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_molar&page=1266",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume_molar&page=1264",
"results": [
{
"id": "jvasp-25595",
"created_at": "2022-09-04T14:38:00.688177Z",
"updated_at": "2022-09-04T14:38:00.688210Z",
"structure_string": "Hg4 Sb4 O14\n1.0\n6.442727 0.000000 3.719710\n2.147575 6.074261 3.719710\n0.000000 0.000000 7.439420\nHg Sb O\n4 4 14\ndirect\n0.500000 -0.000000 0.500000 Hg\n0.500001 0.500000 0.500000 Hg\n0.500001 0.500000 -0.000000 Hg\n0.000000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Sb\n0.000000 0.500000 -0.000000 Sb\n-0.000000 -0.000000 0.500000 Sb\n0.500000 -0.000000 -0.000000 Sb\n0.375000 0.375000 0.375000 O\n0.929130 0.320871 0.320871 O\n0.929130 0.320871 0.929129 O\n0.625001 0.625000 0.625000 O\n0.679129 0.070871 0.679129 O\n0.929130 0.929129 0.320871 O\n0.070872 0.679129 0.679129 O\n0.679129 0.070871 0.070871 O\n0.320871 0.320871 0.929129 O\n0.679130 0.679129 0.070871 O\n0.320872 0.929129 0.320871 O\n0.320872 0.929129 0.929129 O\n0.070872 0.679129 0.070871 O\n0.070871 0.070871 0.679129 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Hg",
"Sb",
"O"
],
"chemical_system": "Hg-O-Sb",
"density": 8.631736229052583,
"density_atomic": 0.07556495443976423,
"volume": 291.14025361501484,
"volume_molar": 7.969489037144174,
"formula_full": "Hg4 Sb4 O14",
"formula_reduced": "Hg2Sb2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 1.7406241727272724,
"spacegroup": 227
},
{
"id": "jvasp-15367",
"created_at": "2022-09-04T14:36:47.829843Z",
"updated_at": "2022-09-04T14:36:47.829864Z",
"structure_string": "Nb1 Ga1 Co2\n1.0\n3.649958 -0.000000 2.107305\n1.216653 3.441213 2.107305\n-0.000000 -0.000000 4.214609\nNb Ga Co\n1 1 2\ndirect\n0.500000 0.500000 0.499999 Nb\n0.000000 0.000000 0.000000 Ga\n0.250000 0.250000 0.250000 Co\n0.750000 0.749999 0.749999 Co\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Nb",
"Ga",
"Co"
],
"chemical_system": "Co-Ga-Nb",
"density": 8.79870387585362,
"density_atomic": 0.07556197124007859,
"volume": 52.936681433191254,
"volume_molar": 7.969803673948906,
"formula_full": "Nb1 Ga1 Co2",
"formula_reduced": "NbGaCo2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.8270133812500005,
"spacegroup": 225
},
{
"id": "jvasp-93848",
"created_at": "2022-09-04T14:36:20.241010Z",
"updated_at": "2022-09-04T14:36:20.241027Z",
"structure_string": "Pu1 B2 Os3\n1.0\n-0.000164 -0.000095 2.933162\n5.591050 -0.000031 0.000456\n-2.795552 4.842038 0.000000\nPu B Os\n1 2 3\ndirect\n0.000000 0.000000 0.000000 Pu\n-0.000003 0.333339 0.666670 B\n0.000005 0.666662 0.333331 B\n0.500000 0.500000 0.500000 Os\n0.500000 0.000000 0.500000 Os\n0.500000 0.500000 -0.000000 Os\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Pu",
"B",
"Os"
],
"chemical_system": "B-Os-Pu",
"density": 17.488847628377442,
"density_atomic": 0.07556053400023742,
"volume": 79.40653251578591,
"volume_molar": 7.9699552678929955,
"formula_full": "Pu1 B2 Os3",
"formula_reduced": "PuB2Os3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 6.413896694444444,
"spacegroup": 191
},
{
"id": "jvasp-93850",
"created_at": "2022-09-04T14:36:21.147284Z",
"updated_at": "2022-09-04T14:36:21.147311Z",
"structure_string": "Al1 N1 F4\n1.0\n3.594144 -0.000000 -0.000000\n0.000000 3.594144 0.000000\n-0.000000 0.000000 6.147136\nAl N F\n1 1 4\ndirect\n0.499999 0.499999 0.500000 Al\n0.000000 0.000000 0.000000 N\n0.000000 0.499999 0.500000 F\n0.499999 0.000000 0.500000 F\n0.499999 0.499999 0.793858 F\n0.499999 0.499999 0.206143 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Al",
"N",
"F"
],
"chemical_system": "Al-F-N",
"density": 2.446266792094302,
"density_atomic": 0.07555922283991066,
"volume": 79.4079104375168,
"volume_molar": 7.970093568536656,
"formula_full": "Al1 N1 F4",
