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=id&page=4351",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=4349",
"results": [
{
"id": "jvasp-92806",
"created_at": "2022-09-04T14:36:08.932239Z",
"updated_at": "2022-09-04T14:36:08.932254Z",
"structure_string": "U2 Bi1 N2\n1.0\n4.580251 -0.000000 -0.000000\n-0.000000 4.580251 0.000000\n-2.290126 -2.290126 5.148219\nU Bi N\n2 1 2\ndirect\n0.250000 0.749999 0.500000 U\n0.749999 0.250000 0.500000 U\n0.000000 0.000000 0.000000 Bi\n0.719669 0.719669 0.439339 N\n0.280330 0.280330 0.560661 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"U",
"Bi",
"N"
],
"chemical_system": "Bi-N-U",
"density": 10.963128356966525,
"density_atomic": 0.04629503692763195,
"volume": 108.00293793513897,
"volume_molar": 13.008177894779013,
"formula_full": "U2 Bi1 N2",
"formula_reduced": "U2BiN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 4.79999456,
"spacegroup": 139
},
{
"id": "jvasp-92807",
"created_at": "2022-09-04T14:36:17.703693Z",
"updated_at": "2022-09-04T14:36:17.703719Z",
"structure_string": "Y2 In1 Ni2\n1.0\n3.679289 0.000000 0.000000\n0.000000 3.757491 -1.033005\n0.000000 0.009844 7.386127\nY In Ni\n2 1 2\ndirect\n0.500000 0.637104 0.274211 Y\n0.500000 0.362894 0.725789 Y\n0.000000 0.000000 0.000000 In\n0.000000 0.198948 0.397896 Ni\n0.000000 0.801051 0.602103 Ni\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Y",
"In",
"Ni"
],
"chemical_system": "In-Ni-Y",
"density": 6.665192729222837,
"density_atomic": 0.04894769944841192,
"volume": 102.14984680270243,
"volume_molar": 12.303215121166202,
"formula_full": "Y2 In1 Ni2",
"formula_reduced": "Y2InNi2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.4568991340000004,
"spacegroup": 65
},
{
"id": "jvasp-92811",
"created_at": "2022-09-04T14:35:45.188479Z",
"updated_at": "2022-09-04T14:35:45.188499Z",
"structure_string": "La1 Ni2 P2\n1.0\n3.753920 0.000000 -1.441874\n-0.553821 3.712842 -1.441874\n0.015286 0.017734 5.647401\nLa Ni P\n1 2 2\ndirect\n0.000000 0.000000 0.000000 La\n0.750001 0.249999 0.500001 Ni\n0.250001 0.749999 0.500000 Ni\n0.632718 0.632717 0.265435 P\n0.367283 0.367282 0.734566 P\n",
"nsites": 5,
"nelements": 3,
"elements": [
"La",
"Ni",
"P"
],
"chemical_system": "La-Ni-P",
"density": 6.697388552723217,
"density_atomic": 0.06336827977404043,
"volume": 78.90383039951654,
"volume_molar": 9.503399463381113,
"formula_full": "La1 Ni2 P2",
"formula_reduced": "La(NiP)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.91102816,
"spacegroup": 139
},
{
"id": "jvasp-92812",
"created_at": "2022-09-04T14:35:48.771145Z",
"updated_at": "2022-09-04T14:35:48.771168Z",
"structure_string": "Rb1 W1 O3\n1.0\n4.006874 -0.000000 -0.000000\n0.000000 4.006874 -0.000000\n0.000000 0.000000 4.006874\nRb W O\n1 1 3\ndirect\n0.499999 0.499999 0.499999 Rb\n0.000000 0.000000 0.000000 W\n0.499999 0.000000 0.000000 O\n0.000000 0.499999 0.000000 O\n0.000000 0.000000 0.499999 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"W",
"O"
],
"chemical_system": "O-Rb-W",
"density": 8.190498295557731,
"density_atomic": 0.07772360694004238,
"volume": 64.3305193473214,
"volume_molar": 7.748148853469456,
"formula_full": "Rb1 W1 O3",
"formula_reduced": "RbWO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.5815181,
"spacegroup": 221
},
{
"id": "jvasp-9282",
"created_at": "2022-09-04T14:38:16.663779Z",
"updated_at": "2022-09-04T14:38:16.663806Z",
