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=4392",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=4390",
"results": [
{
"id": "jvasp-68168",
"created_at": "2022-09-04T14:36:14.419393Z",
"updated_at": "2022-09-04T14:36:14.419413Z",
"structure_string": "Be1 Zn2 Sn1\n1.0\n-2.046464 2.046464 4.016121\n2.046464 -2.046464 4.016121\n2.046464 2.046464 -4.016121\nBe Zn Sn\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Be\n0.000000 0.000000 0.000000 Zn\n0.250000 0.749999 0.499999 Zn\n0.749999 0.250000 0.499999 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Zn",
"Sn"
],
"chemical_system": "Be-Sn-Zn",
"density": 6.381196948645145,
"density_atomic": 0.059454535783228644,
"volume": 67.27829840576013,
"volume_molar": 10.128984577319278,
"formula_full": "Be1 Zn2 Sn1",
"formula_reduced": "BeZn2Sn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 119
},
{
"id": "jvasp-102955",
"created_at": "2022-09-04T14:36:35.002629Z",
"updated_at": "2022-09-04T14:36:35.002655Z",
"structure_string": "Li1 Zn1 Cu2\n1.0\n3.601380 0.000000 2.079258\n1.200460 3.395414 2.079258\n0.000000 -0.000000 4.158517\nLi Zn Cu\n1 1 2\ndirect\n0.500000 0.499999 0.500001 Li\n0.000000 0.000000 0.000000 Zn\n0.750000 0.749999 0.750002 Cu\n0.250000 0.250000 0.250001 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Zn",
"Cu"
],
"chemical_system": "Cu-Li-Zn",
"density": 6.512767183709852,
"density_atomic": 0.0786610658356081,
"volume": 50.85107807157743,
"volume_molar": 7.655808748619717,
"formula_full": "Li1 Zn1 Cu2",
"formula_reduced": "LiZnCu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-99381",
"created_at": "2022-09-04T14:36:14.431412Z",
"updated_at": "2022-09-04T14:36:14.431451Z",
"structure_string": "Rb2 Nd1 Ag1 Br6\n1.0\n6.932557 -0.000000 4.002514\n2.310852 6.536077 4.002514\n-0.000000 -0.000000 8.005027\nRb Nd Ag Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Nd\n0.000000 0.000000 0.000000 Ag\n0.752279 0.247722 0.247721 Br\n0.247721 0.247722 0.752279 Br\n0.247721 0.752279 0.752278 Br\n0.247721 0.752279 0.247721 Br\n0.752279 0.247722 0.752278 Br\n0.752279 0.752279 0.247721 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Nd",
"Ag",
"Br"
],
"chemical_system": "Ag-Br-Nd-Rb",
"density": 4.131505784545889,
"density_atomic": 0.027569354003743673,
"volume": 362.7215929195181,
"volume_molar": 21.843604892527573,
"formula_full": "Rb2 Nd1 Ag1 Br6",
"formula_reduced": "Rb2NdAgBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-65670",
"created_at": "2022-09-04T14:36:21.865158Z",
"updated_at": "2022-09-04T14:36:21.865182Z",
"structure_string": "Ba2 Ga1 Se1\n1.0\n0.000000 4.045055 4.045055\n4.045055 0.000000 4.045055\n4.045055 4.045055 0.000000\nBa Ga Se\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.749999 0.749999 0.749999 Ba\n0.000000 0.000000 0.000000 Ga\n0.499999 0.499999 0.499999 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Ga",
"Se"
],
"chemical_system": "Ba-Ga-Se",
"density": 5.310458711228051,
"density_atomic": 0.030217372797780716,
"volume": 132.37418179166707,
"volume_molar": 19.9293988934812,
"formula_full": "Ba2 Ga1 Se1",
"formula_reduced": "Ba2GaSe",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-94746",
"created_at": "2022-09-04T14:36:11.138551Z",
"updated_at": "2022-09-04T14:36:11.138564Z",
