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=3418",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=3416",
"results": [
{
"id": "jvasp-121318",
"created_at": "2022-09-04T14:38:53.464886Z",
"updated_at": "2022-09-04T14:38:53.464912Z",
"structure_string": "Nd4 As8 Au4\n1.0\n4.115924 -0.000000 0.000000\n0.000000 4.150628 0.000000\n0.000000 0.000000 20.679346\nNd As Au\n4 8 4\ndirect\n0.250000 0.225602 0.118037 Nd\n0.749999 0.725602 0.381963 Nd\n0.250000 0.274399 0.618037 Nd\n0.749999 0.774399 0.881963 Nd\n0.250000 0.704178 0.001706 As\n0.749999 0.728127 0.157114 As\n0.250000 0.228126 0.342886 As\n0.749999 0.204178 0.498294 As\n0.250000 0.795822 0.501706 As\n0.749999 0.771874 0.657114 As\n0.250000 0.271874 0.842886 As\n0.749999 0.295822 0.998294 As\n0.749999 0.208222 0.251472 Au\n0.250000 0.708222 0.248528 Au\n0.749999 0.291778 0.751472 Au\n0.250000 0.791778 0.748528 Au\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Nd",
"As",
"Au"
],
"chemical_system": "As-Au-Nd",
"density": 9.232480743564293,
"density_atomic": 0.04528996910787838,
"volume": 353.2791104778372,
"volume_molar": 13.29685331790704,
"formula_full": "Nd4 As8 Au4",
"formula_reduced": "NdAs2Au",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4747731425,
"spacegroup": 62
},
{
"id": "jvasp-121317",
"created_at": "2022-09-04T14:38:53.861263Z",
"updated_at": "2022-09-04T14:38:53.861281Z",
"structure_string": "Mn4 Ni2 O8\n1.0\n4.945751 -0.292182 -3.054218\n-1.631687 4.645050 -3.104058\n0.175405 0.292182 5.810158\nMn Ni O\n4 2 8\ndirect\n0.500000 0.500000 -0.000000 Mn\n0.500000 0.000000 0.000000 Mn\n0.499999 0.500000 0.499999 Mn\n-0.000001 0.500000 0.499999 Mn\n0.874993 0.124994 0.750000 Ni\n0.125005 0.875006 0.249999 Ni\n0.716800 0.738758 0.978042 O\n0.738750 0.260716 0.021965 O\n0.739285 0.261242 0.478043 O\n0.738749 0.716784 0.478034 O\n0.260714 0.738758 0.521956 O\n0.261249 0.283215 0.521965 O\n0.283199 0.261242 0.021957 O\n0.261248 0.739284 0.978033 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mn",
"Ni",
"O"
],
"chemical_system": "Mn-Ni-O",
"density": 5.544776986538232,
"density_atomic": 0.10050432868681831,
"volume": 139.29748283405206,
"volume_molar": 5.991921779573895,
"formula_full": "Mn4 Ni2 O8",
"formula_reduced": "Mn2NiO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.89880441182266,
"spacegroup": 227
},
{
"id": "jvasp-121316",
"created_at": "2022-09-04T14:38:50.141975Z",
"updated_at": "2022-09-04T14:38:50.142002Z",
"structure_string": "Li7 Mn4 Co1 O12\n1.0\n4.888965 -0.106016 0.427162\n0.798979 4.733614 1.428726\n0.075873 0.134440 8.579456\nLi Mn Co O\n7 4 1 12\ndirect\n0.247131 0.413390 0.080559 Li\n0.752647 0.581809 0.904819 Li\n0.244034 0.750164 0.744144 Li\n0.242949 0.088324 0.425469 Li\n0.751794 0.250034 0.253170 Li\n0.760404 0.920184 0.589094 Li\n0.000356 0.333365 0.667314 Li\n-0.000054 0.005353 0.992089 Mn\n0.500274 0.495298 0.506845 Mn\n0.000012 0.665064 0.336905 Mn\n0.499990 0.830848 0.168749 Mn\n0.499958 0.166636 0.831629 Co\n0.128752 0.022316 0.202135 O\n0.630165 0.183449 0.038322 O\n0.132760 0.343949 0.881660 O\n0.137963 0.703291 0.527140 O\n0.626207 0.856035 0.371226 O\n0.607416 0.523479 0.704568 O\n0.369732 0.811700 0.964793 O\n0.868018 0.963490 0.805321 O\n0.392629 0.145573 0.627355 O\n0.373942 0.476561 0.296327 O\n0.870721 0.646402 0.128809 O\n0.862186 0.323266 0.451571 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Co",
"O"
],
"chemical_system": "Co-Li-Mn-O",
"density": 4.350049447454472,
"density_atomic": 0.12107853030390821,
"volume": 198.2184615204676,
"volume_molar": 4.973747818778748,
"formula_full": "Li7 Mn4 Co1 O12",
"formula_reduced": "Li7Mn4CoO12",
