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=-nelements&page=877",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=875",
"results": [
{
"id": "jvasp-118280",
"created_at": "2022-09-04T14:38:32.169255Z",
"updated_at": "2022-09-04T14:38:32.169281Z",
"structure_string": "Mn1 Zn1 F3\n1.0\n2.901079 -2.900225 0.000317\n2.901079 2.900225 0.000317\n0.000228 0.000000 4.102596\nMn Zn F\n1 1 3\ndirect\n0.497894 0.497894 0.500015 Mn\n0.997734 0.997734 0.999222 Zn\n0.498007 0.498007 0.000079 F\n0.997925 0.498070 0.500321 F\n0.498070 0.997925 0.500321 F\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Mn",
"Zn",
"F"
],
"chemical_system": "F-Mn-Zn",
"density": 4.265611812998614,
"density_atomic": 0.07242525147831777,
"volume": 69.03669504684936,
"volume_molar": 8.314973903546434,
"formula_full": "Mn1 Zn1 F3",
"formula_reduced": "MnZnF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.1387627641379312,
"spacegroup": 221
},
{
"id": "jvasp-21082",
"created_at": "2022-09-04T14:38:32.169408Z",
"updated_at": "2022-09-04T14:38:32.169443Z",
"structure_string": "Nd2 B4 C4\n1.0\n5.389272 0.000000 0.000000\n-0.000000 5.389272 0.000000\n0.000000 0.000000 3.835037\nNd B C\n2 4 4\ndirect\n0.500000 0.500000 0.000000 Nd\n0.000000 0.000000 0.000000 Nd\n0.138296 0.638296 0.500000 B\n0.638296 0.861703 0.500000 B\n0.861703 0.361703 0.500000 B\n0.361703 0.138296 0.500000 B\n0.839420 0.660580 0.500000 C\n0.339420 0.839420 0.500000 C\n0.660580 0.160580 0.500000 C\n0.160580 0.339420 0.500000 C\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Nd",
"B",
"C"
],
"chemical_system": "B-C-Nd",
"density": 5.661622415235289,
"density_atomic": 0.08977806383824301,
"volume": 111.38578370343816,
"volume_molar": 6.707808681250187,
"formula_full": "Nd2 B4 C4",
"formula_reduced": "Nd(BC)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 4.7282313333333335,
"spacegroup": 127
},
{
"id": "jvasp-16662",
"created_at": "2022-09-04T14:38:32.204514Z",
"updated_at": "2022-09-04T14:38:32.204529Z",
"structure_string": "Sr2 Sb2 Au2\n1.0\n2.718789 -4.709081 -0.000000\n2.718789 4.709081 -0.000000\n0.000000 0.000000 6.492290\nSr Sb Au\n2 2 2\ndirect\n0.666667 0.333333 0.750000 Sr\n0.333333 0.666667 0.250000 Sr\n0.333333 0.666667 0.750000 Sb\n0.666667 0.333333 0.250000 Sb\n0.000000 0.000000 0.500000 Au\n0.000000 0.000000 0.000000 Au\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sr",
"Sb",
"Au"
],
"chemical_system": "Au-Sb-Sr",
"density": 8.1177583472906,
"density_atomic": 0.03609206069605796,
"volume": 166.24154687447177,
"volume_molar": 16.68549992397012,
"formula_full": "Sr2 Sb2 Au2",
"formula_reduced": "SrSbAu",
"formula_anonymous": "ABC",
"energy_above_hull": 0.3069839450000001,
"spacegroup": 194
},
{
"id": "jvasp-24369",
"created_at": "2022-09-04T14:38:32.247880Z",
"updated_at": "2022-09-04T14:38:32.247907Z",
