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=67",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=65",
"results": [
{
"id": "jvasp-105613",
"created_at": "2022-09-04T14:35:42.747380Z",
"updated_at": "2022-09-04T14:35:42.747405Z",
"structure_string": "K2 Na1 Au1 Cl6\n1.0\n6.290325 -0.000000 3.631720\n2.096775 5.930574 3.631720\n0.000000 0.000000 7.263441\nK Na Au Cl\n2 1 1 6\ndirect\n0.750000 0.749999 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Au\n0.757401 0.242599 0.242599 Cl\n0.242599 0.242599 0.757401 Cl\n0.242599 0.757401 0.757401 Cl\n0.242599 0.757401 0.242599 Cl\n0.757401 0.242599 0.757401 Cl\n0.757401 0.757401 0.242599 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Na",
"Au",
"Cl"
],
"chemical_system": "Au-Cl-K-Na",
"density": 3.1307476863093004,
"density_atomic": 0.03690521782466503,
"volume": 270.96439445255504,
"volume_molar": 16.317857243414498,
"formula_full": "K2 Na1 Au1 Cl6",
"formula_reduced": "K2NaAuCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-90637",
"created_at": "2022-09-04T14:35:42.923581Z",
"updated_at": "2022-09-04T14:35:42.923603Z",
"structure_string": "Y1 Mg6 Cu1\n1.0\n6.679825 -0.284874 0.000000\n-3.586621 5.642461 0.000000\n0.000000 0.000000 4.874415\nY Mg Cu\n1 6 1\ndirect\n0.195920 0.304080 0.250000 Y\n0.176335 0.823520 0.250000 Mg\n0.676480 0.323666 0.250000 Mg\n0.655033 0.844967 0.250000 Mg\n0.314115 0.682615 0.749999 Mg\n0.817385 0.185886 0.749999 Mg\n0.810465 0.689536 0.749999 Mg\n0.354265 0.145735 0.749999 Cu\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Y",
"Mg",
"Cu"
],
"chemical_system": "Cu-Mg-Y",
"density": 2.7711200504568447,
"density_atomic": 0.04475786914282976,
"volume": 178.7395189541012,
"volume_molar": 13.454931781453567,
"formula_full": "Y1 Mg6 Cu1",
"formula_reduced": "YMg6Cu",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-88080",
"created_at": "2022-09-04T14:35:44.842419Z",
"updated_at": "2022-09-04T14:35:44.842451Z",
"structure_string": "Ba8 Br12 O2\n1.0\n10.412649 0.000000 0.000000\n-5.206325 9.017619 -0.000000\n0.000000 -0.000000 7.902812\nBa Br O\n8 12 2\ndirect\n0.198366 0.801634 -0.000917 Ba\n0.333333 0.666667 0.420931 Ba\n0.603268 0.801634 -0.000917 Ba\n0.801634 0.198366 0.499083 Ba\n0.396732 0.198366 0.499083 Ba\n0.801634 0.603268 0.499083 Ba\n0.666667 0.333333 0.920930 Ba\n0.198366 0.396732 -0.000917 Ba\n0.940378 0.470189 0.207818 Br\n0.470189 0.529811 0.707818 Br\n0.529811 0.059622 0.207818 Br\n0.141650 0.858349 0.394846 Br\n0.470189 0.940378 0.707818 Br\n0.059621 0.529811 0.707818 Br\n0.141650 0.283301 0.394846 Br\n0.858349 0.716699 0.894846 Br\n0.283301 0.141651 0.894846 Br\n0.529811 0.470189 0.207818 Br\n0.716699 0.858349 0.394846 Br\n0.858349 0.141651 0.894846 Br\n0.333333 0.666667 0.099395 O\n0.666667 0.333333 0.599395 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Ba",
"Br",
"O"
],
"chemical_system": "Ba-Br-O",
"density": 4.675725201869476,
"density_atomic": 0.02964748916660778,
"volume": 742.0527207672881,
"volume_molar": 20.312481526370835,
"formula_full": "Ba8 Br12 O2",
"formula_reduced": "Ba4Br6O",
"formula_anonymous": "AB4C6",
"energy_above_hull": 0.0,
"spacegroup": 186
},
{
"id": "jvasp-94095",
"created_at": "2022-09-04T14:35:43.691817Z",
"updated_at": "2022-09-04T14:35:43.691834Z",
