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=volume&page=3468",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume&page=3466",
"results": [
{
"id": "jvasp-92179",
"created_at": "2022-09-04T14:36:00.366067Z",
"updated_at": "2022-09-04T14:36:00.366091Z",
"structure_string": "Sr2 Mg6\n1.0\n5.425181 0.000000 0.000000\n0.000000 5.425181 -0.000000\n0.000000 0.000000 7.667684\nSr Mg\n2 6\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Sr\n0.500000 0.500000 0.000000 Mg\n0.500000 0.000000 0.250000 Mg\n0.000000 0.500000 0.250000 Mg\n0.000000 0.000000 0.500000 Mg\n0.000000 0.500000 0.750000 Mg\n0.500000 0.000000 0.750000 Mg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sr",
"Mg"
],
"chemical_system": "Mg-Sr",
"density": 2.362414800605654,
"density_atomic": 0.035448455396445776,
"volume": 225.67979085492442,
"volume_molar": 16.988443340196447,
"formula_full": "Sr2 Mg6",
"formula_reduced": "SrMg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1077207352941176,
"spacegroup": 225
},
{
"id": "jvasp-66178",
"created_at": "2022-09-04T14:36:09.467850Z",
"updated_at": "2022-09-04T14:36:09.467866Z",
"structure_string": "Ba4 Si1 Se1\n1.0\n-0.000000 4.832323 4.832323\n4.832323 0.000000 4.832323\n4.832323 4.832323 0.000000\nBa Si Se\n4 1 1\ndirect\n0.125622 0.624792 0.624792 Ba\n0.624792 0.624792 0.624792 Ba\n0.624792 0.125622 0.624792 Ba\n0.624792 0.624792 0.125622 Ba\n0.000000 0.000000 0.000000 Si\n0.250000 0.250000 0.250000 Se\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Si",
"Se"
],
"chemical_system": "Ba-Se-Si",
"density": 4.829353996047868,
"density_atomic": 0.026586023739450664,
"volume": 225.6824886188857,
"volume_molar": 22.6515285588338,
"formula_full": "Ba4 Si1 Se1",
"formula_reduced": "Ba4SiSe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.6825326411111109,
"spacegroup": 216
},
{
"id": "jvasp-99060",
"created_at": "2022-09-04T14:35:49.060420Z",
"updated_at": "2022-09-04T14:35:49.060448Z",
"structure_string": "Rb1 In1 Mo2 O8\n1.0\n5.886888 -0.000000 -0.000000\n-2.943444 5.098195 0.000000\n-0.000000 -0.000000 7.520296\nRb In Mo O\n1 1 2 8\ndirect\n0.000000 0.000000 0.500000 Rb\n0.000000 0.000000 0.000000 In\n0.666668 0.333333 0.750773 Mo\n0.333334 0.666668 0.249227 Mo\n0.333592 0.166796 0.825588 O\n0.833204 0.166796 0.825588 O\n0.833205 0.666409 0.825588 O\n0.166797 0.833205 0.174412 O\n0.333334 0.666668 0.479638 O\n0.666668 0.333333 0.520363 O\n0.166797 0.333592 0.174412 O\n0.666410 0.833205 0.174412 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Rb",
"In",
"Mo",
"O"
],
"chemical_system": "In-Mo-O-Rb",
"density": 3.82692308520142,
"density_atomic": 0.05316723746241812,
"volume": 225.70290601392145,
"volume_molar": 11.326788916307379,
"formula_full": "Rb1 In1 Mo2 O8",
"formula_reduced": "RbIn(MoO4)2",
"formula_anonymous": "ABC2D8",
"energy_above_hull": 2.8572924808333333,
"spacegroup": 164
},
{
"id": "jvasp-54817",
"created_at": "2022-09-04T14:37:29.146128Z",
"updated_at": "2022-09-04T14:37:29.146154Z",
