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=-formula_anonymous&page=551",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=549",
"results": [
{
"id": "jvasp-115290",
"created_at": "2022-09-04T14:38:46.217659Z",
"updated_at": "2022-09-04T14:38:46.217669Z",
"structure_string": "Ti1 Pb1 O3\n1.0\n3.956567 0.000000 -0.000000\n0.000000 3.956567 -0.000000\n0.000000 0.000000 3.956567\nTi Pb O\n1 1 3\ndirect\n0.500001 0.500001 0.500001 Ti\n0.000000 0.000000 0.000000 Pb\n0.000000 0.500001 0.500001 O\n0.500001 0.500001 0.000000 O\n0.500001 0.000000 0.500001 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ti",
"Pb",
"O"
],
"chemical_system": "O-Pb-Ti",
"density": 8.125116464448332,
"density_atomic": 0.08072618541688516,
"volume": 61.93777117274974,
"volume_molar": 7.459959527259385,
"formula_full": "Ti1 Pb1 O3",
"formula_reduced": "TiPbO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.9055479306666665,
"spacegroup": 221
},
{
"id": "jvasp-19370",
"created_at": "2022-09-04T14:38:35.803669Z",
"updated_at": "2022-09-04T14:38:35.803681Z",
"structure_string": "Mg4 Cr4 O12\n1.0\n0.000000 5.184519 -0.000239\n4.964462 0.000000 0.000000\n0.000000 -0.000568 -7.285978\nMg Cr O\n4 4 12\ndirect\n0.063662 0.986253 0.750001 Mg\n0.436338 0.486254 0.250000 Mg\n0.563662 0.513746 0.750001 Mg\n0.936338 0.013746 0.250000 Mg\n0.000000 0.500000 0.000000 Cr\n0.500000 0.000000 0.000000 Cr\n0.500000 0.000000 0.500000 Cr\n-0.000000 0.500000 0.500000 Cr\n0.189223 0.183996 0.064595 O\n0.310777 0.683996 0.935405 O\n0.689223 0.316004 0.064595 O\n0.810777 0.816004 0.935405 O\n0.189226 0.183999 0.435403 O\n0.947292 0.375209 0.750000 O\n0.447292 0.124791 0.750000 O\n0.052708 0.624791 0.250001 O\n0.689226 0.316001 0.435403 O\n0.552708 0.875209 0.250001 O\n0.310773 0.683999 0.564598 O\n0.810774 0.816001 0.564598 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Mg",
"Cr",
"O"
],
"chemical_system": "Cr-Mg-O",
"density": 4.402600244665111,
"density_atomic": 0.10665015166033151,
"volume": 187.52903477997577,
"volume_molar": 5.646631220159749,
"formula_full": "Mg4 Cr4 O12",
"formula_reduced": "MgCrO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.8964253899999997,
"spacegroup": 62
},
{
"id": "jvasp-116088",
"created_at": "2022-09-04T14:38:40.573209Z",
"updated_at": "2022-09-04T14:38:40.573237Z",
"structure_string": "Zr1 Tl1 F3\n1.0\n3.323659 -2.903081 -0.206031\n3.323659 2.903081 -0.206031\n-0.544755 0.000000 4.383976\nZr Tl F\n1 1 3\ndirect\n0.498761 0.498761 0.488745 Zr\n-0.001787 -0.001787 -0.012429 Tl\n-0.001301 0.498583 0.487599 F\n0.497832 0.497832 0.988634 F\n0.498583 -0.001301 0.487599 F\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Zr",
"Tl",
"F"
],
"chemical_system": "F-Tl-Zr",
"density": 6.9745944205541806,
"density_atomic": 0.05955996939251918,
"volume": 83.94900217373193,
"volume_molar": 10.111054155035195,
"formula_full": "Zr1 Tl1 F3",
"formula_reduced": "ZrTlF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.1842875895,
"spacegroup": 166
},
{
"id": "jvasp-115085",
"created_at": "2022-09-04T14:38:43.936009Z",
"updated_at": "2022-09-04T14:38:43.936027Z",
"structure_string": "Hf1 Mg1 O3\n1.0\n4.053149 0.000000 0.000000\n0.000000 4.053149 0.000000\n-0.000000 0.000000 4.053149\nHf Mg O\n1 1 3\ndirect\n0.500001 0.500001 0.500001 Hf\n0.000000 0.000000 0.000000 Mg\n0.500001 0.500001 0.000000 O\n0.500001 0.000000 0.500001 O\n0.000000 0.500001 0.500001 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Hf",
"Mg",
"O"
],
"chemical_system": "Hf-Mg-O",
"density": 6.254421503155091,
"density_atomic": 0.07509176221162886,
"volume": 66.58519993056828,
"volume_molar": 8.019708930292488,
