_anonymous": "AB3",
"energy_above_hull": 3.3346567500000006,
"spacegroup": 8
},
{
"id": "jvasp-116214",
"created_at": "2022-09-04T14:38:49.530354Z",
"updated_at": "2022-09-04T14:38:49.530377Z",
"structure_string": "K1 Te1\n1.0\n5.795922 -0.000000 0.000000\n-2.897961 5.019416 -0.000000\n-0.000000 -0.000000 3.269408\nK Te\n1 1\ndirect\n0.000000 0.000000 0.000000 K\n0.333333 0.666667 0.000000 Te\n",
"nsites": 2,
"nelements": 2,
"elements": [
"K",
"Te"
],
"chemical_system": "K-Te",
"density": 2.9102843537134255,
"density_atomic": 0.021027379446274544,
"volume": 95.11408709345108,
"volume_molar": 28.639521036783083,
"formula_full": "K1 Te1",
"formula_reduced": "KTe",
"formula_anonymous": "AB",
"energy_above_hull": 0.1926319416666667,
"spacegroup": 187
},
{
"id": "jvasp-123618",
"created_at": "2022-09-04T14:38:52.242118Z",
"updated_at": "2022-09-04T14:38:52.242143Z",
"structure_string": "Si1 P3\n1.0\n3.280116 0.000000 -1.050334\n0.049084 4.116736 0.153286\n-0.035926 0.188632 5.534750\nSi P\n1 3\ndirect\n0.395047 0.942750 0.790100 Si\n0.611337 0.060408 0.222672 P\n0.102110 0.420283 0.204221 P\n0.891503 0.576561 0.783009 P\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Si",
"P"
],
"chemical_system": "P-Si",
"density": 2.6979353746791648,
"density_atomic": 0.053707224628926194,
"volume": 74.47787569804228,
"volume_molar": 11.212906273984848,
"formula_full": "Si1 P3",
"formula_reduced": "SiP3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.0470862750000007,
"spacegroup": 8
},
{
"id": "jvasp-120308",
"created_at": "2022-09-04T14:38:53.659779Z",
"updated_at": "2022-09-04T14:38:53.659806Z",
"structure_string": "Li2 Sb1\n1.0\n4.825078 0.000000 -0.000000\n-2.412539 4.178640 0.000000\n-0.000000 0.000000 3.366645\nLi Sb\n2 1\ndirect\n0.333333 0.666666 0.000000 Li\n0.666667 0.333333 0.000000 Li\n0.000000 0.000000 0.000000 Sb\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"Sb"
],
"chemical_system": "Li-Sb",
"density": 3.3182313527578495,
"density_atomic": 0.04419616996385773,
"volume": 67.8791850618121,
"volume_molar": 13.625933570544058,
"formula_full": "Li2 Sb1",
"formula_reduced": "Li2Sb",
"formula_anonymous": "AB2",
"energy_above_hull": 0.7179187000000001,
"spacegroup": 191
},
{
"id": "jvasp-117966",
"created_at": "2022-09-04T14:38:48.937881Z",
"updated_at": "2022-09-04T14:38:48.937901Z",
"structure_string": "Ca1 C2\n1.0\n5.017428 0.000000 0.000000\n0.000000 3.635789 0.000000\n0.000000 0.000000 2.680290\nCa C\n1 2\ndirect\n0.466666 0.000000 0.000000 Ca\n-0.033333 0.000000 0.752338 C\n-0.033333 0.000000 0.247661 C\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ca",
"C"
],
"chemical_system": "C-Ca",
"density": 2.1769149170183724,
"density_atomic": 0.061356368658796116,
"volume": 48.89467981201845,
"volume_molar": 9.815021474770182,
"formula_full": "Ca1 C2",
"formula_reduced": "CaC2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.6809668066666656,
"spacegroup": 47
},
{
"id": "jvasp-111280",
"created_at": "2022-09-04T14:38:48.760429Z",
"updated_at": "2022-09-04T14:38:48.760459Z",
"structure_string": "Mg5 Sc1\n1.0\n4.904062 0.004665 3.746939\n1.855224 4.539603 3.746939\n0.006939 0.004665 6.171656\nMg Sc\n5 1\ndirect\n0.340610 0.000001 0.659390 Mg\n0.659389 0.340611 0.000000 Mg\n-0.000001 0.659389 0.340611 Mg\n0.162922 0.162923 0.162923 Mg\n0.837076 0.837079 0.837078 Mg\n0.499999 0.500001 0.500001 Sc\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Sc"
],
"chemical_system": "Mg-Sc",
"density": 2.0153411188125627,
"density_atomic": 0.043740754739856225,
"volume": 137.17184432880507,
"volume_molar": 13.767802580947864,
"formula_full": "Mg5 Sc1",
"formula_reduced": "Mg5Sc",
"formula_anonymous": "AB5",
"energy_above_hull": 0.0,
"spacegroup": 155
},
{
"id": "jvasp-118753",
"created_at": "2022-09-04T14:38:53.657329Z",
"updated_at": "2022-09-04T14:38:53.657355Z",
"structure_string": "N1 Cl2\n1.0\n4.474429 0.000000 0.199838\n0.000000 3.099683 0.000000\n0.213234 0.000000 4.680731\nN Cl\n1 2\ndirect\n0.565106 0.000000 -0.108479 N\n0.190270 0.000000 -0.021542 Cl\n-0.355376 0.000000 0.530021 Cl\n",
"nsites": 3,
"nelements": 2,
"elements": [
"N",
"Cl"
],
"chemical_system": "Cl-N",
"density": 2.176394834841312,
"density_atomic": 0.04630599209286955,
"volume": 64.78643182902363,
"volume_molar": 13.00510039375082,
"formula_full": "N1 Cl2",
"formula_reduced": "NCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.8393871283333327,
"spacegroup": 6
}
]
}