"formula_anonymous": "AB4C7D12",
"energy_above_hull": 2.786429661063218,
"spacegroup": 1
},
{
"id": "jvasp-121315",
"created_at": "2022-09-04T14:38:50.125888Z",
"updated_at": "2022-09-04T14:38:50.125915Z",
"structure_string": "Li4 Mn3 Co1 O8\n1.0\n2.836684 0.132196 -0.021309\n-0.266295 5.763017 -0.077624\n0.062273 -0.050098 8.082644\nLi Mn Co O\n4 3 1 8\ndirect\n0.000001 0.500000 0.000000 Li\n0.500016 0.757153 0.245158 Li\n0.499983 0.242847 0.754841 Li\n-0.000000 -0.000000 0.500000 Li\n0.499977 0.256466 0.250763 Mn\n0.000000 0.500000 0.500000 Mn\n0.500022 0.743535 0.749236 Mn\n0.000000 0.000000 0.000000 Co\n0.500198 0.766909 0.987795 O\n0.000194 0.021338 0.241175 O\n0.000224 0.508795 0.743844 O\n0.500221 0.263510 0.494131 O\n0.499801 0.233092 0.012204 O\n-0.000223 0.491205 0.256156 O\n-0.000193 0.978663 0.758825 O\n0.499778 0.736491 0.505869 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Co",
"O"
],
"chemical_system": "Co-Li-Mn-O",
"density": 4.759200171525154,
"density_atomic": 0.12083301269296252,
"volume": 132.4141444743756,
"volume_molar": 4.983853853997914,
"formula_full": "Li4 Mn3 Co1 O8",
"formula_reduced": "Li4Mn3CoO8",
"formula_anonymous": "AB3C4D8",
"energy_above_hull": 2.8467187890086203,
"spacegroup": 10
},
{
"id": "jvasp-121313",
"created_at": "2022-09-04T14:38:54.983276Z",
"updated_at": "2022-09-04T14:38:54.983308Z",
"structure_string": "Rb3 Au1 S1\n1.0\n6.229942 0.000000 -0.000000\n0.000000 6.229942 -0.000000\n0.000000 0.000000 6.229942\nRb Au S\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Rb\n0.500000 0.500000 0.000000 Rb\n0.500000 0.000000 0.500000 Rb\n0.000000 0.000000 0.000000 Au\n0.500000 0.500000 0.500000 S\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"Au",
"S"
],
"chemical_system": "Au-Rb-S",
"density": 3.3337125137671038,
"density_atomic": 0.020678450565246368,
"volume": 241.797613618273,
"volume_molar": 29.12278529282666,
"formula_full": "Rb3 Au1 S1",
"formula_reduced": "Rb3AuS",
"formula_anonymous": "ABC3",
"energy_above_hull": null,
"spacegroup": 221
},
{
"id": "jvasp-121312",
"created_at": "2022-09-04T14:38:55.400272Z",
"updated_at": "2022-09-04T14:38:55.400288Z",
"structure_string": "Rb2 Au2 S2\n1.0\n3.284332 -4.054509 0.000000\n3.284332 4.054509 -0.000000\n0.000000 -0.000000 6.700401\nRb Au S\n2 2 2\ndirect\n0.624012 0.375988 0.750000 Rb\n0.375988 0.624012 0.250000 Rb\n0.000000 0.000000 0.500000 Au\n0.000000 0.000000 0.000000 Au\n0.202274 0.797726 0.750000 S\n0.797726 0.202274 0.250000 S\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Rb",
"Au",
"S"
],
"chemical_system": "Au-Rb-S",
"density": 5.853057095272015,
"density_atomic": 0.033622897713564956,
"volume": 178.44981866566891,
"volume_molar": 17.910832110018895,
"formula_full": "Rb2 Au2 S2",
"formula_reduced": "RbAuS",
"formula_anonymous": "ABC",
"energy_above_hull": null,
"spacegroup": 63
},
{
"id": "jvasp-121311",
"created_at": "2022-09-04T14:38:54.888575Z",
"updated_at": "2022-09-04T14:38:54.888596Z",
"structure_string": "Rb1 Au1 S2\n1.0\n3.600812 0.000000 0.000000\n0.000000 3.600812 0.000000\n0.000000 -0.000000 8.054845\nRb Au S\n1 1 2\ndirect\n0.499999 0.499999 0.598776 Rb\n0.000000 0.000000 0.054674 Au\n0.000000 0.000000 0.360285 S\n0.499999 0.499999 0.996264 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Rb",
"Au",
"S"
],
"chemical_system": "Au-Rb-S",
"density": 5.51029595552943,
"density_atomic": 0.03830027648909809,
"volume": 104.43788835672173,
"volume_molar": 15.723491609033584,
"formula_full": "Rb1 Au1 S2",
"formula_reduced": "RbAuS2",
"formula_anonymous": "ABC2",
"energy_above_hull": null,
"spacegroup": 99
},
{
"id": "jvasp-121310",
"created_at": "2022-09-04T14:38:54.874529Z",