"structure_string": "Li2 V4 F12\n1.0\n4.680977 -0.000000 0.000000\n-0.000000 4.680977 0.000000\n0.000000 0.000000 9.319307\nLi V F\n2 4 12\ndirect\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Li\n0.000000 0.000000 0.667795 V\n0.500000 0.500000 0.167794 V\n0.500000 0.500000 0.832206 V\n0.000000 0.000000 0.332206 V\n0.801324 0.198677 0.168045 F\n0.801324 0.198677 0.831955 F\n0.198677 0.801324 0.831955 F\n0.301324 0.301324 0.331955 F\n0.695717 0.695717 0.000000 F\n0.304283 0.304283 0.000000 F\n0.195717 0.804283 0.500000 F\n0.198677 0.801324 0.168045 F\n0.301324 0.301324 0.668046 F\n0.698677 0.698677 0.668046 F\n0.804283 0.195717 0.500000 F\n0.698677 0.698677 0.331955 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Li",
"V",
"F"
],
"chemical_system": "F-Li-V",
"density": 3.623812780579311,
"density_atomic": 0.08814869192302922,
"volume": 204.2004209854579,
"volume_molar": 6.83179821347603,
"formula_full": "Li2 V4 F12",
"formula_reduced": "LiV2F6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.7898855661111113,
"spacegroup": 136
},
{
"id": "jvasp-53404",
"created_at": "2022-09-04T14:38:32.409446Z",
"updated_at": "2022-09-04T14:38:32.409465Z",
"structure_string": "In5 Cu1 S8\n1.0\n6.618505 0.000000 3.821196\n2.206169 6.239986 3.821196\n0.000000 0.000000 7.642391\nIn Cu S\n5 1 8\ndirect\n0.143744 0.618752 0.618752 In\n0.618752 0.143744 0.618752 In\n0.000000 0.000000 0.000000 In\n0.618752 0.618752 0.143745 In\n0.618752 0.618752 0.618752 In\n0.250000 0.250000 0.250000 Cu\n0.402059 0.865981 0.865981 S\n0.869956 0.376682 0.376682 S\n0.376682 0.869956 0.376682 S\n0.865981 0.402059 0.865981 S\n0.376682 0.376682 0.869956 S\n0.865981 0.865981 0.402059 S\n0.376682 0.376682 0.376682 S\n0.865981 0.865981 0.865981 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"In",
"Cu",
"S"
],
"chemical_system": "Cu-In-S",
"density": 4.704241649818622,
"density_atomic": 0.044356295268021984,
"volume": 315.6259988667966,
"volume_molar": 13.576744233510354,
"formula_full": "In5 Cu1 S8",
"formula_reduced": "In5CuS8",
"formula_anonymous": "AB5C8",
"energy_above_hull": 1.0407307357142856,
"spacegroup": 216
},
{
"id": "jvasp-54751",
"created_at": "2022-09-04T14:38:32.202116Z",
"updated_at": "2022-09-04T14:38:32.202150Z",
"structure_string": "H4 I4 O12\n1.0\n5.473272 0.000000 0.000000\n0.000000 5.840325 0.000000\n0.000000 0.000000 7.676923\nH I O\n4 4 12\ndirect\n0.760090 0.825853 0.366686 H\n0.739909 0.174147 0.866686 H\n0.260091 0.674146 0.633313 H\n0.239909 0.325853 0.133313 H\n0.790348 0.407232 0.338721 I\n0.709651 0.592767 0.838721 I\n0.290349 0.092767 0.661279 I\n0.209651 0.907232 0.161279 I\n0.903639 0.337007 0.554614 O\n0.596360 0.662993 0.054614 O\n0.340496 0.197228 0.080925 O\n0.159504 0.802772 0.580925 O\n0.840496 0.302772 0.919075 O\n0.575118 0.977080 0.757505 O\n0.075118 0.522919 0.242495 O\n0.424881 0.477080 0.742495 O\n0.096360 0.837006 0.945385 O\n0.924881 0.022919 0.257505 O\n0.659504 0.697227 0.419075 O\n0.403640 0.162993 0.445385 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"H",
"I",
"O"
],
"chemical_system": "H-I-O",
"density": 4.761347644263316,
"density_atomic": 0.08150021687423245,
"volume": 245.39811999351022,
"volume_molar": 7.389110104201445,
"formula_full": "H4 I4 O12",
"formula_reduced": "HIO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.9143233550000005,
"spacegroup": 19
},
{