"structure_string": "Mg6 Al1 Cd1\n1.0\n6.239797 -0.022038 0.000000\n-3.138983 5.392803 0.000000\n0.000000 0.000000 5.151614\nMg Al Cd\n6 1 1\ndirect\n0.163858 0.838572 0.250000 Mg\n0.661428 0.336142 0.250000 Mg\n0.665575 0.834424 0.250000 Mg\n0.334747 0.658387 0.749999 Mg\n0.841613 0.165252 0.749999 Mg\n0.834057 0.665943 0.749999 Mg\n0.158443 0.341557 0.250000 Al\n0.340281 0.159719 0.749999 Cd\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Al",
"Cd"
],
"chemical_system": "Al-Cd-Mg",
"density": 2.7377786903018775,
"density_atomic": 0.04624399945207979,
"volume": 172.99541767121542,
"volume_molar": 13.022534450638133,
"formula_full": "Mg6 Al1 Cd1",
"formula_reduced": "Mg6AlCd",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-69110",
"created_at": "2022-09-04T14:36:11.878640Z",
"updated_at": "2022-09-04T14:36:11.878668Z",
"structure_string": "Ba1 Sr1 Ca2\n1.0\n4.595800 0.000000 0.000000\n0.000000 4.627287 0.000000\n0.000000 0.000000 9.015077\nBa Sr Ca\n1 1 2\ndirect\n0.500000 0.500000 0.764988 Ba\n0.000000 0.000000 0.477644 Sr\n0.000000 0.000000 0.022254 Ca\n0.500000 0.500000 0.235114 Ca\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Sr",
"Ca"
],
"chemical_system": "Ba-Ca-Sr",
"density": 2.6426434869189115,
"density_atomic": 0.020864260347781004,
"volume": 191.71539912390978,
"volume_molar": 28.863427984594132,
"formula_full": "Ba1 Sr1 Ca2",
"formula_reduced": "BaSrCa2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-91731",
"created_at": "2022-09-04T14:36:14.438088Z",
"updated_at": "2022-09-04T14:36:14.438108Z",
"structure_string": "Sc2 F6\n1.0\n4.815510 0.123325 2.953807\n1.713681 4.501960 2.953806\n0.174089 0.123325 5.646575\nSc F\n2 6\ndirect\n0.500000 0.500001 0.500001 Sc\n0.000000 0.000000 0.000000 Sc\n0.642806 0.250002 0.857195 F\n0.250000 0.857195 0.642807 F\n0.857193 0.642807 0.250001 F\n0.357194 0.750001 0.142807 F\n0.750000 0.142807 0.357194 F\n0.142806 0.357195 0.750001 F\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sc",
"F"
],
"chemical_system": "F-Sc",
"density": 2.8733183943885883,
"density_atomic": 0.06788950451442607,
"volume": 117.83853862565829,
"volume_molar": 8.870503331955138,
"formula_full": "Sc2 F6",
"formula_reduced": "ScF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 167
},
{
"id": "jvasp-69311",
"created_at": "2022-09-04T14:36:14.445685Z",
"updated_at": "2022-09-04T14:36:14.445712Z",
"structure_string": "Ba1 Ca2 Mg1\n1.0\n4.232383 0.000000 0.000000\n0.000000 4.233321 0.000000\n0.000000 0.000000 9.010536\nBa Ca Mg\n1 2 1\ndirect\n0.500000 0.500000 0.717344 Ba\n0.000000 0.000000 0.032846 Ca\n0.500000 0.500000 0.284467 Ca\n0.000000 0.000000 0.465344 Mg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Ca",
"Mg"
],
"chemical_system": "Ba-Ca-Mg",
"density": 2.486949988884265,
"density_atomic": 0.02477668519747403,
"volume": 161.44209639503342,
"volume_molar": 24.305675727009493,
"formula_full": "Ba1 Ca2 Mg1",
"formula_reduced": "BaCa2Mg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-57551",
"created_at": "2022-09-04T14:36:22.408865Z",
"updated_at": "2022-09-04T14:36:22.408884Z",