"structure_string": "Y4 Re8\n1.0\n2.713324 -4.699616 -0.000000\n2.713324 4.699616 0.000000\n0.000000 0.000000 8.850290\nY Re\n4 8\ndirect\n0.666666 0.333332 0.437639 Y\n0.333332 0.666666 0.562361 Y\n0.333332 0.666666 0.937639 Y\n0.666666 0.333332 0.062361 Y\n0.829013 0.170985 0.750000 Re\n0.341973 0.170986 0.750000 Re\n0.170986 0.341973 0.250000 Re\n0.170985 0.829013 0.250000 Re\n0.829012 0.658026 0.750000 Re\n0.000000 0.000000 0.000000 Re\n0.658026 0.829012 0.250000 Re\n0.000000 0.000000 0.500000 Re\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Y",
"Re"
],
"chemical_system": "Re-Y",
"density": 13.575620960215847,
"density_atomic": 0.05316547750226577,
"volume": 225.71037755634924,
"volume_molar": 11.327163871975667,
"formula_full": "Y4 Re8",
"formula_reduced": "YRe2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.872043816666667,
"spacegroup": 194
},
{
"id": "jvasp-104162",
"created_at": "2022-09-04T14:36:55.764179Z",
"updated_at": "2022-09-04T14:36:55.764197Z",
"structure_string": "H4 C6 S4 O2\n1.0\n4.572835 0.069617 0.197336\n0.399750 4.365272 0.403492\n0.134288 0.327906 11.358341\nH C S O\n4 6 4 2\ndirect\n0.280102 0.197369 0.865942 H\n0.780116 0.197376 0.365941 H\n0.531540 0.335758 0.753147 H\n0.031549 0.335766 0.253145 H\n0.152162 0.653308 0.784805 C\n0.652173 0.653315 0.284805 C\n0.662900 0.167757 0.189016 C\n0.162891 0.167750 0.689016 C\n0.295166 0.331399 0.778250 C\n0.795176 0.331406 0.278248 C\n0.455431 0.310634 0.082292 S\n0.955425 0.310628 0.582292 S\n0.888568 0.750285 0.880350 S\n0.388579 0.750290 0.380350 S\n0.272333 0.851131 0.699490 O\n0.772342 0.851139 0.199489 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"H",
"C",
"S",
"O"
],
"chemical_system": "C-H-O-S",
"density": 1.7387420960207782,
"density_atomic": 0.07088293648881436,
"volume": 225.7242827760793,
"volume_molar": 8.495896273922456,
"formula_full": "H4 C6 S4 O2",
"formula_reduced": "H2C3S2O",
"formula_anonymous": "AB2C2D3",
"energy_above_hull": 4.2868666875,
"spacegroup": 1
},
{
"id": "jvasp-66642",
"created_at": "2022-09-04T14:35:45.886612Z",
"updated_at": "2022-09-04T14:35:45.886644Z",
"structure_string": "Ba4 Zn1 Pt1\n1.0\n0.000000 4.832662 4.832662\n4.832662 -0.000000 4.832662\n4.832662 4.832662 0.000000\nBa Zn Pt\n4 1 1\ndirect\n0.127712 0.624096 0.624096 Ba\n0.624096 0.624096 0.624096 Ba\n0.624096 0.127712 0.624096 Ba\n0.624096 0.624096 0.127712 Ba\n0.000000 0.000000 0.000000 Zn\n0.250000 0.250000 0.250000 Pt\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"Pt"
],
"chemical_system": "Ba-Pt-Zn",
"density": 5.957144662452515,
"density_atomic": 0.026580429288703734,
"volume": 225.7299885878783,
"volume_molar": 22.656296083823282,
"formula_full": "Ba4 Zn1 Pt1",
"formula_reduced": "Ba4ZnPt",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.1016276133333332,
"spacegroup": 216
},
{
"id": "jvasp-97457",
"created_at": "2022-09-04T14:35:43.729317Z",
"updated_at": "2022-09-04T14:35:43.729335Z",