"structure_string": "Mg1 Sb4 O8\n1.0\n3.241546 -0.162246 -0.227687\n1.171968 6.528591 0.425570\n0.789337 3.375903 9.183706\nMg Sb O\n1 4 8\ndirect\n0.585396 0.855249 0.801521 Mg\n0.345306 0.733513 0.522384 Sb\n0.988749 0.280407 0.867350 Sb\n0.126287 0.628296 0.107254 Sb\n0.727421 0.226846 0.443017 Sb\n0.205971 0.324790 0.279282 O\n0.604563 0.718802 0.197518 O\n0.502635 0.243983 0.750138 O\n0.884314 0.623107 0.711290 O\n0.800395 -0.049403 0.398738 O\n0.068949 0.896399 0.911925 O\n0.297493 0.989414 0.593393 O\n0.640138 0.537948 0.007402 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Mg",
"Sb",
"O"
],
"chemical_system": "Mg-O-Sb",
"density": 5.539248806763955,
"density_atomic": 0.06782864090147807,
"volume": 191.65944986104998,
"volume_molar": 8.878462961903118,
"formula_full": "Mg1 Sb4 O8",
"formula_reduced": "Mg(SbO2)4",
"formula_anonymous": "AB4C8",
"energy_above_hull": 2.2271685730769235,
"spacegroup": 1
},
{
"id": "jvasp-9283",
"created_at": "2022-09-04T14:37:56.498193Z",
"updated_at": "2022-09-04T14:37:56.498219Z",
"structure_string": "Mg4 Co4 O8\n1.0\n2.906852 0.008778 -0.036488\n1.435095 7.494049 0.177252\n0.099443 0.793637 8.113562\nMg Co O\n4 4 8\ndirect\n0.643451 0.682577 0.976320 Mg\n0.340437 0.289220 0.043764 Mg\n0.550032 0.869193 0.262980 Mg\n0.433851 0.102607 0.757106 Mg\n0.771787 0.426288 0.715732 Co\n0.127271 0.714842 0.652184 Co\n0.856603 0.256958 0.367896 Co\n0.212091 0.545511 0.304349 Co\n0.764271 0.441309 0.165106 O\n0.872196 0.225636 0.593870 O\n0.111688 0.746162 0.426213 O\n0.219612 0.530489 0.854974 O\n0.887434 0.195315 0.906153 O\n0.562981 0.843299 0.755355 O\n0.096451 0.776483 0.113929 O\n0.420894 0.128500 0.264727 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Mg",
"Co",
"O"
],
"chemical_system": "Co-Mg-O",
"density": 4.343529401090392,
"density_atomic": 0.09079495853776563,
"volume": 176.221238025511,
"volume_molar": 6.6326818768193245,
"formula_full": "Mg4 Co4 O8",
"formula_reduced": "MgCoO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.3721992375000005,
"spacegroup": 12
},
{
"id": "jvasp-9284",
"created_at": "2022-09-04T14:38:04.359961Z",
"updated_at": "2022-09-04T14:38:04.359988Z",
"structure_string": "Zn1 Bi4 O8\n1.0\n3.503546 -0.026217 -0.190215\n1.635342 6.870591 0.349383\n1.179116 2.562032 8.874157\nZn Bi O\n1 4 8\ndirect\n0.582821 0.808640 0.808876 Zn\n0.426383 0.731516 0.486020 Bi\n-0.010197 0.300094 0.854117 Bi\n0.084154 0.641218 0.120202 Bi\n0.723337 0.188803 0.479508 Bi\n0.168208 0.386697 0.327210 O\n0.509716 0.766729 0.201353 O\n0.546101 0.262377 0.720844 O\n0.903041 0.614872 0.697300 O\n0.855714 -0.061698 0.379160 O\n0.026906 0.878238 0.901994 O\n0.309996 0.970668 0.601444 O\n0.651424 0.521202 0.013183 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Zn",
"Bi",
"O"
],
"chemical_system": "Bi-O-Zn",
"density": 8.078008923623724,
"density_atomic": 0.06143922445160933,
"volume": 211.59121255248007,
"volume_molar": 9.801785119770107,
"formula_full": "Zn1 Bi4 O8",
"formula_reduced": "Zn(BiO2)4",
"formula_anonymous": "AB4C8",
"energy_above_hull": 1.9216388923076924,
"spacegroup": 1
},
{
"id": "jvasp-92846",
"created_at": "2022-09-04T14:36:12.148407Z",
"updated_at": "2022-09-04T14:36:12.148433Z",
"structure_string": "Ba1 Mg6 Nb1\n1.0\n6.590378 0.000765 0.000000\n-3.294527 5.707816 0.000000\n0.000000 0.000000 5.191953\nBa Mg Nb\n1 6 1\ndirect\n0.083332 0.416669 0.250000 Ba\n0.112584 0.931290 0.250000 Mg\n0.568711 0.387416 0.250000 Mg\n0.568824 0.931176 0.250000 Mg\n0.436010 0.593071 0.750000 Mg\n0.906929 0.063989 0.750000 Mg\n0.906926 0.593074 0.750000 Mg\n0.416685 0.083315 0.750000 Nb\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Nb"
],
"chemical_system": "Ba-Mg-Nb",
"density": 3.197201470819505,
"density_atomic": 0.04095904749248993,
"volume": 195.31704201536533,
"volume_molar": 14.702833998042053,
"formula_full": "Ba1 Mg6 Nb1",
"formula_reduced": "BaMg6Nb",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0485949587499999,
