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=density_atomic&page=251",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=249",
"results": [
{
"id": "jvasp-69016",
"created_at": "2022-09-04T14:36:05.389362Z",
"updated_at": "2022-09-04T14:36:05.389387Z",
"structure_string": "Ba2 Sc1 Hg1\n1.0\n-0.000000 4.194648 4.194648\n4.194648 -0.000000 4.194648\n4.194648 4.194648 0.000000\nBa Sc Hg\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Sc\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Sc",
"Hg"
],
"chemical_system": "Ba-Hg-Sc",
"density": 5.851979680434335,
"density_atomic": 0.027098386262252246,
"volume": 147.61026583977645,
"volume_molar": 22.223244962703838,
"formula_full": "Ba2 Sc1 Hg1",
"formula_reduced": "Ba2ScHg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1353229475,
"spacegroup": 225
},
{
"id": "jvasp-114538",
"created_at": "2022-09-04T14:38:41.067380Z",
"updated_at": "2022-09-04T14:38:41.067408Z",
"structure_string": "Ba1 Br1 N1\n1.0\n5.258697 -0.000000 0.000000\n-2.629348 4.554165 -0.000000\n-0.000000 0.000000 4.622364\nBa Br N\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.333333 0.666666 0.000000 Br\n0.666667 0.333333 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Br",
"N"
],
"chemical_system": "Ba-Br-N",
"density": 3.4686197058121033,
"density_atomic": 0.02710005693517394,
"volume": 110.7008744364007,
"volume_molar": 22.221874937036354,
"formula_full": "Ba1 Br1 N1",
"formula_reduced": "BaBrN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.5647011083333329,
"spacegroup": 187
},
{
"id": "jvasp-66088",
"created_at": "2022-09-04T14:36:16.813812Z",
"updated_at": "2022-09-04T14:36:16.813834Z",
"structure_string": "Ba4 Bi1 Ir1\n1.0\n-0.000000 4.801239 4.801239\n4.801239 -0.000000 4.801239\n4.801239 4.801239 -0.000000\nBa Bi Ir\n4 1 1\ndirect\n0.123548 0.625484 0.625484 Ba\n0.625484 0.625484 0.625484 Ba\n0.625484 0.123548 0.625484 Ba\n0.625484 0.625484 0.123548 Ba\n0.250000 0.250000 0.250000 Bi\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Bi",
"Ir"
],
"chemical_system": "Ba-Bi-Ir",
"density": 7.130397065772038,
"density_atomic": 0.027105740684656453,
"volume": 221.35532357528882,
"volume_molar": 22.21721527576226,
"formula_full": "Ba4 Bi1 Ir1",
"formula_reduced": "Ba4BiIr",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.9206098799999995,
"spacegroup": 216
},
{
"id": "jvasp-68986",
"created_at": "2022-09-04T14:36:19.244469Z",
"updated_at": "2022-09-04T14:36:19.244487Z",
"structure_string": "K1 Ba2 Pd1\n1.0\n-0.000000 4.194104 4.194104\n4.194104 -0.000000 4.194104\n4.194104 4.194104 0.000000\nK Ba Pd\n1 2 1\ndirect\n0.000000 0.000000 0.000000 K\n0.250000 0.250000 0.250000 Ba\n0.749999 0.749999 0.749999 Ba\n0.500000 0.500000 0.500000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Ba",
"Pd"
],
"chemical_system": "Ba-K-Pd",
"density": 4.728560323169487,
"density_atomic": 0.027108932091066885,
"volume": 147.5528429730401,
"volume_molar": 22.21459974804561,
"formula_full": "K1 Ba2 Pd1",
"formula_reduced": "KBa2Pd",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.05310891,
"spacegroup": 225
},
{
"id": "jvasp-65639",
"created_at": "2022-09-04T14:35:56.565196Z",
"updated_at": "2022-09-04T14:35:56.565211Z",
