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=620",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=618",
"results": [
{
"id": "jvasp-4183",
"created_at": "2022-09-04T14:37:19.134329Z",
"updated_at": "2022-09-04T14:37:19.134347Z",
"structure_string": "Be2 Cl4\n1.0\n4.739843 -0.000000 -2.221529\n-1.040164 4.508660 -2.219288\n-0.043697 0.059191 6.073985\nBe Cl\n2 4\ndirect\n0.250000 0.000000 -0.000000 Be\n0.750000 0.000000 -0.000000 Be\n0.613824 0.899542 0.227646 Cl\n0.386176 0.100458 0.772352 Cl\n0.113823 0.328105 0.227647 Cl\n0.886176 0.671895 0.772352 Cl\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Be",
"Cl"
],
"chemical_system": "Be-Cl",
"density": 2.0396910964815986,
"density_atomic": 0.04610955825112155,
"volume": 130.12486407531478,
"volume_molar": 13.060504130623547,
"formula_full": "Be2 Cl4",
"formula_reduced": "BeCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1047714116666665,
"spacegroup": 72
},
{
"id": "jvasp-106666",
"created_at": "2022-09-04T14:36:48.642691Z",
"updated_at": "2022-09-04T14:36:48.642711Z",
"structure_string": "Rb2 Na1 V1 Cl6\n1.0\n6.203744 -0.000000 3.581733\n2.067915 5.848946 3.581733\n-0.000000 -0.000000 7.163466\nRb Na V Cl\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.749999 0.750001 0.750000 Rb\n0.499999 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 V\n0.764707 0.235293 0.235293 Cl\n0.235292 0.764708 0.764707 Cl\n0.235292 0.764708 0.235293 Cl\n0.764707 0.235293 0.764707 Cl\n0.235292 0.235293 0.764708 Cl\n0.764706 0.764708 0.235293 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Na",
"V",
"Cl"
],
"chemical_system": "Cl-Na-Rb-V",
"density": 2.923250744768558,
"density_atomic": 0.038472048902217,
"volume": 259.92896883180396,
"volume_molar": 15.653288379067762,
"formula_full": "Rb2 Na1 V1 Cl6",
"formula_reduced": "Rb2NaVCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.1048717605,
"spacegroup": 225
},
{
"id": "jvasp-65626",
"created_at": "2022-09-04T14:36:09.357478Z",
"updated_at": "2022-09-04T14:36:09.357492Z",
"structure_string": "Ba1 Sb1 Br2\n1.0\n4.075670 0.000000 0.000000\n0.000000 5.357539 0.000000\n0.000000 0.000000 6.398463\nBa Sb Br\n1 1 2\ndirect\n0.500000 0.500000 0.750534 Ba\n0.000000 0.000000 0.540444 Sb\n0.000000 0.000000 0.962259 Br\n0.500000 0.500000 0.246762 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Sb",
"Br"
],
"chemical_system": "Ba-Br-Sb",
"density": 4.978680504254413,
"density_atomic": 0.028629909458025616,
"volume": 139.71402899001166,
"volume_molar": 21.034438718114274,
"formula_full": "Ba1 Sb1 Br2",
"formula_reduced": "BaSbBr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.104886051875,
"spacegroup": 25
},
{
"id": "jvasp-81768",
"created_at": "2022-09-04T14:37:08.025428Z",
"updated_at": "2022-09-04T14:37:08.025457Z",
"structure_string": "K1 Na2 P1\n1.0\n-13.132282 2.117919 -3.821353\n-8.603049 -0.221443 0.525086\n-7.026565 4.427199 -2.314908\nK Na P\n1 2 1\ndirect\n0.500000 0.000000 0.000000 K\n0.963372 0.857747 0.857719 Na\n0.036626 0.142255 0.142283 Na\n0.000000 0.000000 0.000000 P\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Na",
"P"
],
"chemical_system": "K-Na-P",
"density": 1.538041742428297,
"density_atomic": 0.031924777689114274,
"volume": 125.29452950157652,
"volume_molar": 18.863532327911663,
"formula_full": "K1 Na2 P1",
"formula_reduced": "KNa2P",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1049028750000001,