"formula_full": "Hf1 Mg1 O3",
"formula_reduced": "HfMgO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.9569085099999992,
"spacegroup": 221
},
{
"id": "jvasp-115587",
"created_at": "2022-09-04T14:38:47.147955Z",
"updated_at": "2022-09-04T14:38:47.147988Z",
"structure_string": "Ba1 Zr1 O3\n1.0\n4.222833 0.000000 0.000000\n0.000000 4.222833 0.000000\n-0.000000 -0.000000 4.222833\nBa Zr O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Zr\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ba",
"Zr",
"O"
],
"chemical_system": "Ba-O-Zr",
"density": 6.098314019614749,
"density_atomic": 0.06639850239576316,
"volume": 75.30290322209206,
"volume_molar": 9.069693656801919,
"formula_full": "Ba1 Zr1 O3",
"formula_reduced": "BaZrO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.6906061939999997,
"spacegroup": 221
},
{
"id": "jvasp-114788",
"created_at": "2022-09-04T14:38:41.283002Z",
"updated_at": "2022-09-04T14:38:41.283020Z",
"structure_string": "Na1 Sn1 Cl3\n1.0\n5.545583 -0.204058 1.140110\n0.021878 5.550615 1.130186\n1.410654 1.374051 5.355463\nNa Sn Cl\n1 1 3\ndirect\n0.965807 0.977953 0.567292 Na\n0.440323 0.451872 0.677117 Sn\n0.461705 -0.039785 0.556134 Cl\n-0.051757 0.473677 0.556818 Cl\n0.623919 0.636281 0.132637 Cl\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Na",
"Sn",
"Cl"
],
"chemical_system": "Cl-Na-Sn",
"density": 2.801307582818297,
"density_atomic": 0.0340037738447676,
"volume": 147.04250248298206,
"volume_molar": 17.710212953103348,
"formula_full": "Na1 Sn1 Cl3",
"formula_reduced": "NaSnCl3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0104739999999999,
"spacegroup": 8
},
{
"id": "jvasp-114009",
"created_at": "2022-09-04T14:38:43.971674Z",
"updated_at": "2022-09-04T14:38:43.971692Z",
"structure_string": "Zr1 B1 O3\n1.0\n3.435056 -0.000000 -0.000000\n-0.000000 3.435056 -0.000000\n-0.000000 -0.000000 3.435056\nZr B O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500000 0.500000 0.500000 B\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Zr",
"B",
"O"
],
"chemical_system": "B-O-Zr",
"density": 6.1466007570833785,
"density_atomic": 0.12335834657752585,
"volume": 40.53232017711665,
"volume_molar": 4.881826748719693,
"formula_full": "Zr1 B1 O3",
"formula_reduced": "ZrBO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.0263695166666658,
"spacegroup": 221
},
{
"id": "jvasp-114405",
"created_at": "2022-09-04T14:38:40.537477Z",
"updated_at": "2022-09-04T14:38:40.537505Z",
"structure_string": "Y1 Zr1 O3\n1.0\n4.107301 0.000000 -0.000000\n-0.000000 4.107301 -0.000000\n0.000000 0.000000 4.107301\nY Zr O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500000 Zr\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Y",
"Zr",
"O"
],
"chemical_system": "O-Y-Zr",
"density": 5.467114793890283,
"density_atomic": 0.07216064585495605,
"volume": 69.28984546576916,
"volume_molar": 8.345464052670193,
"formula_full": "Y1 Zr1 O3",
"formula_reduced": "YZrO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.46832209,
"spacegroup": 221
},
{
"id": "jvasp-116190",
"created_at": "2022-09-04T14:38:40.551257Z",
"updated_at": "2022-09-04T14:38:40.551282Z",
"structure_string": "Na3 I1 O1\n1.0\n4.675488 0.000000 0.000000\n-0.000000 4.675488 -0.000000\n0.000000 -0.000000 4.675488\nNa I O\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Na\n0.500000 0.000000 0.500000 Na\n0.500000 0.500000 0.000000 Na\n0.000000 0.000000 0.000000 I\n0.500000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Na",
"I",
"O"
],
"chemical_system": "I-Na-O",
"density": 3.442264499472857,
"density_atomic": 0.048920305928942934,
"volume": 102.20704685008579,
"volume_molar": 12.310104455902625,