"spacegroup": 187
},
{
"id": "jvasp-92847",
"created_at": "2022-09-04T14:36:15.823154Z",
"updated_at": "2022-09-04T14:36:15.823178Z",
"structure_string": "Ba1 Mg6 Cr1\n1.0\n7.648166 0.813731 0.000000\n-3.119370 5.402907 0.000000\n0.000000 0.000000 5.031491\nBa Mg Cr\n1 6 1\ndirect\n0.085588 0.292794 0.250000 Ba\n0.621783 0.322449 0.250000 Mg\n0.621783 0.799332 0.250000 Mg\n0.356354 0.174247 0.750000 Mg\n0.356354 0.682108 0.750000 Mg\n0.740576 0.120288 0.750000 Mg\n0.937765 0.718882 0.750000 Mg\n0.279801 0.889901 0.250000 Cr\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Cr"
],
"chemical_system": "Ba-Cr-Mg",
"density": 2.521857242883576,
"density_atomic": 0.03625084607248138,
"volume": 220.6845044114138,
"volume_molar": 16.612414363954684,
"formula_full": "Ba1 Mg6 Cr1",
"formula_reduced": "BaMg6Cr",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-92848",
"created_at": "2022-09-04T14:36:20.975538Z",
"updated_at": "2022-09-04T14:36:20.975553Z",
"structure_string": "Ba1 Mg6 Bi1\n1.0\n7.747811 -0.625787 0.000000\n-4.415853 6.396909 0.000000\n0.000000 0.000000 4.999104\nBa Mg Bi\n1 6 1\ndirect\n0.204508 0.295492 0.250000 Ba\n0.158555 0.782370 0.250000 Mg\n0.717630 0.341445 0.250000 Mg\n0.627167 0.872833 0.250000 Mg\n0.306561 0.674484 0.749999 Mg\n0.825516 0.193439 0.749999 Mg\n0.778676 0.721323 0.749999 Mg\n0.381387 0.118613 0.749999 Bi\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Bi"
],
"chemical_system": "Ba-Bi-Mg",
"density": 3.4930909374677688,
"density_atomic": 0.03419514195861695,
"volume": 233.95136097641065,
"volume_molar": 17.61110033491895,
"formula_full": "Ba1 Mg6 Bi1",
"formula_reduced": "BaMg6Bi",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-9285",
"created_at": "2022-09-04T14:38:01.953772Z",
"updated_at": "2022-09-04T14:38:01.953792Z",
"structure_string": "Zn1 Sb4 O8\n1.0\n3.235247 -0.296195 -0.466619\n0.695115 7.036696 0.324141\n-0.069515 3.604140 8.721214\nZn Sb O\n1 4 8\ndirect\n0.483883 0.910386 0.816251 Zn\n0.326057 0.741472 0.500114 Sb\n0.007719 0.318138 0.865000 Sb\n0.133468 0.615032 0.116015 Sb\n0.798229 0.197422 0.445737 Sb\n0.211105 0.311684 0.271051 O\n0.691115 0.659569 0.231900 O\n0.454839 0.250613 0.758463 O\n0.917624 0.608666 0.684359 O\n0.765556 -0.039620 0.379453 O\n0.045610 0.903547 0.940320 O\n0.372046 0.966182 0.593413 O\n0.570325 0.566280 -0.010874 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Zn",
"Sb",
"O"
],
"chemical_system": "O-Sb-Zn",
"density": 5.7893986258822245,
"density_atomic": 0.06660934943485494,
"volume": 195.16779716808702,
"volume_molar": 9.04098420281038,
"formula_full": "Zn1 Sb4 O8",
"formula_reduced": "Zn(SbO2)4",
"formula_anonymous": "AB4C8",
"energy_above_hull": 2.175180984615385,
"spacegroup": 8
},
{
"id": "jvasp-92850",
"created_at": "2022-09-04T14:35:43.240731Z",
"updated_at": "2022-09-04T14:35:43.240754Z",
"structure_string": "Ba1 Mg6 Ga1\n1.0\n6.718723 0.770933 0.000000\n-2.691714 6.204048 0.000000\n0.000000 0.000000 4.898525\nBa Mg Ga\n1 6 1\ndirect\n0.121166 0.378834 0.250000 Ba\n0.210097 0.904676 0.250000 Mg\n0.595324 0.289903 0.250000 Mg\n0.692929 0.807071 0.250000 Mg\n0.399169 0.719587 0.750001 Mg\n0.780413 0.100830 0.750001 Mg\n0.869193 0.630807 0.750001 Mg\n0.331709 0.168290 0.750001 Ga\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Ga"
],
"chemical_system": "Ba-Ga-Mg",
"density": 2.7336900304180047,
"density_atomic": 0.03732184575623453,
"volume": 214.3516709289121,
"volume_molar": 16.13569918093886,
"formula_full": "Ba1 Mg6 Ga1",
"formula_reduced": "BaMg6Ga",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0031562499999999,
"spacegroup": 38
}
]
}