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=4356",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume&page=4354",
"results": [
{
"id": "jvasp-113675",
"created_at": "2022-09-04T14:38:48.243572Z",
"updated_at": "2022-09-04T14:38:48.243597Z",
"structure_string": "Al1 P1 O2\n1.0\n2.637345 0.000000 0.000000\n0.000000 2.637345 0.000000\n-0.000000 0.000000 6.612316\nAl P O\n1 1 2\ndirect\n0.500000 0.500000 0.583529 Al\n0.000000 0.000000 0.064968 P\n0.000000 0.000000 0.516279 O\n0.500000 0.500000 0.845226 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"P",
"O"
],
"chemical_system": "Al-O-P",
"density": 3.2477498612053655,
"density_atomic": 0.08697060698179285,
"volume": 45.992550113366384,
"volume_molar": 6.924340267351158,
"formula_full": "Al1 P1 O2",
"formula_reduced": "AlPO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.015696325,
"spacegroup": 99
},
{
"id": "jvasp-69855",
"created_at": "2022-09-04T14:36:05.513537Z",
"updated_at": "2022-09-04T14:36:05.513562Z",
"structure_string": "Be2 Nb1 Fe1\n1.0\n-2.010726 2.010726 2.843843\n2.010726 -2.010726 2.843843\n2.010726 2.010726 -2.843843\nBe Nb Fe\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500001 Be\n0.750001 0.250000 0.500001 Nb\n0.499999 0.499999 0.000000 Fe\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Nb",
"Fe"
],
"chemical_system": "Be-Fe-Nb",
"density": 6.021581779536978,
"density_atomic": 0.0869738301674244,
"volume": 45.990845663575016,
"volume_molar": 6.924083656437109,
"formula_full": "Be2 Nb1 Fe1",
"formula_reduced": "Be2NbFe",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.136771775,
"spacegroup": 216
},
{
"id": "jvasp-107785",
"created_at": "2022-09-04T14:35:58.617225Z",
"updated_at": "2022-09-04T14:35:58.617245Z",
"structure_string": "Cr2 O2\n1.0\n2.700640 -0.293657 -1.191020\n-1.882403 2.884090 2.382117\n-0.256308 0.392430 6.679861\nCr O\n2 2\ndirect\n-0.000005 0.000027 0.900001 Cr\n0.000006 0.000034 0.399999 Cr\n0.499788 0.749881 0.150026 O\n0.500211 0.250157 0.649975 O\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cr",
"O"
],
"chemical_system": "Cr-O",
"density": 4.910131125084375,
"density_atomic": 0.08697487567716645,
"volume": 45.99029281567713,
"volume_molar": 6.924000423240611,
"formula_full": "Cr2 O2",
"formula_reduced": "CrO",
"formula_anonymous": "AB",
"energy_above_hull": 1.6378604500000002,
"spacegroup": 131
},
{
"id": "jvasp-19846",
"created_at": "2022-09-04T14:36:37.263445Z",
"updated_at": "2022-09-04T14:36:37.263470Z",
"structure_string": "Ga1 Ni3\n1.0\n3.582651 0.000000 0.000000\n0.000000 3.582651 0.000000\n-0.000000 0.000000 3.582651\nGa Ni\n1 3\ndirect\n0.000000 0.000000 0.000000 Ga\n0.500000 0.000000 0.500000 Ni\n0.000000 0.500000 0.500000 Ni\n0.500000 0.500000 0.000000 Ni\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ga",
"Ni"
],
"chemical_system": "Ga-Ni",
"density": 8.876119043510208,
"density_atomic": 0.08698542297416362,
"volume": 45.984716326413434,
"volume_molar": 6.923160863158295,
"formula_full": "Ga1 Ni3",
"formula_reduced": "GaNi3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.6078179714285712,
"spacegroup": 221
},
{
"id": "jvasp-822",
"created_at": "2022-09-04T14:38:14.454237Z",
"updated_at": "2022-09-04T14:38:14.454264Z",
"structure_string": "As2\n1.0\n3.432088 0.023002 2.523934\n1.289490 3.180719 2.523934\n0.033900 0.023002 4.260084\nAs\n2\ndirect\n0.226063 0.226062 0.226062 As\n0.773938 0.773936 0.773935 As\n",
"nsites": 2,
"nelements": 1,
"elements": [
"As"
],
"chemical_system": "As",
"density": 5.410986290486954,
"density_atomic": 0.0434930929171342,
"volume": 45.98431304507424,
"volume_molar": 13.846200295467066,
"formula_full": "As2",
"formula_reduced": "As",
"formula_anonymous": "A",
"energy_above_hull": 1.7500000000225668e-06,
"spacegroup": 166
},
{
"id": "jvasp-121185",
"created_at": "2022-09-04T14:38:52.889802Z",
"updated_at": "2022-09-04T14:38:52.889819Z",
"structure_string": "Li2 S1\n1.0\n3.824007 1.145064 -0.487852\n-0.993856 -3.880509 -0.341459\n0.689596 -3.988885 -3.992528\nLi S\n2 1\ndirect\n0.682911 0.224375 0.255581 Li\n0.682970 0.224126 0.755635 Li\n0.182953 0.224230 0.005629 S\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"S"
],
"chemical_system": "Li-S",
"density": 1.6591924199246462,
"density_atomic": 0.06523966942889133,
"volume": 45.98429186202242,
"volume_molar": 9.23079594473405,