"id": "jvasp-116555",
"created_at": "2022-09-04T14:38:32.230011Z",
"updated_at": "2022-09-04T14:38:32.230037Z",
"structure_string": "Er6 Si4 Ni12\n1.0\n7.102069 -0.000000 -2.510960\n-3.551034 6.150572 -2.510960\n-0.000000 -0.000000 7.532881\nEr Si Ni\n6 4 12\ndirect\n0.713376 0.713376 0.000000 Er\n0.286624 0.000000 0.286624 Er\n0.000000 0.286624 0.286624 Er\n0.286624 0.286624 0.000000 Er\n0.713376 0.000000 0.713376 Er\n0.000000 0.713376 0.713376 Er\n0.000000 0.000000 0.500000 Si\n0.000000 0.500000 0.000000 Si\n0.500000 0.000000 0.000000 Si\n0.500000 0.500000 0.500000 Si\n0.669633 0.669632 0.339264 Ni\n0.660737 0.330368 0.330368 Ni\n0.330368 0.000000 0.669632 Ni\n0.330368 0.669632 0.000000 Ni\n0.000000 0.330368 0.669632 Ni\n0.330368 0.330368 0.660736 Ni\n0.669633 0.330368 0.000000 Ni\n0.000000 0.669632 0.330368 Ni\n0.669632 0.000000 0.330368 Ni\n0.669633 0.339263 0.669632 Ni\n0.330368 0.660736 0.330368 Ni\n0.339264 0.669632 0.669632 Ni\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Er",
"Si",
"Ni"
],
"chemical_system": "Er-Ni-Si",
"density": 9.185667374439946,
"density_atomic": 0.06685920063454731,
"volume": 329.04970133059317,
"volume_molar": 9.007198265676324,
"formula_full": "Er6 Si4 Ni12",
"formula_reduced": "Er3(SiNi3)2",
"formula_anonymous": "A2B3C6",
"energy_above_hull": 1.7614428727272726,
"spacegroup": 229
},
{
"id": "jvasp-17507",
"created_at": "2022-09-04T14:38:32.233990Z",
"updated_at": "2022-09-04T14:38:32.234015Z",
"structure_string": "Tb3 In3 Cu3\n1.0\n3.747763 -6.491316 0.000000\n3.747763 6.491316 0.000000\n0.000000 -0.000000 3.924853\nTb In Cu\n3 3 3\ndirect\n0.409704 -0.000000 0.500000 Tb\n0.590295 0.590295 0.500000 Tb\n-0.000000 0.409704 0.500000 Tb\n0.255655 0.255655 0.000000 In\n0.744345 -0.000000 0.000000 In\n-0.000000 0.744345 0.000000 In\n0.333333 0.666667 0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.666667 0.333333 0.000000 Cu\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Tb",
"In",
"Cu"
],
"chemical_system": "Cu-In-Tb",
"density": 8.798623188268449,
"density_atomic": 0.0471285684107105,
"volume": 190.96697191325353,
"volume_molar": 12.778110948584214,
"formula_full": "Tb3 In3 Cu3",
"formula_reduced": "TbInCu",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0992970924999999,
"spacegroup": 189
},
{
"id": "jvasp-45134",
"created_at": "2022-09-04T14:38:32.252513Z",
"updated_at": "2022-09-04T14:38:32.252538Z",
"structure_string": "Ni1 Te4 O12\n1.0\n5.073152 0.005250 -0.006708\n0.058704 5.593712 0.067287\n0.025822 0.774777 7.552419\nNi Te O\n1 4 12\ndirect\n0.992794 0.599741 0.291462 Ni\n0.003028 0.989330 0.982262 Te\n0.504004 0.465144 0.502363 Te\n0.016938 -0.003352 0.510972 Te\n0.492172 0.475204 0.985696 Te\n0.299714 0.780366 0.903746 O\n0.169553 0.611669 0.532563 O\n0.809628 0.660691 0.055926 O\n0.341142 0.450800 0.234591 O\n0.638442 0.492381 0.740976 O\n0.822533 0.306801 0.410208 O\n0.126855 0.930503 0.221423 O\n0.692658 0.172506 0.059848 O\n0.854573 0.003027 0.749000 O\n0.682193 0.750644 0.405542 O\n0.190718 0.289180 0.912260 O\n0.363041 0.143969 0.560465 O\n",
"nsites": 17,
"nelements": 3,
