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=125",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=123",
"results": [
{
"id": "jvasp-108847",
"created_at": "2022-09-04T14:38:19.531435Z",
"updated_at": "2022-09-04T14:38:19.531453Z",
"structure_string": "Na2 Ag1 Au1 Cl6\n1.0\n6.192582 -0.000000 3.575289\n2.064194 5.838422 3.575289\n-0.000000 -0.000000 7.150578\nNa Ag Au Cl\n2 1 1 6\ndirect\n0.749999 0.750000 0.750001 Na\n0.250000 0.250000 0.250000 Na\n0.500000 0.500000 0.500001 Ag\n0.000000 0.000000 0.000000 Au\n0.751337 0.248662 0.248663 Cl\n0.248662 0.248662 0.751338 Cl\n0.248662 0.751337 0.751339 Cl\n0.248662 0.751337 0.248663 Cl\n0.751337 0.248662 0.751338 Cl\n0.751337 0.751337 0.248663 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Na",
"Ag",
"Au",
"Cl"
],
"chemical_system": "Ag-Au-Cl-Na",
"density": 3.619591168470387,
"density_atomic": 0.03868045758031989,
"volume": 258.5284824833062,
"volume_molar": 15.568949119836644,
"formula_full": "Na2 Ag1 Au1 Cl6",
"formula_reduced": "Na2AgAuCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-64603",
"created_at": "2022-09-04T14:38:13.130841Z",
"updated_at": "2022-09-04T14:38:13.130865Z",
"structure_string": "Ba4 Mg1 Cd1\n1.0\n0.000000 5.163458 5.163458\n5.163458 0.000000 5.163458\n5.163458 5.163458 0.000000\nBa Mg Cd\n4 1 1\ndirect\n0.125787 0.624738 0.624738 Ba\n0.624738 0.624738 0.624738 Ba\n0.624738 0.125787 0.624738 Ba\n0.624738 0.624738 0.125787 Ba\n0.000000 0.000000 0.000000 Mg\n0.250000 0.250000 0.250000 Cd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Cd"
],
"chemical_system": "Ba-Cd-Mg",
"density": 4.13748531026891,
"density_atomic": 0.021792111301775684,
"volume": 275.32899024387336,
"volume_molar": 27.63449890928787,
"formula_full": "Ba4 Mg1 Cd1",
"formula_reduced": "Ba4MgCd",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-109853",
"created_at": "2022-09-04T14:38:19.042052Z",
"updated_at": "2022-09-04T14:38:19.042073Z",
"structure_string": "K2 As1 Au1 I6\n1.0\n7.099670 -0.000000 4.098996\n2.366557 6.693633 4.098996\n-0.000000 0.000000 8.197993\nK As Au I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 As\n0.500000 0.500000 0.500000 Au\n0.751006 0.248994 0.248994 I\n0.248994 0.248994 0.751006 I\n0.248994 0.751006 0.751006 I\n0.248994 0.751006 0.248994 I\n0.751006 0.248994 0.751006 I\n0.751007 0.751006 0.248994 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"As",
"Au",
"I"
],
"chemical_system": "As-Au-I-K",
"density": 4.737568360635726,
"density_atomic": 0.025668021656344825,
"volume": 389.58982246020196,
"volume_molar": 23.46164749518746,
"formula_full": "K2 As1 Au1 I6",
"formula_reduced": "K2AsAuI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-36977",
"created_at": "2022-09-04T14:38:17.748959Z",
"updated_at": "2022-09-04T14:38:17.748973Z",
"structure_string": "Tl1 Cd1 F3\n1.0\n4.450490 -0.006970 -0.030563\n0.002130 4.452205 -0.010127\n0.027557 0.015755 4.451620\nTl Cd F\n1 1 3\ndirect\n0.012995 0.972420 0.970527 Tl\n0.493504 0.493976 0.491994 Cd\n0.471821 0.997818 0.515782 F\n0.990026 0.517440 0.515893 F\n0.471657 0.518337 0.995804 F\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Tl",
"Cd",
"F"
],
"chemical_system": "Cd-F-Tl",
"density": 7.036437765926595,
"density_atomic": 0.05668219358988878,
"volume": 88.21112387033521,
"volume_molar": 10.624396090899094,
"formula_full": "Tl1 Cd1 F3",
"formula_reduced": "TlCdF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 160
},
{
"id": "jvasp-109837",
"created_at": "2022-09-04T14:38:13.305153Z",