"structure_string": "Mg6 Ga1 Ni1\n1.0\n6.028132 0.049540 0.000000\n-2.971163 5.245285 0.000000\n0.000000 0.000000 4.808691\nMg Ga Ni\n6 1 1\ndirect\n0.164088 0.844999 0.250000 Mg\n0.655000 0.335912 0.250000 Mg\n0.662624 0.837375 0.250000 Mg\n0.329461 0.638685 0.750000 Mg\n0.861314 0.170539 0.750000 Mg\n0.836026 0.663973 0.750000 Mg\n0.335866 0.164134 0.750000 Ga\n0.155622 0.344378 0.250000 Ni\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Ga",
"Ni"
],
"chemical_system": "Ga-Mg-Ni",
"density": 2.981221998928921,
"density_atomic": 0.05237141058715905,
"volume": 152.755098827938,
"volume_molar": 11.498908836869424,
"formula_full": "Mg6 Ga1 Ni1",
"formula_reduced": "Mg6GaNi",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-65656",
"created_at": "2022-09-04T14:36:02.643803Z",
"updated_at": "2022-09-04T14:36:02.643823Z",
"structure_string": "Ba1 Na2 Ga1\n1.0\n4.202624 -0.000000 -0.000000\n-0.000000 4.202624 0.000000\n0.000000 0.000000 7.672023\nBa Na Ga\n1 2 1\ndirect\n0.499999 0.499999 0.000000 Ba\n0.000000 0.000000 0.687585 Na\n0.000000 0.000000 0.312415 Na\n0.499999 0.499999 0.500000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Na",
"Ga"
],
"chemical_system": "Ba-Ga-Na",
"density": 3.100768561933122,
"density_atomic": 0.02951950172595235,
"volume": 135.50364220691984,
"volume_molar": 20.40055017156871,
"formula_full": "Ba1 Na2 Ga1",
"formula_reduced": "BaNa2Ga",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 123
},
{
"id": "jvasp-1297",
"created_at": "2022-09-04T14:35:53.575197Z",
"updated_at": "2022-09-04T14:35:53.575222Z",
"structure_string": "Na2 Se1\n1.0\n4.159084 0.000000 2.401248\n1.386361 3.921222 2.401248\n0.000000 0.000000 4.802497\nNa Se\n2 1\ndirect\n0.749999 0.750000 0.750002 Na\n0.250000 0.250000 0.250001 Na\n0.000000 0.000000 0.000000 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Na",
"Se"
],
"chemical_system": "Na-Se",
"density": 2.6488829655834936,
"density_atomic": 0.0383031975262868,
"volume": 78.32244287023697,
"volume_molar": 15.722292521054184,
"formula_full": "Na2 Se1",
"formula_reduced": "Na2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-64463",
"created_at": "2022-09-04T14:35:58.384711Z",
"updated_at": "2022-09-04T14:35:58.384738Z",
"structure_string": "Ba4 In1 Ga1\n1.0\n0.000000 5.028841 5.028841\n5.028841 -0.000000 5.028841\n5.028841 5.028841 -0.000000\nBa In Ga\n4 1 1\ndirect\n0.125024 0.624992 0.624992 Ba\n0.624992 0.624992 0.624992 Ba\n0.624992 0.125024 0.624992 Ba\n0.624992 0.624992 0.125024 Ba\n0.000000 0.000000 0.000000 In\n0.250000 0.250000 0.250000 Ga\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"In",
"Ga"
],
"chemical_system": "Ba-Ga-In",
"density": 4.790955038053928,
"density_atomic": 0.02358943512136351,
"volume": 254.35115207850683,
"volume_molar": 25.528974004748914,
"formula_full": "Ba4 In1 Ga1",
"formula_reduced": "Ba4InGa",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-71562",
"created_at": "2022-09-04T14:35:57.420105Z",
"updated_at": "2022-09-04T14:35:57.420127Z",
"structure_string": "Be1 Cd2 Br1\n1.0\n3.211721 0.000000 -0.000000\n-0.000000 3.211721 0.000000\n0.000000 -0.000000 8.403898\nBe Cd Br\n1 2 1\ndirect\n0.000000 0.000000 0.503816 Be\n0.000000 0.000000 0.027423 Cd\n0.500000 0.500000 0.298675 Cd\n0.500000 0.500000 0.670086 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cd",
"Br"
],
"chemical_system": "Be-Br-Cd",
"density": 6.009800807299886,
"density_atomic": 0.04614276296613294,
"volume": 86.68748342911,
"volume_molar": 13.051105683506698,
"formula_full": "Be1 Cd2 Br1",
"formula_reduced": "BeCd2Br",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-95521",