"elements": [
"Ni",
"Te",
"O"
],
"chemical_system": "Ni-O-Te",
"density": 5.904165289870709,
"density_atomic": 0.07941901269387272,
"volume": 214.05453711100557,
"volume_molar": 7.582744428230113,
"formula_full": "Ni1 Te4 O12",
"formula_reduced": "Ni(TeO3)4",
"formula_anonymous": "AB4C12",
"energy_above_hull": 2.424526792156862,
"spacegroup": 1
},
{
"id": "jvasp-20835",
"created_at": "2022-09-04T14:38:32.253354Z",
"updated_at": "2022-09-04T14:38:32.253381Z",
"structure_string": "K2 Si1 F6\n1.0\n4.915705 -0.000000 2.838084\n1.638569 4.634571 2.838084\n-0.000000 -0.000000 5.676167\nK Si F\n2 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Si\n0.214155 0.785844 0.785844 F\n0.214155 0.785844 0.214155 F\n0.785844 0.214155 0.785845 F\n0.785844 0.214155 0.214155 F\n0.785844 0.785844 0.214155 F\n0.214155 0.214155 0.785845 F\n",
"nsites": 9,
"nelements": 3,
"elements": [
"K",
"Si",
"F"
],
"chemical_system": "F-K-Si",
"density": 2.8285176932016998,
"density_atomic": 0.06959723610791602,
"volume": 129.31548008666306,
"volume_molar": 8.652844705876245,
"formula_full": "K2 Si1 F6",
"formula_reduced": "K2SiF6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-17525",
"created_at": "2022-09-04T14:38:32.280700Z",
"updated_at": "2022-09-04T14:38:32.280721Z",
"structure_string": "Pr2 Cu2 Sb4\n1.0\n4.389398 0.000000 0.000000\n0.000000 4.389398 0.000000\n-0.000000 0.000000 10.242632\nPr Cu Sb\n2 2 4\ndirect\n0.500000 0.000000 0.750366 Pr\n0.000000 0.500000 0.249633 Pr\n0.500000 0.500000 0.000000 Cu\n0.000000 0.000000 0.000000 Cu\n0.500000 0.000000 0.151969 Sb\n0.000000 0.500000 0.848031 Sb\n0.500000 0.500000 0.500000 Sb\n0.000000 0.000000 0.500000 Sb\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Pr",
"Cu",
"Sb"
],
"chemical_system": "Cu-Pr-Sb",
"density": 7.538936236145695,
"density_atomic": 0.04053857650817045,
"volume": 197.3428938331769,
"volume_molar": 14.855333558114092,
"formula_full": "Pr2 Cu2 Sb4",
"formula_reduced": "PrCuSb2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.950505625,
"spacegroup": 129
},
{
"id": "jvasp-21599",
"created_at": "2022-09-04T14:38:32.378852Z",
"updated_at": "2022-09-04T14:38:32.378881Z",
"structure_string": "Nb5 Ni4 P4\n1.0\n3.443699 -0.000000 0.864204\n1.721849 7.091830 0.432102\n-0.004336 -0.000000 7.310644\nNb Ni P\n5 4 4\ndirect\n0.805594 0.064007 0.324805 Nb\n0.130400 0.675195 0.064006 Nb\n0.869600 0.324805 0.935993 Nb\n0.194405 0.935994 0.675194 Nb\n0.500000 0.000000 -0.000000 Nb\n0.914637 0.694892 0.475833 Ni\n0.085362 0.305108 0.524166 Ni\n0.609530 0.475834 0.305107 Ni\n0.390470 0.524166 0.694892 Ni\n0.556016 0.203797 0.684168 P\n0.240186 0.315831 0.203797 P\n0.759813 0.684169 0.796202 P\n0.443983 0.796203 0.315831 P\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Nb",
"Ni",
"P"
],
"chemical_system": "Nb-Ni-P",
"density": 7.6551018811575045,
"density_atomic": 0.07280137451915697,
"volume": 178.56805707121887,
"volume_molar": 8.272015191712258,
"formula_full": "Nb5 Ni4 P4",
"formula_reduced": "Nb5(NiP)4",
"formula_anonymous": "A4B4C5",
"energy_above_hull": 4.051809892307692,
"spacegroup": 87
}
]
}