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=535",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=533",
"results": [
{
"id": "jvasp-79083",
"created_at": "2022-09-04T14:36:38.361727Z",
"updated_at": "2022-09-04T14:36:38.361748Z",
"structure_string": "Li1 Mg2 Pd1\n1.0\n0.000000 3.227126 3.227126\n3.227126 0.000000 3.227126\n3.227126 3.227126 0.000000\nLi Mg Pd\n1 2 1\ndirect\n0.249999 0.249999 0.249999 Li\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.750001 0.750001 0.750001 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Mg",
"Pd"
],
"chemical_system": "Li-Mg-Pd",
"density": 4.001368954873066,
"density_atomic": 0.059508941939648535,
"volume": 67.21678910131912,
"volume_molar": 10.119724135084441,
"formula_full": "Li1 Mg2 Pd1",
"formula_reduced": "LiMg2Pd",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.03986845,
"spacegroup": 225
},
{
"id": "jvasp-7774",
"created_at": "2022-09-04T14:37:02.701244Z",
"updated_at": "2022-09-04T14:37:02.701263Z",
"structure_string": "Cd2 O2\n1.0\n1.830706 -3.170876 0.000000\n1.830706 3.170876 0.000000\n0.000000 0.000000 5.781627\nCd O\n2 2\ndirect\n0.666668 0.333334 0.500653 Cd\n0.333334 0.666668 0.000653 Cd\n0.666668 0.333334 0.114448 O\n0.333334 0.666668 0.614448 O\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cd",
"O"
],
"chemical_system": "Cd-O",
"density": 6.353329252554889,
"density_atomic": 0.059591190537111,
"volume": 67.1240155457032,
"volume_molar": 10.105756749816324,
"formula_full": "Cd2 O2",
"formula_reduced": "CdO",
"formula_anonymous": "AB",
"energy_above_hull": 0.0398858750000002,
"spacegroup": 186
},
{
"id": "jvasp-122726",
"created_at": "2022-09-04T14:38:55.024903Z",
"updated_at": "2022-09-04T14:38:55.024939Z",
"structure_string": "Yb1 Ga3\n1.0\n5.618954 -0.837017 -0.810666\n-3.452236 4.511685 0.810666\n-0.843017 0.497073 4.157473\nYb Ga\n1 3\ndirect\n0.063011 0.936984 0.936860 Yb\n0.436535 0.563462 0.321910 Ga\n0.812357 0.187641 0.179030 Ga\n0.688089 0.311907 0.562199 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Yb",
"Ga"
],
"chemical_system": "Ga-Yb",
"density": 7.052066757498073,
"density_atomic": 0.044445357045225425,
"volume": 89.99815202136402,
"volume_molar": 13.549538490313317,
"formula_full": "Yb1 Ga3",
"formula_reduced": "YbGa3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0399212499999999,
"spacegroup": 8
},
{
"id": "jvasp-14574",
"created_at": "2022-09-04T14:36:36.936236Z",
"updated_at": "2022-09-04T14:36:36.936251Z",
"structure_string": "Er1 Se1\n1.0\n3.483478 0.000000 2.011187\n1.161159 3.284255 2.011187\n0.000000 0.000000 4.022375\nEr Se\n1 1\ndirect\n0.000000 0.000000 0.000000 Er\n0.500000 0.500001 0.500000 Se\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Er",
"Se"
],
"chemical_system": "Er-Se",
"density": 8.884605770631346,
"density_atomic": 0.04346077806045853,
"volume": 46.01850425268017,
"volume_molar": 13.856495508714929,
"formula_full": "Er1 Se1",
"formula_reduced": "ErSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.0399566833333333,
"spacegroup": 225
},
{
"id": "jvasp-30194",
"created_at": "2022-09-04T14:38:13.034590Z",
"updated_at": "2022-09-04T14:38:13.034604Z",
"structure_string": "Tm2 Br2 O2\n1.0\n3.776839 0.000000 0.000000\n0.000000 3.776839 0.000000\n0.000000 0.000000 8.322123\nTm Br O\n2 2 2\ndirect\n0.000000 0.500000 0.134026 Tm\n0.500000 0.000000 0.865974 Tm\n0.000000 0.500000 0.669065 Br\n0.500000 0.000000 0.330934 Br\n0.000000 0.000000 0.000000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tm",
"Br",
"O"
],
"chemical_system": "Br-O-Tm",
"density": 7.409137912726392,
"density_atomic": 0.05054290223670678,
"volume": 118.71103032232487,
"volume_molar": 11.914908906094476,
"formula_full": "Tm2 Br2 O2",
"formula_reduced": "TmBrO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0400506183333333,
"spacegroup": 129
},
{
"id": "jvasp-119930",
"created_at": "2022-09-04T14:38:53.930154Z",
"updated_at": "2022-09-04T14:38:53.930181Z",
"structure_string": "Ba1 Ca1 Br1\n1.0\n3.962649 0.000000 -0.000000\n0.000000 3.962649 0.000000\n-0.000000 0.000000 9.689887\nBa Ca Br\n1 1 1\ndirect\n0.000000 0.000000 0.422571 Ba\n0.000000 0.000000 0.021687 Ca\n0.000000 0.000000 0.740900 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Ca",
"Br"
],
"chemical_system": "Ba-Br-Ca",
"density": 2.8081102255315127,
"density_atomic": 0.01971656846856131,
"volume": 152.1562945795357,
"volume_molar": 30.54355411593297,
"formula_full": "Ba1 Ca1 Br1",
"formula_reduced": "BaCaBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0400833333333332,
"spacegroup": 99
},
{
"id": "jvasp-64379",