"structure_string": "Ba2 Ge1 Bi1\n1.0\n0.000000 4.193983 4.193983\n4.193983 0.000000 4.193983\n4.193983 4.193983 0.000000\nBa Ge Bi\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.749999 0.749999 0.749999 Ba\n0.500000 0.500000 0.500000 Ge\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Ge",
"Bi"
],
"chemical_system": "Ba-Bi-Ge",
"density": 6.260776184182406,
"density_atomic": 0.027111278506457667,
"volume": 147.5400726324004,
"volume_molar": 22.212677128323474,
"formula_full": "Ba2 Ge1 Bi1",
"formula_reduced": "Ba2GeBi",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1532230475,
"spacegroup": 225
},
{
"id": "jvasp-107894",
"created_at": "2022-09-04T14:36:02.230992Z",
"updated_at": "2022-09-04T14:36:02.231027Z",
"structure_string": "Ba2 Cd1 Hg1\n1.0\n5.136490 -0.000000 2.965554\n1.712163 4.842730 2.965554\n-0.000000 -0.000000 5.931108\nBa Cd Hg\n2 1 1\ndirect\n0.749999 0.750000 0.749999 Ba\n0.250000 0.250000 0.250000 Ba\n0.500000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Cd",
"Hg"
],
"chemical_system": "Ba-Cd-Hg",
"density": 6.614225506834155,
"density_atomic": 0.02711236833468797,
"volume": 147.53414200567423,
"volume_molar": 22.211784251599973,
"formula_full": "Ba2 Cd1 Hg1",
"formula_reduced": "Ba2CdHg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-66188",
"created_at": "2022-09-04T14:36:18.953480Z",
"updated_at": "2022-09-04T14:36:18.953502Z",
"structure_string": "Ba4 Tl1 Ir1\n1.0\n-0.000000 4.800811 4.800811\n4.800811 0.000000 4.800811\n4.800811 4.800811 0.000000\nBa Tl Ir\n4 1 1\ndirect\n0.127749 0.624084 0.624084 Ba\n0.624084 0.624084 0.624084 Ba\n0.624084 0.127749 0.624084 Ba\n0.624084 0.624084 0.127749 Ba\n0.000000 0.000000 0.000000 Tl\n0.250000 0.250000 0.250000 Ir\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Ir"
],
"chemical_system": "Ba-Ir-Tl",
"density": 7.097809050399105,
"density_atomic": 0.027112990891745063,
"volume": 221.29613158343167,
"volume_molar": 22.211274233981786,
"formula_full": "Ba4 Tl1 Ir1",
"formula_reduced": "Ba4TlIr",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.6719445966666665,
"spacegroup": 216
},
{
"id": "jvasp-105714",
"created_at": "2022-09-04T14:35:53.316247Z",
"updated_at": "2022-09-04T14:35:53.316282Z",
"structure_string": "Yb1 Ac2 Mg1\n1.0\n5.136411 0.000000 2.965508\n1.712137 4.842655 2.965508\n0.000000 0.000000 5.931017\nYb Ac Mg\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Yb\n0.250000 0.250000 0.250000 Ac\n0.750001 0.749999 0.750001 Ac\n0.500000 0.499999 0.500001 Mg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Ac",
"Mg"
],
"chemical_system": "Ac-Mg-Yb",
"density": 7.331413497145238,
"density_atomic": 0.027113621239023902,
"volume": 147.52732454058582,
"volume_molar": 22.210757858240253,
"formula_full": "Yb1 Ac2 Mg1",
"formula_reduced": "Ac2YbMg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1810813375,
"spacegroup": 225
},
{
"id": "jvasp-66591",
"created_at": "2022-09-04T14:36:12.558276Z",
"updated_at": "2022-09-04T14:36:12.558304Z",
"structure_string": "K1 Ba1 Tc1\n1.0\n0.000000 3.810104 3.810104\n3.810104 0.000000 3.810104\n3.810104 3.810104 0.000000\nK Ba Tc\n1 1 1\ndirect\n0.000000 0.000000 0.000000 K\n0.749999 0.749999 0.749999 Ba\n0.500000 0.500000 0.500000 Tc\n",