"formula_reduced": "AlNF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.8956628633333332,
"spacegroup": 123
},
{
"id": "jvasp-104635",
"created_at": "2022-09-04T14:36:51.637964Z",
"updated_at": "2022-09-04T14:36:51.637994Z",
"structure_string": "U2 Mn4 Si2 C2\n1.0\n5.650398 0.006473 0.000000\n-4.406374 3.537076 0.000000\n0.000000 0.000000 6.612596\nU Mn Si C\n2 4 2 2\ndirect\n0.557305 0.442696 0.250000 U\n0.442696 0.557305 0.750000 U\n0.833717 0.166283 0.060657 Mn\n0.166285 0.833718 0.939344 Mn\n0.166285 0.833718 0.560657 Mn\n0.833717 0.166283 0.439343 Mn\n0.275640 0.724362 0.250000 Si\n0.724362 0.275638 0.750000 Si\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"U",
"Mn",
"Si",
"C"
],
"chemical_system": "C-Mn-Si-U",
"density": 9.736377140195092,
"density_atomic": 0.07555883029609664,
"volume": 132.34720496350243,
"volume_molar": 7.970134974827823,
"formula_full": "U2 Mn4 Si2 C2",
"formula_reduced": "UMn2SiC",
"formula_anonymous": "ABCD2",
"energy_above_hull": 4.957075816551725,
"spacegroup": 63
},
{
"id": "jvasp-19804",
"created_at": "2022-09-04T14:38:16.835554Z",
"updated_at": "2022-09-04T14:38:16.835574Z",
"structure_string": "Mn2 Pt2\n1.0\n3.765058 -0.000000 0.000000\n-0.000000 3.749826 0.000000\n0.000000 0.000000 3.749826\nMn Pt\n2 2\ndirect\n0.000000 0.000000 0.000000 Mn\n0.000000 0.500001 0.500001 Mn\n0.500000 0.000000 0.500001 Pt\n0.500000 0.500001 0.000000 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mn",
"Pt"
],
"chemical_system": "Mn-Pt",
"density": 15.684240510981358,
"density_atomic": 0.0755555007987115,
"volume": 52.941214838300894,
"volume_molar": 7.970486194041216,
"formula_full": "Mn2 Pt2",
"formula_reduced": "MnPt",
"formula_anonymous": "AB",
"energy_above_hull": 2.287284320689656,
"spacegroup": 123
},
{
"id": "jvasp-50293",
"created_at": "2022-09-04T14:36:45.731691Z",
"updated_at": "2022-09-04T14:36:45.731721Z",
"structure_string": "Ag2 Sn2 O6\n1.0\n3.253132 0.000387 0.000395\n0.008391 6.574489 -0.025780\n0.008361 2.244127 6.179607\nAg Sn O\n2 2 6\ndirect\n0.499512 0.501093 0.500412 Ag\n0.499563 0.001109 0.000390 Ag\n0.999523 0.501084 0.000419 Sn\n0.999522 0.001089 0.500415 Sn\n0.498917 0.176635 0.561774 O\n0.500121 0.439729 0.824877 O\n0.998967 0.833365 0.832689 O\n0.000080 0.168802 0.168126 O\n0.498921 0.562456 0.175955 O\n0.500125 0.825551 0.439054 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ag",
"Sn",
"O"
],
"chemical_system": "Ag-O-Sn",
"density": 6.889693081832871,
"density_atomic": 0.0755540198398953,
"volume": 132.35563139050387,
"volume_molar": 7.970642426122889,
"formula_full": "Ag2 Sn2 O6",
"formula_reduced": "AgSnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.3560978919999995,
"spacegroup": 65
},
{
"id": "jvasp-104877",
"created_at": "2022-09-04T14:36:59.839734Z",
"updated_at": "2022-09-04T14:36:59.839746Z",
"structure_string": "Th2 Ta2 N6\n1.0\n4.983723 0.003993 -2.785641\n-1.676167 4.652557 -2.853329\n0.000928 -0.003993 5.709404\nTh Ta N\n2 2 6\ndirect\n0.236146 0.250001 0.986145 Th\n0.763854 0.750000 0.013854 Th\n0.500000 -0.000000 0.500000 Ta\n0.000000 0.500001 0.500000 Ta\n0.353089 0.750001 0.603089 N\n0.646910 0.250000 0.396910 N\n0.808188 0.308188 -0.000000 N\n0.191812 0.191812 0.500000 N\n0.191811 0.691812 -0.000000 N\n0.808188 0.808189 0.500000 N\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Th",
"Ta",
"N"
],
"chemical_system": "N-Ta-Th",
"density": 11.416751459867019,
"density_atomic": 0.0755520567782071,
"volume": 132.35907037390527,
"volume_molar": 7.9708495265440344,
"formula_full": "Th2 Ta2 N6",
"formula_reduced": "ThTaN3",
"formula_anonymous": "ABC3",
"energy_above_hull": 5.108184909999999,
"spacegroup": 74
},
{
"id": "jvasp-11073",
"created_at": "2022-09-04T14:37:08.252989Z",
"updated_at": "2022-09-04T14:37:08.253014Z",