"formula_full": "Li2 S1",
"formula_reduced": "Li2S",
"formula_anonymous": "AB2",
"energy_above_hull": 0.4638300000000001,
"spacegroup": 225
},
{
"id": "jvasp-14603",
"created_at": "2022-09-04T14:36:39.756501Z",
"updated_at": "2022-09-04T14:36:39.756526Z",
"structure_string": "As2\n1.0\n3.431985 0.022935 2.523738\n1.289390 3.180648 2.523738\n0.033801 0.022935 4.259886\nAs\n2\ndirect\n0.226068 0.226069 0.226069 As\n0.773931 0.773934 0.773932 As\n",
"nsites": 2,
"nelements": 1,
"elements": [
"As"
],
"chemical_system": "As",
"density": 5.41134273647224,
"density_atomic": 0.04349595800263354,
"volume": 45.98128405124233,
"volume_molar": 13.84528824410622,
"formula_full": "As2",
"formula_reduced": "As",
"formula_anonymous": "A",
"energy_above_hull": 1.7500000000225668e-06,
"spacegroup": 166
},
{
"id": "jvasp-74794",
"created_at": "2022-09-04T14:35:49.960604Z",
"updated_at": "2022-09-04T14:35:49.960637Z",
"structure_string": "Be2 Mo1 Rh1\n1.0\n2.763489 0.000000 0.000000\n0.000000 2.763489 0.000000\n0.000000 -0.000000 6.020772\nBe Mo Rh\n2 1 1\ndirect\n0.000000 0.000000 0.015802 Be\n0.500000 0.500000 0.204786 Be\n0.000000 0.000000 0.482853 Mo\n0.500000 0.500000 0.796559 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Mo",
"Rh"
],
"chemical_system": "Be-Mo-Rh",
"density": 7.832143624275394,
"density_atomic": 0.08699460681954894,
"volume": 45.979861812550226,
"volume_molar": 6.922429999013155,
"formula_full": "Be2 Mo1 Rh1",
"formula_reduced": "Be2MoRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.0749152750000004,
"spacegroup": 99
},
{
"id": "jvasp-78394",
"created_at": "2022-09-04T14:37:57.657829Z",
"updated_at": "2022-09-04T14:37:57.657850Z",
"structure_string": "Na1 S1\n1.0\n-2.843408 -2.843408 0.000000\n-2.843408 -0.000000 -2.843408\n-0.000000 -2.843408 -2.843408\nNa S\n1 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Na",
"S"
],
"chemical_system": "Na-S",
"density": 1.9883668126126186,
"density_atomic": 0.04349931891024635,
"volume": 45.977731378430754,
"volume_molar": 13.84421850931894,
"formula_full": "Na1 S1",
"formula_reduced": "NaS",
"formula_anonymous": "AB",
"energy_above_hull": 0.3399974999999999,
"spacegroup": 225
},
{
"id": "jvasp-74728",
"created_at": "2022-09-04T14:36:14.877958Z",
"updated_at": "2022-09-04T14:36:14.877973Z",
"structure_string": "Be2 Si1 Pd1\n1.0\n3.045575 0.000000 0.000000\n0.000000 3.045575 0.000000\n0.000000 -0.000000 4.956751\nBe Si Pd\n2 1 1\ndirect\n0.000000 0.000000 0.013302 Be\n0.499999 0.499999 0.227637 Be\n0.499999 0.499999 0.769305 Si\n0.000000 0.000000 0.489756 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Si",
"Pd"
],
"chemical_system": "Be-Pd-Si",
"density": 5.508943013549624,
"density_atomic": 0.08700100926564573,
"volume": 45.976478132415046,
"volume_molar": 6.921920574061633,
"formula_full": "Be2 Si1 Pd1",
"formula_reduced": "Be2SiPd",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.094799125,
"spacegroup": 99
},
{
"id": "jvasp-123402",
"created_at": "2022-09-04T14:38:50.748824Z",
"updated_at": "2022-09-04T14:38:50.748849Z",
"structure_string": "Zr1 In1\n1.0\n1.606119 -2.781877 -0.000000\n1.606119 2.781877 -0.000000\n0.000000 0.000000 5.144533\nZr In\n1 1\ndirect\n0.333334 0.666667 0.749999 Zr\n0.666667 0.333334 0.250000 In\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Zr",
"In"
],
"chemical_system": "In-Zr",
"density": 7.442404279126337,
"density_atomic": 0.04350492246941273,
"volume": 45.97180931436326,
"volume_molar": 13.842435334148734,
"formula_full": "Zr1 In1",
"formula_reduced": "ZrIn",
"formula_anonymous": "AB",
"energy_above_hull": 1.1788672350000002,
"spacegroup": 187
},
{
"id": "jvasp-120303",
"created_at": "2022-09-04T14:38:47.342275Z",
"updated_at": "2022-09-04T14:38:47.342303Z",
"structure_string": "Ti1 Al1 N2\n1.0\n3.189419 0.000000 0.000000\n0.000000 3.189419 0.000000\n0.000000 0.000000 4.518883\nTi Al N\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500000 0.499999 Al\n0.500000 0.000000 0.261874 N\n0.000000 0.500000 0.738124 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Al",
"N"
],
"chemical_system": "Al-N-Ti",
"density": 3.715776222741389,
"density_atomic": 0.08701732733527441,
"volume": 45.96785631657192,
"volume_molar": 6.92062252934628,
"formula_full": "Ti1 Al1 N2",
"formula_reduced": "TiAlN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.602376908333333,
"spacegroup": 115
}
]
}