"created_at": "2022-09-04T14:36:10.503137Z",
"updated_at": "2022-09-04T14:36:10.503163Z",
"structure_string": "Eu8 I16\n1.0\n7.286179 0.000000 0.000000\n0.000000 8.199500 0.000000\n0.000000 0.000000 13.959246\nEu I\n8 16\ndirect\n0.171633 0.449821 0.595097 Eu\n0.328367 0.949821 0.404903 Eu\n0.828367 0.550179 0.404903 Eu\n0.171633 0.949821 0.904903 Eu\n0.671633 0.050179 0.595097 Eu\n0.671633 0.550179 0.904903 Eu\n0.328367 0.449821 0.095097 Eu\n0.828367 0.050179 0.095097 Eu\n0.018003 0.295047 0.953316 I\n0.018003 0.795047 0.546684 I\n0.704416 0.884707 0.295735 I\n0.295584 0.115293 0.704265 I\n0.481997 0.795047 0.046684 I\n0.481997 0.295047 0.453316 I\n0.981997 0.704953 0.046684 I\n0.518004 0.704953 0.546684 I\n0.204416 0.615293 0.295735 I\n0.204416 0.115293 0.204265 I\n0.295584 0.615293 0.795735 I\n0.518004 0.204953 0.953316 I\n0.981997 0.204953 0.453316 I\n0.704416 0.384707 0.204265 I\n0.795584 0.384707 0.704265 I\n0.795584 0.884707 0.795735 I\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Eu",
"I"
],
"chemical_system": "Eu-I",
"density": 6.463578069305456,
"density_atomic": 0.0287780971496458,
"volume": 833.9675787179483,
"volume_molar": 20.92612561798277,
"formula_full": "Eu8 I16",
"formula_reduced": "EuI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 61
},
{
"id": "jvasp-64868",
"created_at": "2022-09-04T14:35:53.518345Z",
"updated_at": "2022-09-04T14:35:53.518372Z",
"structure_string": "Ba4 In1 Sn1\n1.0\n0.000000 5.019863 5.019863\n5.019863 0.000000 5.019863\n5.019863 5.019863 -0.000000\nBa In Sn\n4 1 1\ndirect\n0.123091 0.625636 0.625636 Ba\n0.625636 0.625636 0.625636 Ba\n0.625636 0.123091 0.625636 Ba\n0.625636 0.625636 0.123091 Ba\n0.250000 0.250000 0.250000 In\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"In",
"Sn"
],
"chemical_system": "Ba-In-Sn",
"density": 5.138238948550459,
"density_atomic": 0.0237162303859648,
"volume": 252.99130183651712,
"volume_molar": 25.392487178585874,
"formula_full": "Ba4 In1 Sn1",
"formula_reduced": "Ba4InSn",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-65635",
"created_at": "2022-09-04T14:35:46.885913Z",
"updated_at": "2022-09-04T14:35:46.885930Z",
"structure_string": "Ba2 Mg1 Ga1\n1.0\n0.000000 4.187741 4.187741\n4.187741 0.000000 4.187741\n4.187741 4.187741 -0.000000\nBa Mg Ga\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Ga"
],
"chemical_system": "Ba-Ga-Mg",
"density": 4.168037279694056,
"density_atomic": 0.027232690719828246,
"volume": 146.88229088900061,
"volume_molar": 22.11364577212068,
"formula_full": "Ba2 Mg1 Ga1",
"formula_reduced": "Ba2MgGa",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-106430",
"created_at": "2022-09-04T14:36:54.850228Z",
"updated_at": "2022-09-04T14:36:54.850247Z",
"structure_string": "K2 Al1 Au1 I6\n1.0\n7.045205 -0.000000 4.067551\n2.348402 6.642283 4.067551\n-0.000000 -0.000000 8.135102\nK Al Au I\n2 1 1 6\ndirect\n0.749999 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Au\n0.756350 0.243649 0.243650 I\n0.243649 0.243649 0.756350 I\n0.243649 0.756350 0.756350 I\n0.243649 0.756350 0.243650 I\n0.756350 0.243649 0.756350 I\n0.756350 0.756350 0.243650 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Al",
"Au",
"I"
],
"chemical_system": "Al-Au-I-K",
"density": 4.6391860261910285,
"density_atomic": 0.026267938306175968,
"volume": 380.69222957055814,
"volume_molar": 22.92582192712136,
"formula_full": "K2 Al1 Au1 I6",
"formula_reduced": "K2AlAuI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}