"nsites": 3,
"nelements": 3,
"elements": [
"K",
"Ba",
"Tc"
],
"chemical_system": "Ba-K-Tc",
"density": 4.119388560546433,
"density_atomic": 0.027119443176686724,
"volume": 110.621740293656,
"volume_molar": 22.20598970548534,
"formula_full": "K1 Ba1 Tc1",
"formula_reduced": "KBaTc",
"formula_anonymous": "ABC",
"energy_above_hull": 1.7610251566666664,
"spacegroup": 216
},
{
"id": "jvasp-37117",
"created_at": "2022-09-04T14:38:07.761289Z",
"updated_at": "2022-09-04T14:38:07.761298Z",
"structure_string": "Pr1 Tl1 Te2\n1.0\n-2.290978 -3.968090 0.000000\n-4.581956 0.000000 0.000000\n-2.290978 -1.322697 -8.112322\nPr Tl Te\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Pr\n0.500000 0.500001 0.500000 Tl\n0.741351 0.741352 0.775948 Te\n0.258650 0.258650 0.224052 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pr",
"Tl",
"Te"
],
"chemical_system": "Pr-Te-Tl",
"density": 6.76048658199941,
"density_atomic": 0.027119543977780942,
"volume": 147.49510549577096,
"volume_molar": 22.20590716766456,
"formula_full": "Pr1 Tl1 Te2",
"formula_reduced": "PrTlTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4413419958333334,
"spacegroup": 166
},
{
"id": "jvasp-112997",
"created_at": "2022-09-04T14:38:46.014560Z",
"updated_at": "2022-09-04T14:38:46.014590Z",
"structure_string": "Y6 Rh1 I10\n1.0\n7.559540 -0.027024 -0.940423\n-2.851130 8.671102 -2.866104\n-0.008835 -0.037080 9.588477\nY Rh I\n6 1 10\ndirect\n0.526366 0.210553 0.412188 Y\n0.473633 0.789448 0.587813 Y\n0.143766 0.370504 0.330838 Y\n0.856233 0.629497 0.669163 Y\n0.613069 0.537952 0.255529 Y\n0.386931 0.462049 0.744472 Y\n0.500000 0.500000 0.500001 Rh\n0.950966 0.311783 0.594043 I\n0.049033 0.688217 0.405958 I\n0.290352 0.769047 0.859230 I\n0.709648 0.230953 0.140772 I\n0.866433 0.964200 0.777381 I\n0.229265 0.409882 0.031914 I\n0.411291 0.127018 0.685312 I\n0.133567 0.035800 0.222620 I\n0.770735 0.590118 0.968087 I\n0.588708 0.872982 0.314689 I\n",
"nsites": 17,
"nelements": 3,
"elements": [
"Y",
"Rh",
"I"
],
"chemical_system": "I-Rh-Y",
"density": 5.0477611096767125,
"density_atomic": 0.027121631247451292,
"volume": 626.8059559137891,
"volume_molar": 22.204198210112896,
"formula_full": "Y6 Rh1 I10",
"formula_reduced": "Y6RhI10",
"formula_anonymous": "AB6C10",
"energy_above_hull": 1.1853010852941177,
"spacegroup": 2
},
{
"id": "jvasp-107808",
"created_at": "2022-09-04T14:36:34.558340Z",
"updated_at": "2022-09-04T14:36:34.558368Z",
"structure_string": "K2 Tl1 As1 Br6\n1.0\n6.970426 -0.000000 4.024377\n2.323475 6.571781 4.024377\n-0.000000 -0.000000 8.048755\nK Tl As Br\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500001 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 As\n0.766396 0.233605 0.233605 Br\n0.233605 0.233605 0.766395 Br\n0.233606 0.766395 0.766395 Br\n0.233606 0.766395 0.233605 Br\n0.766396 0.233605 0.766395 Br\n0.766396 0.766395 0.233605 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Tl",
"As",
"Br"
],
"chemical_system": "As-Br-K-Tl",
"density": 3.769335429338987,
"density_atomic": 0.027122448216691766,
"volume": 368.69827974621313,
"volume_molar": 22.20352938601553,
"formula_full": "K2 Tl1 As1 Br6",
"formula_reduced": "K2TlAsBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}