"updated_at": "2022-09-04T14:38:13.305177Z",
"structure_string": "Na2 Al1 Ag1 Cl6\n1.0\n6.089481 -0.000000 3.515763\n2.029827 5.741218 3.515763\n-0.000000 -0.000000 7.031527\nNa Al Ag Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Ag\n0.766154 0.233846 0.233845 Cl\n0.233846 0.233846 0.766154 Cl\n0.233846 0.766154 0.766154 Cl\n0.233846 0.766154 0.233845 Cl\n0.766154 0.233846 0.766154 Cl\n0.766154 0.766154 0.233845 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Na",
"Al",
"Ag",
"Cl"
],
"chemical_system": "Ag-Al-Cl-Na",
"density": 2.658349285835578,
"density_atomic": 0.04067860336782638,
"volume": 245.82948213775757,
"volume_molar": 14.804197443914818,
"formula_full": "Na2 Al1 Ag1 Cl6",
"formula_reduced": "Na2AlAgCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-109725",
"created_at": "2022-09-04T14:38:19.076384Z",
"updated_at": "2022-09-04T14:38:19.076394Z",
"structure_string": "La1 Ga3 Cu1\n1.0\n3.994080 -0.016477 -4.591677\n-0.571196 3.953059 -4.591677\n0.014327 0.016477 6.085718\nLa Ga Cu\n1 3 1\ndirect\n0.000000 0.000000 0.000000 La\n0.619399 0.619399 -0.000001 Ga\n0.380600 0.380601 -0.000001 Ga\n0.750000 0.250000 0.500000 Ga\n0.250000 0.750000 0.500000 Cu\n",
"nsites": 5,
"nelements": 3,
"elements": [
"La",
"Ga",
"Cu"
],
"chemical_system": "Cu-Ga-La",
"density": 7.073082278974591,
"density_atomic": 0.05174074203084037,
"volume": 96.63564540724447,
"volume_molar": 11.639069181517474,
"formula_full": "La1 Ga3 Cu1",
"formula_reduced": "LaGa3Cu",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 119
},
{
"id": "jvasp-110204",
"created_at": "2022-09-04T14:38:19.090260Z",
"updated_at": "2022-09-04T14:38:19.090289Z",
"structure_string": "Na4 Ag1 Cl5\n1.0\n5.380550 -0.005316 -8.950681\n-0.212600 3.885921 -9.691206\n0.004069 0.005316 10.443419\nNa Ag Cl\n4 1 5\ndirect\n0.598968 0.598968 -0.000001 Na\n0.200205 0.200205 -0.000000 Na\n0.799795 0.799794 -0.000001 Na\n0.401031 0.401031 -0.000001 Na\n0.000000 0.000000 0.000000 Ag\n0.300437 0.800437 0.500000 Cl\n0.899981 0.399981 0.500000 Cl\n0.500000 -0.000000 0.500000 Cl\n0.100019 0.600019 0.500000 Cl\n0.699563 0.199563 0.500000 Cl\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Na",
"Ag",
"Cl"
],
"chemical_system": "Ag-Cl-Na",
"density": 2.8622285463281543,
"density_atomic": 0.04570961604114162,
"volume": 218.77234739839756,
"volume_molar": 13.1747787042877,
"formula_full": "Na4 Ag1 Cl5",
"formula_reduced": "Na4AgCl5",
"formula_anonymous": "AB4C5",
"energy_above_hull": 0.0,
"spacegroup": 71
},
{
"id": "jvasp-108860",
"created_at": "2022-09-04T14:38:19.106354Z",
"updated_at": "2022-09-04T14:38:19.106375Z",
"structure_string": "Na3 As1 F6\n1.0\n5.151706 -0.000000 2.974339\n1.717235 4.857075 2.974339\n-0.000000 -0.000000 5.948678\nNa As F\n3 1 6\ndirect\n0.750001 0.750001 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.500001 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 As\n0.756985 0.243016 0.243015 F\n0.243016 0.243016 0.756985 F\n0.243016 0.756985 0.756984 F\n0.243016 0.756985 0.243015 F\n0.756985 0.243016 0.756985 F\n0.756986 0.756985 0.243015 F\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Na",
"As",
"F"
],
"chemical_system": "As-F-Na",
"density": 2.876885996987156,
"density_atomic": 0.06718211290897173,
"volume": 148.84914402066335,
"volume_molar": 8.963904972979469,
"formula_full": "Na3 As1 F6",
"formula_reduced": "Na3AsF6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-21037",
"created_at": "2022-09-04T14:38:19.508183Z",
"updated_at": "2022-09-04T14:38:19.508193Z",