"structure_string": "Rb2 Co1 F4\n1.0\n3.956192 -0.000000 -1.146995\n-0.332541 3.942192 -1.146995\n0.020558 0.022365 7.467215\nRb Co F\n2 1 4\ndirect\n0.647000 0.646999 0.294000 Rb\n0.353000 0.352999 0.706000 Rb\n0.000000 0.000000 0.000000 Co\n0.500000 -0.000000 0.000000 F\n0.000000 0.500000 0.000000 F\n0.850802 0.850800 0.701605 F\n0.149198 0.149198 0.298395 F\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Rb",
"Co",
"F"
],
"chemical_system": "Co-F-Rb",
"density": 4.353566182514648,
"density_atomic": 0.06000231277096995,
"volume": 116.66216978534048,
"volume_molar": 10.036514397347705,
"formula_full": "Rb2 Co1 F4",
"formula_reduced": "Rb2CoF4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-105611",
"created_at": "2022-09-04T14:36:14.448957Z",
"updated_at": "2022-09-04T14:36:14.448983Z",
"structure_string": "K1 Rb2 Sc1 I6\n1.0\n7.485662 -0.000000 4.321849\n2.495221 7.057550 4.321849\n0.000000 0.000000 8.643699\nK Rb Sc I\n1 2 1 6\ndirect\n0.500000 0.500000 0.500000 K\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Sc\n0.765852 0.234148 0.234148 I\n0.234148 0.234148 0.765852 I\n0.234148 0.765852 0.765852 I\n0.234148 0.765852 0.234148 I\n0.765852 0.234148 0.765852 I\n0.765852 0.765852 0.234148 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Rb",
"Sc",
"I"
],
"chemical_system": "I-K-Rb-Sc",
"density": 3.6960432813141613,
"density_atomic": 0.021898591780243597,
"volume": 456.6503682223881,
"volume_molar": 27.50012795541052,
"formula_full": "K1 Rb2 Sc1 I6",
"formula_reduced": "KRb2ScI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-54988",
"created_at": "2022-09-04T14:37:11.735474Z",
"updated_at": "2022-09-04T14:37:11.735491Z",
"structure_string": "Ca12 Hg4\n1.0\n8.159607 0.000000 -2.884857\n-4.079803 7.066427 -2.884857\n-0.000000 -0.000000 8.654571\nCa Hg\n12 4\ndirect\n0.250000 0.500000 0.750000 Ca\n0.750001 0.500000 0.250000 Ca\n0.000000 0.250000 0.250000 Ca\n0.500000 0.250000 0.750000 Ca\n0.750000 0.000000 0.750000 Ca\n0.000000 0.750000 0.750000 Ca\n0.250000 0.000000 0.250000 Ca\n0.250000 0.250000 -0.000000 Ca\n0.250001 0.750000 0.500000 Ca\n0.500001 0.750000 0.250000 Ca\n0.750000 0.250000 0.500000 Ca\n0.750001 0.750000 -0.000000 Ca\n0.500000 0.000000 -0.000000 Hg\n0.000000 0.000000 0.500000 Hg\n0.000000 0.500000 -0.000000 Hg\n0.500000 0.500000 0.500000 Hg\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Ca",
"Hg"
],
"chemical_system": "Ca-Hg",
"density": 4.270328395020197,
"density_atomic": 0.03206308592265365,
"volume": 499.0162219131709,
"volume_molar": 18.782162061778198,
"formula_full": "Ca12 Hg4",
"formula_reduced": "Ca3Hg",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-93829",
"created_at": "2022-09-04T14:36:21.819536Z",
"updated_at": "2022-09-04T14:36:21.819545Z",
"structure_string": "Yb2 Sn2 Hg2\n1.0\n-2.409560 -4.173348 0.000000\n-2.409560 4.173348 0.000000\n0.000000 0.000000 -7.692973\nYb Sn Hg\n2 2 2\ndirect\n0.999995 0.000005 0.254123 Yb\n0.000005 0.999995 0.754123 Yb\n0.333330 0.666670 0.040021 Sn\n0.666670 0.333330 0.540021 Sn\n0.333330 0.666670 0.435856 Hg\n0.666670 0.333330 0.935856 Hg\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Yb",
"Sn",
"Hg"
],
"chemical_system": "Hg-Sn-Yb",
"density": 10.568118274543215,
"density_atomic": 0.03877972285795657,
"volume": 154.7200329919057,
"volume_molar": 15.529096951151667,
"formula_full": "Yb2 Sn2 Hg2",
"formula_reduced": "YbSnHg",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 186
}
]
}