"created_at": "2022-09-04T14:35:47.778460Z",
"updated_at": "2022-09-04T14:35:47.778482Z",
"structure_string": "Ba4 Tl1 Te1\n1.0\n-0.000000 5.030489 5.030489\n5.030489 -0.000000 5.030489\n5.030489 5.030489 0.000000\nBa Tl Te\n4 1 1\ndirect\n0.127783 0.624072 0.624072 Ba\n0.624072 0.624072 0.624072 Ba\n0.624072 0.127783 0.624072 Ba\n0.624072 0.624072 0.127783 Ba\n0.000000 0.000000 0.000000 Tl\n0.250000 0.250000 0.250000 Te\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Te"
],
"chemical_system": "Ba-Te-Tl",
"density": 5.747883718038621,
"density_atomic": 0.023566258852733113,
"volume": 254.6012940575057,
"volume_molar": 25.554080508207512,
"formula_full": "Ba4 Tl1 Te1",
"formula_reduced": "Ba4TlTe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0401369899999999,
"spacegroup": 216
},
{
"id": "jvasp-63959",
"created_at": "2022-09-04T14:35:54.480647Z",
"updated_at": "2022-09-04T14:35:54.480666Z",
"structure_string": "Ba4 Ga1 Ge1\n1.0\n0.000000 4.938316 4.938316\n4.938316 -0.000000 4.938316\n4.938316 4.938316 -0.000000\nBa Ga Ge\n4 1 1\ndirect\n0.123103 0.625633 0.625633 Ba\n0.625633 0.625633 0.625633 Ba\n0.625633 0.123103 0.625633 Ba\n0.625633 0.625633 0.123103 Ba\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ga",
"Ge"
],
"chemical_system": "Ba-Ga-Ge",
"density": 4.768502764886652,
"density_atomic": 0.024910625029403093,
"volume": 240.86107807082075,
"volume_molar": 24.1749885957972,
"formula_full": "Ba4 Ga1 Ge1",
"formula_reduced": "Ba4GaGe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0402279849999999,
"spacegroup": 216
},
{
"id": "jvasp-118314",
"created_at": "2022-09-04T14:38:51.164477Z",
"updated_at": "2022-09-04T14:38:51.164504Z",
"structure_string": "Sr1 O1 F2\n1.0\n3.612797 -0.000000 -0.000000\n0.000000 3.612797 -0.000000\n-0.000000 0.000000 4.717046\nSr O F\n1 1 2\ndirect\n0.500001 0.500001 0.502597 Sr\n0.000000 0.000000 0.002395 O\n0.000000 0.000000 0.502402 F\n0.500001 0.500001 0.002607 F\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"O",
"F"
],
"chemical_system": "F-O-Sr",
"density": 3.8194851263494183,
"density_atomic": 0.06496848815334853,
"volume": 61.56830970975636,
"volume_molar": 9.269325685685688,
"formula_full": "Sr1 O1 F2",
"formula_reduced": "SrOF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0402425706249999,
"spacegroup": 123
},
{
"id": "jvasp-68999",
"created_at": "2022-09-04T14:36:17.726285Z",
"updated_at": "2022-09-04T14:36:17.726310Z",
"structure_string": "Ba1 La1 In2\n1.0\n4.085768 0.000000 -0.000000\n0.000000 4.085768 0.000000\n0.000000 0.000000 8.224687\nBa La In\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ba\n0.500000 0.500000 0.000000 La\n0.000000 0.000000 0.780441 In\n0.000000 0.000000 0.219559 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"La",
"In"
],
"chemical_system": "Ba-In-La",
"density": 6.118147233486001,
"density_atomic": 0.029133536504609512,
"volume": 137.29881366675548,
"volume_molar": 20.67081955205533,
"formula_full": "Ba1 La1 In2",
"formula_reduced": "BaLaIn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0402852274999999,
"spacegroup": 123
},
{
"id": "jvasp-25060",
"created_at": "2022-09-04T14:37:53.808948Z",
"updated_at": "2022-09-04T14:37:53.808962Z",
"structure_string": "Pr2\n1.0\n3.694323 -0.000000 -0.000000\n-1.847161 3.200095 0.000000\n-0.000000 -0.000000 6.042609\nPr\n2\ndirect\n0.166551 0.333102 0.250000 Pr\n0.833449 0.666899 0.750000 Pr\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Pr"
],
"chemical_system": "Pr",
"density": 6.550756205143149,
"density_atomic": 0.027996759555246584,
"volume": 71.43683882605623,
"volume_molar": 21.51013494299719,
"formula_full": "Pr2",
"formula_reduced": "Pr",
"formula_anonymous": "A",
"energy_above_hull": 0.0402999999999997,
"spacegroup": 194
},
{
"id": "jvasp-96887",
"created_at": "2022-09-04T14:36:20.926823Z",
"updated_at": "2022-09-04T14:36:20.926843Z",
"structure_string": "Na2 Ge2 Au2\n1.0\n4.112563 -0.000000 1.741044\n1.962038 5.278667 1.093137\n-0.003733 0.032189 5.736534\nNa Ge Au\n2 2 2\ndirect\n0.282917 0.217083 0.217083 Na\n0.405648 0.594353 0.594352 Na\n0.676949 0.001284 0.644817 Ge\n0.676948 0.644819 0.001284 Ge\n-0.000161 0.205820 0.794502 Au\n-0.000161 0.794503 0.205820 Au\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Na",
"Ge",
"Au"
],
"chemical_system": "Au-Ge-Na",
"density": 7.803027275500117,
"density_atomic": 0.048179955599907856,
"volume": 124.53311600834009,
"volume_molar": 12.499265898060555,
"formula_full": "Na2 Ge2 Au2",
"formula_reduced": "NaGeAu",
"formula_anonymous": "ABC",
"energy_above_hull": 0.04030084,
"spacegroup": 44
}
]
}