"structure_string": "Fe4 Bi4 O12\n1.0\n5.422999 -0.003290 0.000000\n0.003252 5.422615 0.000000\n0.000000 0.000000 7.676353\nFe Bi O\n4 4 12\ndirect\n0.000001 0.500001 0.250000 Fe\n0.499998 -0.000000 0.750000 Fe\n-0.000002 0.500000 0.750000 Fe\n0.500002 0.000000 0.250000 Fe\n0.500000 0.500000 0.500000 Bi\n0.500000 0.500000 0.000000 Bi\n0.000000 0.000000 0.000000 Bi\n0.000000 0.000000 0.500000 Bi\n0.749992 0.749995 0.250000 O\n0.750008 0.750007 0.750000 O\n0.749989 0.250005 0.750000 O\n0.249989 0.750005 0.750000 O\n0.500000 0.000000 0.500000 O\n-0.000000 0.500000 0.500000 O\n0.750011 0.249996 0.250000 O\n-0.000000 0.500000 0.000000 O\n0.250008 0.250006 0.750000 O\n0.250011 0.749996 0.250000 O\n0.500000 0.000000 0.000000 O\n0.249992 0.249994 0.250000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Fe",
"Bi",
"O"
],
"chemical_system": "Bi-Fe-O",
"density": 9.204606081410567,
"density_atomic": 0.08859854800239236,
"volume": 225.7373337479521,
"volume_molar": 6.79710999308633,
"formula_full": "Fe4 Bi4 O12",
"formula_reduced": "FeBiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.20887806,
"spacegroup": 221
},
{
"id": "jvasp-47056",
"created_at": "2022-09-04T14:36:52.471173Z",
"updated_at": "2022-09-04T14:36:52.471194Z",
"structure_string": "Co4 Sn4 O12\n1.0\n5.354139 0.000057 0.000173\n-0.000075 5.411343 0.000120\n-0.000146 0.000046 7.791577\nCo Sn O\n4 4 12\ndirect\n0.025159 0.985694 0.750025 Co\n0.525154 0.514311 0.750000 Co\n0.474818 0.485721 0.250016 Co\n0.974826 0.014280 0.250006 Co\n0.499991 0.000014 0.000007 Sn\n0.500002 0.000004 0.499999 Sn\n0.999985 0.499998 0.000006 Sn\n-0.000001 0.499985 0.500002 Sn\n0.165003 0.837043 0.069204 O\n0.665040 0.662977 0.430783 O\n0.665025 0.662988 0.069237 O\n0.902367 0.628722 0.750000 O\n0.097616 0.371254 0.250001 O\n0.835017 0.162929 0.569202 O\n0.334996 0.337037 0.569210 O\n0.834965 0.162982 0.930774 O\n0.165063 0.836991 0.430746 O\n0.597618 0.128749 0.250001 O\n0.334972 0.337050 0.930784 O\n0.402370 0.871281 0.750001 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Co",
"Sn",
"O"
],
"chemical_system": "Co-O-Sn",
"density": 6.63907833717252,
"density_atomic": 0.08859514513490842,
"volume": 225.74600413538423,
"volume_molar": 6.79737106455413,
"formula_full": "Co4 Sn4 O12",
"formula_reduced": "CoSnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.07238462,
"spacegroup": 62
},
{
"id": "jvasp-63941",
"created_at": "2022-09-04T14:36:07.729585Z",
"updated_at": "2022-09-04T14:36:07.729617Z",
"structure_string": "Ba4 Pt1 Cl1\n1.0\n0.000000 4.832791 4.832791\n4.832791 0.000000 4.832791\n4.832791 4.832791 0.000000\nBa Pt Cl\n4 1 1\ndirect\n0.124604 0.625132 0.625132 Ba\n0.625132 0.625132 0.625132 Ba\n0.625132 0.124604 0.625132 Ba\n0.625132 0.625132 0.124604 Ba\n0.000000 0.000000 0.000000 Pt\n0.250000 0.250000 0.250000 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Pt",
"Cl"
],
"chemical_system": "Ba-Cl-Pt",
"density": 5.736319756495394,
"density_atomic": 0.026578300839209465,
"volume": 225.7480655478374,
"volume_molar": 22.658110450446387,
"formula_full": "Ba4 Pt1 Cl1",
"formula_reduced": "Ba4PtCl",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.3444315579166666,
"spacegroup": 216
},
{
"id": "jvasp-93177",