"formula_full": "Na3 I1 O1",
"formula_reduced": "Na3IO",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-117264",
"created_at": "2022-09-04T14:38:47.054319Z",
"updated_at": "2022-09-04T14:38:47.054336Z",
"structure_string": "Na4 V4 O12\n1.0\n3.615116 -0.000000 0.000000\n0.000000 5.267566 0.000000\n-0.000000 -0.000000 14.363307\nNa V O\n4 4 12\ndirect\n0.250000 0.866408 0.330294 Na\n0.750001 0.133592 0.669706 Na\n0.750001 0.366408 0.169706 Na\n0.250000 0.633593 0.830294 Na\n0.750001 0.089163 0.915498 V\n0.250000 0.910837 0.084502 V\n0.250000 0.589164 0.584502 V\n0.750001 0.410837 0.415498 V\n0.250000 0.600932 0.103934 O\n0.250000 0.899069 0.603934 O\n0.750001 0.935601 0.812632 O\n0.750001 0.564400 0.312632 O\n0.750001 -0.006504 0.052505 O\n0.750001 0.100932 0.396067 O\n0.750001 0.506504 0.552505 O\n0.250000 0.493496 0.447495 O\n0.250000 0.064399 0.187368 O\n0.250000 0.435601 0.687368 O\n0.750001 0.399068 0.896067 O\n0.250000 0.006504 0.947495 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Na",
"V",
"O"
],
"chemical_system": "Na-O-V",
"density": 2.9609502200478914,
"density_atomic": 0.07312120326586351,
"volume": 273.51847489819636,
"volume_molar": 8.235833781487326,
"formula_full": "Na4 V4 O12",
"formula_reduced": "NaVO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.82599474,
"spacegroup": 62
},
{
"id": "jvasp-116796",
"created_at": "2022-09-04T14:38:43.680083Z",
"updated_at": "2022-09-04T14:38:43.680104Z",
"structure_string": "Mn6 Pb6 O18\n1.0\n5.522675 0.000000 0.181267\n2.761337 4.782095 0.090633\n-0.050725 0.000000 13.596629\nMn Pb O\n6 6 18\ndirect\n0.000000 0.000000 0.000000 Mn\n-0.000000 -0.000000 0.500000 Mn\n0.672618 0.674137 0.844907 Mn\n0.653244 0.674137 0.655093 Mn\n0.327380 0.325864 0.155093 Mn\n0.346754 0.325864 0.344907 Mn\n0.329222 0.341824 0.591492 Pb\n0.328951 0.341824 0.908508 Pb\n0.670776 0.658177 0.408508 Pb\n0.990883 0.018231 0.750000 Pb\n0.009116 0.981770 0.250000 Pb\n0.671047 0.658177 0.091492 Pb\n0.788857 0.328889 0.582090 O\n0.206766 0.167147 0.438500 O\n0.626088 0.167147 0.061500 O\n0.288695 0.828257 0.595152 O\n0.883045 0.828257 0.904848 O\n0.711303 0.171744 0.404848 O\n0.116953 0.171744 0.095152 O\n0.882251 0.328889 0.917910 O\n0.039749 0.473303 0.261214 O\n0.117747 0.671112 0.082090 O\n0.513050 0.526698 0.761214 O\n0.960249 0.526698 0.738786 O\n0.486948 0.473303 0.238786 O\n0.373911 0.832854 0.938500 O\n0.513282 0.973434 0.750000 O\n0.486716 0.026567 0.250000 O\n0.211141 0.671112 0.417910 O\n0.793232 0.832854 0.561500 O\n",
"nsites": 30,
"nelements": 3,
"elements": [
"Mn",
"Pb",
"O"
],
"chemical_system": "Mn-O-Pb",
"density": 8.604007147537411,
"density_atomic": 0.08353512850525156,
"volume": 359.13035074955326,
"volume_molar": 7.20911174467327,
"formula_full": "Mn6 Pb6 O18",
"formula_reduced": "MnPbO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.174245712275862,
"spacegroup": 15
},
{
"id": "jvasp-118251",
"created_at": "2022-09-04T14:38:48.294320Z",
"updated_at": "2022-09-04T14:38:48.294340Z",
"structure_string": "Mn1 In1 F3\n1.0\n4.255302 0.000000 -0.000000\n0.000000 4.255302 -0.000000\n0.000000 0.000000 4.255302\nMn In F\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 In\n0.000000 0.500000 0.500000 F\n0.500000 0.500000 0.000000 F\n0.500000 0.000000 0.500000 F\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Mn",
"In",
"F"
],
"chemical_system": "F-In-Mn",
"density": 4.886609484369607,
"density_atomic": 0.06489015951886695,
"volume": 77.05328569189662,
"volume_molar": 9.280514649141908,
"formula_full": "Mn1 In1 F3",
"formula_reduced": "MnInF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.2637916117758621,
"spacegroup": 221
}
]
}