"structure_string": "Ho2 As2 O8\n1.0\n5.676084 0.014927 -1.695241\n-3.146684 4.724038 -1.695241\n-0.007967 -0.014927 5.923826\nHo As O\n2 2 8\ndirect\n0.125000 0.875000 0.250001 Ho\n0.874999 0.125000 0.750000 Ho\n0.375000 0.625000 0.750001 As\n0.625000 0.375000 0.250000 As\n0.802708 0.735500 0.432791 O\n0.369919 0.802709 0.567210 O\n0.735499 0.802709 0.932791 O\n0.802708 0.369919 0.067210 O\n0.630081 0.197292 0.432791 O\n0.197291 0.264501 0.567210 O\n0.197291 0.630081 0.932791 O\n0.264501 0.197292 0.067209 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ho",
"As",
"O"
],
"chemical_system": "As-Ho-O",
"density": 6.353261223513738,
"density_atomic": 0.07555101627859372,
"volume": 158.8330718907884,
"volume_molar": 7.97095930224606,
"formula_full": "Ho2 As2 O8",
"formula_reduced": "HoAsO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.0476052194444447,
"spacegroup": 141
},
{
"id": "jvasp-26193",
"created_at": "2022-09-04T14:38:35.967250Z",
"updated_at": "2022-09-04T14:38:35.967268Z",
"structure_string": "Na2 Pr4 Ru2 O12\n1.0\n0.000000 5.549948 -0.000771\n5.978335 0.000000 0.000000\n0.000000 -5.431450 -7.977821\nNa Pr Ru O\n2 4 2 12\ndirect\n0.000000 0.000000 0.000000 Na\n-0.000000 0.500000 0.500000 Na\n0.772306 0.072512 0.252323 Pr\n0.227694 0.572511 0.247677 Pr\n0.227694 0.927487 0.747677 Pr\n0.772306 0.427488 0.752323 Pr\n0.500000 0.500000 -0.000000 Ru\n0.500000 0.000000 0.500000 Ru\n0.270277 0.280934 0.436525 O\n0.729724 0.780933 0.063475 O\n0.619651 0.043528 0.732252 O\n0.380349 0.543527 0.767748 O\n0.380349 0.956471 0.267748 O\n0.158561 0.825727 0.450057 O\n0.841439 0.174272 0.549943 O\n0.158561 0.674272 0.950057 O\n0.270277 0.219066 0.936525 O\n0.841439 0.325727 0.049943 O\n0.619651 0.456472 0.232252 O\n0.729724 0.719066 0.563475 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Na",
"Pr",
"Ru",
"O"
],
"chemical_system": "Na-O-Pr-Ru",
"density": 6.296179165540569,
"density_atomic": 0.07555017473410852,
"volume": 264.72473518940296,
"volume_molar": 7.971048089821551,
"formula_full": "Na2 Pr4 Ru2 O12",
"formula_reduced": "NaPr2RuO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.3379780200000004,
"spacegroup": 14
},
{
"id": "jvasp-78686",
"created_at": "2022-09-04T14:37:09.519266Z",
"updated_at": "2022-09-04T14:37:09.519289Z",
"structure_string": "Li1 Rh1\n1.0\n2.664692 -0.000000 0.000000\n-1.332346 2.307691 -0.000000\n-0.000000 -0.000000 4.305002\nLi Rh\n1 1\ndirect\n0.333332 0.666667 0.500000 Li\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Li",
"Rh"
],
"chemical_system": "Li-Rh",
"density": 6.890286640574148,
"density_atomic": 0.07554956423850477,
"volume": 26.472687435841955,
"volume_molar": 7.971112501706186,
"formula_full": "Li1 Rh1",
"formula_reduced": "LiRh",
"formula_anonymous": "AB",
"energy_above_hull": 1.0843715,
"spacegroup": 187
},
{
"id": "jvasp-46898",
"created_at": "2022-09-04T14:38:07.500301Z",
"updated_at": "2022-09-04T14:38:07.500314Z",
"structure_string": "Li2 V1 O1 F5\n1.0\n-3.175791 -4.331928 -0.148119\n3.175791 -4.331928 -0.148119\n-3.175791 0.104215 4.333206\nLi V O F\n2 1 1 5\ndirect\n0.506844 0.244439 0.751285 Li\n0.506845 0.741871 0.248716 Li\n0.008095 -0.008095 -0.000000 V\n0.266247 0.733754 -0.000000 O\n0.280616 0.019723 0.699661 F\n0.679937 0.019723 0.300340 F\n0.956769 0.337805 0.294573 F\n0.956769 0.748658 0.705427 F\n0.678006 0.321995 -0.000000 F\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Li",
"V",
"O",
"F"
],
"chemical_system": "F-Li-O-V",
"density": 2.4506970274875854,
"density_atomic": 0.0755487561605389,
"volume": 119.12836765803613,
"volume_molar": 7.971197761619168,
"formula_full": "Li2 V1 O1 F5",
"formula_reduced": "Li2VOF5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 0.6545210124999997,
"spacegroup": 44
}
]
}