"created_at": "2022-09-04T14:36:19.741391Z",
"updated_at": "2022-09-04T14:36:19.741416Z",
"structure_string": "K1 Mg6 Bi1\n1.0\n7.534954 -0.571037 0.000000\n-4.262009 6.239942 0.000000\n0.000000 0.000000 5.063686\nK Mg Bi\n1 6 1\ndirect\n0.203209 0.296791 0.250000 K\n0.160079 0.792156 0.250000 Mg\n0.707843 0.339920 0.250000 Mg\n0.631169 0.868829 0.250000 Mg\n0.312145 0.676719 0.750001 Mg\n0.823280 0.187854 0.750001 Mg\n0.788166 0.711832 0.750001 Mg\n0.374108 0.125892 0.750001 Bi\n",
"nsites": 8,
"nelements": 3,
"elements": [
"K",
"Mg",
"Bi"
],
"chemical_system": "Bi-K-Mg",
"density": 2.8973418472671693,
"density_atomic": 0.035436029597947026,
"volume": 225.75892645894723,
"volume_molar": 16.994400412028355,
"formula_full": "K1 Mg6 Bi1",
"formula_reduced": "KMg6Bi",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-23427",
"created_at": "2022-09-04T14:37:34.017873Z",
"updated_at": "2022-09-04T14:37:34.017890Z",
"structure_string": "As8 Pd4\n1.0\n6.089050 -0.000000 -0.000000\n0.000000 6.089050 0.000000\n-0.000000 0.000000 6.089050\nAs Pd\n8 4\ndirect\n0.383158 0.116842 0.883158 As\n0.116842 0.883158 0.383158 As\n0.883158 0.383158 0.116842 As\n0.616842 0.616842 0.616842 As\n0.383158 0.383158 0.383158 As\n0.116842 0.616842 0.883158 As\n0.883158 0.116842 0.616842 As\n0.616842 0.883158 0.116842 As\n0.000000 0.500000 0.500000 Pd\n0.500000 0.500000 0.000000 Pd\n0.500000 0.000000 0.500000 Pd\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 12,
"nelements": 2,
"elements": [
"As",
"Pd"
],
"chemical_system": "As-Pd",
"density": 7.539572348031456,
"density_atomic": 0.05315359282847469,
"volume": 225.76084440281767,
"volume_molar": 11.329696525751883,
"formula_full": "As8 Pd4",
"formula_reduced": "As2Pd",
"formula_anonymous": "AB2",
"energy_above_hull": 1.7661697333333333,
"spacegroup": 205
},
{
"id": "jvasp-19024",
"created_at": "2022-09-04T14:37:10.143533Z",
"updated_at": "2022-09-04T14:37:10.143557Z",
"structure_string": "Mg6 Te2 O12\n1.0\n6.089003 0.006937 -0.084371\n-0.085643 6.088406 -0.084371\n0.006832 0.006936 6.089584\nMg Te O\n6 2 12\ndirect\n0.751570 0.936055 0.446354 Mg\n0.553646 0.248431 0.063946 Mg\n0.063947 0.553646 0.248430 Mg\n0.248430 0.063947 0.553645 Mg\n0.936053 0.446356 0.751570 Mg\n0.446354 0.751571 0.936053 Mg\n0.500000 0.500001 0.500000 Te\n0.000000 0.000000 0.000000 Te\n0.697601 0.929211 0.075149 O\n0.070791 0.924852 0.302399 O\n0.408153 0.544308 0.197068 O\n0.075149 0.697602 0.929209 O\n0.929209 0.075150 0.697601 O\n0.802932 0.591848 0.455692 O\n0.455692 0.802933 0.591847 O\n0.591846 0.455694 0.802931 O\n0.197068 0.408154 0.544307 O\n0.544307 0.197069 0.408153 O\n0.302399 0.070791 0.924850 O\n0.924851 0.302400 0.070790 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Mg",
"Te",
"O"
],
"chemical_system": "Mg-O-Te",
"density": 4.361766528430244,
"density_atomic": 0.08858739328585966,
"volume": 225.76575806291848,
"volume_molar": 6.797965869215,
"formula_full": "Mg6 Te2 O12",
"formula_reduced": "Mg3TeO6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 1.3023995916666664,
"spacegroup": 148
}
]
}