"spacegroup": 71
},
{
"id": "jvasp-80622",
"created_at": "2022-09-04T14:37:15.529173Z",
"updated_at": "2022-09-04T14:37:15.529211Z",
"structure_string": "Ca2 Zn1 Ge1\n1.0\n-10.266222 -0.000000 -5.927206\n-6.728371 -1.463225 -0.200533\n-4.975093 3.495791 -3.237297\nCa Zn Ge\n2 1 1\ndirect\n0.749883 -0.000001 -0.000000 Ca\n0.250117 -0.000000 -0.000000 Ca\n0.000000 0.000000 0.000000 Zn\n0.500000 -0.000001 -0.000000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Zn",
"Ge"
],
"chemical_system": "Ca-Ge-Zn",
"density": 2.859020081120677,
"density_atomic": 0.03156191905799649,
"volume": 126.73500596240092,
"volume_molar": 19.08040112812544,
"formula_full": "Ca2 Zn1 Ge1",
"formula_reduced": "Ca2ZnGe",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.104957605,
"spacegroup": 71
},
{
"id": "jvasp-105490",
"created_at": "2022-09-04T14:37:14.740884Z",
"updated_at": "2022-09-04T14:37:14.740905Z",
"structure_string": "In2 Bi1\n1.0\n7.232376 -0.239650 1.907918\n6.527981 3.242602 1.647865\n-0.042653 0.210860 3.555784\nIn Bi\n2 1\ndirect\n0.332066 0.332065 0.667934 In\n0.667935 0.667934 0.332066 In\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 3,
"nelements": 2,
"elements": [
"In",
"Bi"
],
"chemical_system": "Bi-In",
"density": 8.151905205140208,
"density_atomic": 0.03357734956410394,
"volume": 89.34594418396762,
"volume_molar": 17.93512840703188,
"formula_full": "In2 Bi1",
"formula_reduced": "In2Bi",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1051071444444444,
"spacegroup": 139
},
{
"id": "jvasp-2826",
"created_at": "2022-09-04T14:36:51.745026Z",
"updated_at": "2022-09-04T14:36:51.745043Z",
"structure_string": "Na2 Li2 S2\n1.0\n4.005547 0.000000 0.000000\n0.000000 4.005547 0.000000\n0.000000 0.000000 6.495466\nNa Li S\n2 2 2\ndirect\n0.500000 0.000000 0.648542 Na\n0.000000 0.500000 0.351458 Na\n0.500000 0.500000 0.000000 Li\n0.000000 0.000000 0.000000 Li\n0.500000 0.000000 0.216553 S\n0.000000 0.500000 0.783447 S\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Na",
"Li",
"S"
],
"chemical_system": "Li-Na-S",
"density": 1.975637079897881,
"density_atomic": 0.05757278953760867,
"volume": 104.21589865956692,
"volume_molar": 10.46004685263012,
"formula_full": "Na2 Li2 S2",
"formula_reduced": "NaLiS",
"formula_anonymous": "ABC",
"energy_above_hull": 0.105153,
"spacegroup": 129
},
{
"id": "jvasp-16447",
"created_at": "2022-09-04T14:37:53.780966Z",
"updated_at": "2022-09-04T14:37:53.780992Z",
"structure_string": "Lu1 Au1\n1.0\n3.504835 -0.000000 0.000000\n0.000000 3.504835 0.000000\n-0.000000 -0.000000 3.504835\nLu Au\n1 1\ndirect\n0.500001 0.500001 0.500001 Lu\n0.000000 0.000000 0.000000 Au\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Lu",
"Au"
],
"chemical_system": "Au-Lu",
"density": 14.345369649407615,
"density_atomic": 0.04645444375730387,
"volume": 43.05293182389138,
"volume_molar": 12.96354077870787,
"formula_full": "Lu1 Au1",
"formula_reduced": "LuAu",
"formula_anonymous": "AB",
"energy_above_hull": 0.10522666,
"spacegroup": 221
},
{
"id": "jvasp-101396",
"created_at": "2022-09-04T14:36:32.842585Z",
"updated_at": "2022-09-04T14:36:32.842611Z",
"structure_string": "Er2 Ga6\n1.0\n6.233400 -0.000000 0.000000\n-3.116701 5.398283 0.000000\n-0.000000 0.000000 4.516705\nEr Ga\n2 6\ndirect\n0.333333 0.666667 0.750001 Er\n0.666667 0.333333 0.250000 Er\n0.149946 0.299890 0.250000 Ga\n0.700110 0.850054 0.250000 Ga\n0.149945 0.850054 0.250000 Ga\n0.850054 0.700109 0.750001 Ga\n0.299890 0.149946 0.750001 Ga\n0.850054 0.149946 0.750001 Ga\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Er",