"structure_string": "Na2 Th1 F6\n1.0\n2.992319 -5.182849 0.000000\n2.992319 5.182849 -0.000000\n0.000000 0.000000 3.848524\nNa Th F\n2 1 6\ndirect\n0.666667 0.333333 0.420333 Na\n0.333333 0.666667 0.579665 Na\n0.000000 0.000000 0.000000 Th\n0.253263 0.253263 0.499999 F\n0.746738 -0.000000 0.499999 F\n-0.000000 0.746738 0.499999 F\n-0.000000 0.382563 0.000000 F\n0.382563 -0.000000 0.000000 F\n0.617437 0.617437 0.000000 F\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Na",
"Th",
"F"
],
"chemical_system": "F-Na-Th",
"density": 5.453099298905803,
"density_atomic": 0.07539488243056738,
"volume": 119.37149724038997,
"volume_molar": 7.987466212373111,
"formula_full": "Na2 Th1 F6",
"formula_reduced": "Na2ThF6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.0,
"spacegroup": 150
},
{
"id": "jvasp-54582",
"created_at": "2022-09-04T14:38:13.173753Z",
"updated_at": "2022-09-04T14:38:13.173770Z",
"structure_string": "Ag2 Pb4 Br10\n1.0\n6.555162 0.000000 -2.768974\n-0.319687 7.992132 -0.756812\n-0.038190 0.004227 9.053295\nAg Pb Br\n2 4 10\ndirect\n0.500000 0.000000 0.500000 Ag\n-0.000000 0.500000 0.500000 Ag\n0.870867 0.064270 0.207175 Pb\n0.129132 0.935730 0.792825 Pb\n0.336307 0.564270 0.207175 Pb\n0.663692 0.435730 0.792825 Pb\n0.135808 0.819162 0.443137 Br\n0.925602 0.750000 0.000000 Br\n0.864191 0.180838 0.556863 Br\n0.293489 0.576990 0.825981 Br\n0.532492 0.076990 0.825981 Br\n0.706510 0.423011 0.174019 Br\n0.467507 0.923011 0.174019 Br\n0.692671 0.680838 0.556863 Br\n0.307328 0.319162 0.443137 Br\n0.074397 0.250000 0.000000 Br\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ag",
"Pb",
"Br"
],
"chemical_system": "Ag-Br-Pb",
"density": 6.4656080180223325,
"density_atomic": 0.03379240619219975,
"volume": 473.47915709220064,
"volume_molar": 17.820988318346153,
"formula_full": "Ag2 Pb4 Br10",
"formula_reduced": "AgPb2Br5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 0.0,
"spacegroup": 15
},
{
"id": "jvasp-109544",
"created_at": "2022-09-04T14:38:19.525024Z",
"updated_at": "2022-09-04T14:38:19.525044Z",
"structure_string": "In3 Pb1\n1.0\n4.737832 -0.000000 2.735389\n1.579277 4.466871 2.735389\n-0.000000 -0.000000 5.470777\nIn Pb\n3 1\ndirect\n0.250000 0.250000 0.250000 In\n0.750000 0.750000 0.750001 In\n0.500000 0.500000 0.500001 In\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"In",
"Pb"
],
"chemical_system": "In-Pb",
"density": 7.911954647785252,
"density_atomic": 0.03454839779438906,
"volume": 115.77960934123642,
"volume_molar": 17.431027614768414,
"formula_full": "In3 Pb1",
"formula_reduced": "In3Pb",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-109443",
"created_at": "2022-09-04T14:38:19.519445Z",
"updated_at": "2022-09-04T14:38:19.519465Z",
"structure_string": "Na2 Ag1 Au1 F6\n1.0\n5.348128 -0.000000 3.087743\n1.782709 5.042264 3.087743\n-0.000000 -0.000000 6.175487\nNa Ag Au F\n2 1 1 6\ndirect\n0.750000 0.749999 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Au\n0.750320 0.249680 0.249680 F\n0.249681 0.249680 0.750320 F\n0.249681 0.750319 0.750319 F\n0.249681 0.750319 0.249680 F\n0.750320 0.249680 0.750319 F\n0.750320 0.750319 0.249680 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Na",
"Ag",
"Au",
"F"
],
"chemical_system": "Ag-Au-F-Na",
"density": 4.634693812653112,
"density_atomic": 0.06004839650297941,
"volume": 166.53234028495385,
"volume_molar": 10.028811942882104,
"formula_full": "Na2 Ag1 Au1 F6",
"formula_reduced": "Na2AgAuF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}