"updated_at": "2022-09-04T14:38:54.874555Z",
"structure_string": "Rb1 Au1 S2\n1.0\n3.593345 -0.000000 0.000000\n-0.000000 4.568736 0.000000\n0.000000 0.000000 6.750240\nRb Au S\n1 1 2\ndirect\n0.000000 0.500001 0.500000 Rb\n0.000000 0.000000 0.000000 Au\n0.500000 0.000000 0.766847 S\n0.500000 0.000000 0.233153 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Rb",
"Au",
"S"
],
"chemical_system": "Au-Rb-S",
"density": 5.193005871302829,
"density_atomic": 0.03609489622437137,
"volume": 110.81899155867885,
"volume_molar": 16.684189151190395,
"formula_full": "Rb1 Au1 S2",
"formula_reduced": "RbAuS2",
"formula_anonymous": "ABC2",
"energy_above_hull": null,
"spacegroup": 47
},
{
"id": "jvasp-12131",
"created_at": "2022-09-04T14:36:40.651801Z",
"updated_at": "2022-09-04T14:36:40.651821Z",
"structure_string": "Hf2 I2 N2\n1.0\n3.655120 0.006683 10.112893\n1.776979 3.194102 10.112893\n0.011342 0.006683 10.753156\nHf I N\n2 2 2\ndirect\n0.793192 0.793189 0.793192 Hf\n0.206809 0.206808 0.206809 Hf\n0.390186 0.390184 0.390186 I\n0.609815 0.609813 0.609815 I\n0.139131 0.139131 0.139131 N\n0.860870 0.860867 0.860870 N\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Hf",
"I",
"N"
],
"chemical_system": "Hf-I-N",
"density": 8.491416831987985,
"density_atomic": 0.04803035702568334,
"volume": 124.92099521124966,
"volume_molar": 12.538196950690525,
"formula_full": "Hf2 I2 N2",
"formula_reduced": "HfIN",
"formula_anonymous": "ABC",
"energy_above_hull": 2.538824175,
"spacegroup": 166
},
{
"id": "jvasp-121309",
"created_at": "2022-09-04T14:38:54.855513Z",
"updated_at": "2022-09-04T14:38:54.855539Z",
"structure_string": "Rb1 Au1 S1\n1.0\n6.801651 0.000000 0.000000\n0.000000 6.801651 -0.000000\n0.000000 0.000000 8.194801\nRb Au S\n1 1 1\ndirect\n0.000000 0.000000 0.658713 Rb\n0.000000 0.000000 0.280014 Au\n0.000000 0.000000 0.009790 S\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Rb",
"Au",
"S"
],
"chemical_system": "Au-Rb-S",
"density": 1.3775322529430343,
"density_atomic": 0.007913236669988064,
"volume": 379.11162336113034,
"volume_molar": 76.10211865442771,
"formula_full": "Rb1 Au1 S1",
"formula_reduced": "RbAuS",
"formula_anonymous": "ABC",
"energy_above_hull": null,
"spacegroup": 99
},
{
"id": "jvasp-121308",
"created_at": "2022-09-04T14:38:55.368258Z",
"updated_at": "2022-09-04T14:38:55.368273Z",
"structure_string": "Li1 Au1 O1\n1.0\n6.350127 -0.000000 0.000000\n-0.000000 6.350127 0.000000\n0.000000 0.000000 4.762595\nLi Au O\n1 1 1\ndirect\n0.026681 0.226527 0.000000 Li\n0.324356 -0.010293 0.000000 Au\n-0.082104 -0.005323 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Au",
"O"
],
"chemical_system": "Au-Li-O",
"density": 1.9014268236040608,
"density_atomic": 0.015621142021024966,
"volume": 192.04741855379137,
"volume_molar": 38.55121957085225,
"formula_full": "Li1 Au1 O1",
"formula_reduced": "LiAuO",
"formula_anonymous": "ABC",
"energy_above_hull": null,
"spacegroup": 6
},
{
"id": "jvasp-121307",
"created_at": "2022-09-04T14:38:54.815668Z",
"updated_at": "2022-09-04T14:38:54.815695Z",
"structure_string": "Li1 Au1 O1\n1.0\n2.784885 -0.000000 -0.000000\n-0.000000 2.784885 0.000000\n0.000000 0.000000 6.289403\nLi Au O\n1 1 1\ndirect\n0.000000 0.000000 0.395736 Li\n0.000000 0.000000 -0.007923 Au\n0.000000 0.000000 0.664679 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Au",
"O"
],
"chemical_system": "Au-Li-O",
"density": 7.486246700694707,
"density_atomic": 0.061503141464219244,
"volume": 48.77799618976071,
"volume_molar": 9.791598634849422,
"formula_full": "Li1 Au1 O1",
"formula_reduced": "LiAuO",
"formula_anonymous": "ABC",
"energy_above_hull": null,
"spacegroup": 99
}
]
}