"Ga"
],
"chemical_system": "Er-Ga",
"density": 8.225430592435597,
"density_atomic": 0.0526365741723522,
"volume": 151.985575159298,
"volume_molar": 11.440981588735651,
"formula_full": "Er2 Ga6",
"formula_reduced": "ErGa3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1052324999999999,
"spacegroup": 194
},
{
"id": "jvasp-13951",
"created_at": "2022-09-04T14:37:43.504673Z",
"updated_at": "2022-09-04T14:37:43.504709Z",
"structure_string": "Ba2 Ag2 Bi2\n1.0\n2.895033 -5.014343 -0.000000\n2.895033 5.014343 0.000000\n-0.000000 -0.000000 6.993417\nBa Ag Bi\n2 2 2\ndirect\n0.333333 0.666666 0.750000 Ba\n0.666666 0.333333 0.250000 Ba\n0.000000 0.000000 0.000000 Ag\n0.000000 0.000000 0.500000 Ag\n0.333333 0.666666 0.250000 Bi\n0.666666 0.333333 0.750000 Bi\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ag",
"Bi"
],
"chemical_system": "Ag-Ba-Bi",
"density": 7.428752930566917,
"density_atomic": 0.02955046187064868,
"volume": 203.04251169622378,
"volume_molar": 20.3791764283101,
"formula_full": "Ba2 Ag2 Bi2",
"formula_reduced": "BaAgBi",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1052585933333333,
"spacegroup": 194
},
{
"id": "jvasp-50754",
"created_at": "2022-09-04T14:37:30.006043Z",
"updated_at": "2022-09-04T14:37:30.006051Z",
"structure_string": "Li6 Cu2 F10\n1.0\n6.078326 0.329806 -0.721749\n2.993384 5.300423 -0.721749\n-1.079335 -0.669874 6.673755\nLi Cu F\n6 2 10\ndirect\n0.055687 0.447156 0.170653 Li\n0.447146 0.055700 0.670648 Li\n0.511914 0.488087 0.250000 Li\n0.488078 0.511923 0.750000 Li\n0.552844 0.944313 0.329347 Li\n0.944301 0.552855 0.829353 Li\n-0.000002 0.000000 0.500002 Cu\n0.000000 0.000003 -0.000002 Cu\n0.830401 0.169600 0.250000 F\n0.461922 0.769263 0.456909 F\n0.266791 0.083548 0.133793 F\n0.733195 0.916463 0.866201 F\n0.916452 0.733210 0.366207 F\n0.169590 0.830410 0.750000 F\n0.230737 0.538078 0.043091 F\n0.769247 0.461938 0.956915 F\n0.538063 0.230754 0.543086 F\n0.083538 0.266806 0.633800 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Li",
"Cu",
"F"
],
"chemical_system": "Cu-F-Li",
"density": 2.9334660866252515,
"density_atomic": 0.08864340467944087,
"volume": 203.06079245368554,
"volume_molar": 6.793670416629112,
"formula_full": "Li6 Cu2 F10",
"formula_reduced": "Li3CuF5",
"formula_anonymous": "AB3C5",
"energy_above_hull": 0.1053311738888889,
"spacegroup": 15
},
{
"id": "jvasp-91751",
"created_at": "2022-09-04T14:36:03.145155Z",
"updated_at": "2022-09-04T14:36:03.145171Z",
"structure_string": "Ga4 Pd4\n1.0\n4.960168 0.000000 0.000000\n0.000000 4.960168 0.000000\n0.000000 0.000000 4.960168\nGa Pd\n4 4\ndirect\n0.407806 0.907807 0.592194 Ga\n0.907807 0.592194 0.407806 Ga\n0.592194 0.407806 0.907807 Ga\n0.092194 0.092194 0.092194 Ga\n0.109349 0.609350 0.890651 Pd\n0.609350 0.890651 0.109349 Pd\n0.890651 0.109349 0.609350 Pd\n0.390651 0.390651 0.390651 Pd\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ga",
"Pd"
],
"chemical_system": "Ga-Pd",
"density": 9.58705720904659,
"density_atomic": 0.06555424627376978,
"volume": 122.03633562637788,
"volume_molar": 9.186499887208129,
"formula_full": "Ga4 Pd4",
"formula_reduced": "GaPd",
"formula_anonymous": "AB",
"energy_above_hull": 0.1053440125000001,
"spacegroup": 198
}
]
}