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=4448",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=4446",
"results": [
{
"id": "jvasp-8218",
"created_at": "2022-09-04T14:38:17.197725Z",
"updated_at": "2022-09-04T14:38:17.197742Z",
"structure_string": "Hf2 S6\n1.0\n0.000000 5.123018 -0.012751\n3.604546 0.000000 0.000000\n0.000000 -1.152323 -8.941920\nHf S\n2 6\ndirect\n0.716064 0.250000 0.345334 Hf\n0.283937 0.750001 0.654666 Hf\n0.120484 0.250000 0.830229 S\n0.879517 0.750001 0.169771 S\n0.762022 0.750001 0.553434 S\n0.237979 0.250000 0.446566 S\n0.471062 0.750001 0.172751 S\n0.528939 0.250000 0.827249 S\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Hf",
"S"
],
"chemical_system": "Hf-S",
"density": 5.522904416779162,
"density_atomic": 0.048433234888492147,
"volume": 165.17583470148963,
"volume_molar": 12.43390158403579,
"formula_full": "Hf2 S6",
"formula_reduced": "HfS3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.45803325,
"spacegroup": 11
},
{
"id": "jvasp-19767",
"created_at": "2022-09-04T14:38:27.261430Z",
"updated_at": "2022-09-04T14:38:27.261456Z",
"structure_string": "Nb1 N1\n1.0\n2.732586 -0.000000 1.577659\n0.910862 2.576306 1.577659\n0.000000 0.000000 3.155318\nNb N\n1 1\ndirect\n0.500000 0.500001 0.500000 Nb\n0.000000 0.000000 0.000000 N\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Nb",
"N"
],
"chemical_system": "N-Nb",
"density": 7.992184842818686,
"density_atomic": 0.09003587235542242,
"volume": 22.21336837949291,
"volume_molar": 6.68860155675197,
"formula_full": "Nb1 N1",
"formula_reduced": "NbN",
"formula_anonymous": "AB",
"energy_above_hull": 3.035086325,
"spacegroup": 225
},
{
"id": "jvasp-117789",
"created_at": "2022-09-04T14:38:28.484677Z",
"updated_at": "2022-09-04T14:38:28.484698Z",
"structure_string": "I1 Br1\n1.0\n5.230316 0.000000 -0.000000\n-2.615158 4.529587 0.000000\n-0.000000 -0.000000 3.936816\nI Br\n1 1\ndirect\n0.333333 0.666667 0.000000 I\n0.000000 0.000000 0.000000 Br\n",
"nsites": 2,
"nelements": 2,
"elements": [
"I",
"Br"
],
"chemical_system": "Br-I",
"density": 3.6820168192704092,
"density_atomic": 0.021443631949887368,
"volume": 93.26778246678987,
"volume_molar": 28.08358571940343,
"formula_full": "I1 Br1",
"formula_reduced": "IBr",
"formula_anonymous": "AB",
"energy_above_hull": 0.2299359999999999,
"spacegroup": 187
},
{
"id": "jvasp-119011",
"created_at": "2022-09-04T14:38:32.435959Z",
"updated_at": "2022-09-04T14:38:32.435980Z",
"structure_string": "Mg8 O8\n1.0\n5.686084 0.006645 -5.824014\n-0.413358 4.027715 -7.060976\n-0.027951 -0.006645 8.139405\nMg O\n8 8\ndirect\n0.738050 0.070469 0.667580 Mg\n0.261950 0.929533 0.332419 Mg\n0.597112 0.429533 0.167581 Mg\n0.402888 0.570469 0.832419 Mg\n0.025172 0.689819 0.335353 Mg\n0.974827 0.310182 0.664647 Mg\n0.645535 0.810182 0.835353 Mg\n0.354465 0.189819 0.164647 Mg\n0.024623 0.190127 0.834494 O\n0.975376 0.809874 0.165506 O\n0.644367 0.309873 0.334495 O\n0.355633 0.690128 0.665505 O\n0.741820 0.570446 0.171375 O\n0.258179 0.429555 0.828625 O\n0.600929 0.929556 0.671374 O\n0.399070 0.070445 0.328625 O\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Mg",
"O"
],
"chemical_system": "Mg-O",
"density": 2.8864456859061,
"density_atomic": 0.08625649915457533,
"volume": 185.4932689921407,
"volume_molar": 6.981666099395092,
"formula_full": "Mg8 O8",
"formula_reduced": "MgO",
"formula_anonymous": "AB",
"energy_above_hull": 0.0561399999999998,
"spacegroup": 72
},
{
"id": "jvasp-20350",
"created_at": "2022-09-04T14:38:34.396668Z",
"updated_at": "2022-09-04T14:38:34.396688Z",
"structure_string": "Zr8 Sb16\n1.0\n3.939186 0.000000 0.000000\n0.000000 10.088690 0.000000\n0.000000 0.000000 15.139515\nZr Sb\n8 16\ndirect\n0.500000 0.668432 0.993233 Zr\n0.500000 0.331568 0.006766 Zr\n0.000000 0.168432 0.506766 Zr\n0.000000 0.831568 0.493234 Zr\n0.000000 0.978872 0.749410 Zr\n0.000000 0.021128 0.250589 Zr\n0.500000 0.478872 0.750589 Zr\n0.500000 0.521128 0.249411 Zr\n0.500000 0.011980 0.396766 Sb\n0.500000 0.988020 0.603234 Sb\n0.000000 0.730500 0.301404 Sb\n0.000000 0.269500 0.698596 Sb\n0.500000 0.230500 0.198596 Sb\n0.500000 0.769500 0.801404 Sb\n0.500000 0.839670 0.156496 Sb\n0.500000 0.617324 0.442322 Sb\n0.000000 0.339670 0.343504 Sb\n0.000000 0.660330 0.656496 Sb\n0.000000 0.488020 0.896765 Sb\n0.500000 0.382676 0.557678 Sb\n0.000000 0.117324 0.057678 Sb\n0.000000 0.882676 0.942322 Sb\n0.500000 0.160330 0.843503 Sb\n0.000000 0.511980 0.103234 Sb\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Zr",
"Sb"
],
"chemical_system": "Sb-Zr",
"density": 7.390922664534615,
"density_atomic": 0.03988944684369231,
"volume": 601.6628932971805,
"volume_molar": 15.097077639602007,
"formula_full": "Zr8 Sb16",
"formula_reduced": "ZrSb2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.0441922333333338,
"spacegroup": 58
},
{
"id": "jvasp-109566",
"created_at": "2022-09-04T14:38:28.473956Z",
"updated_at": "2022-09-04T14:38:28.473977Z",
"structure_string": "Mg1 Ni5\n1.0\n3.916993 0.002303 2.841819\n1.450446 3.638550 2.841819\n0.003394 0.002303 4.839293\nMg Ni\n1 5\ndirect\n0.000000 0.000000 0.000000 Mg\n0.823744 0.499999 0.176257 Ni\n0.176257 0.823743 0.500000 Ni\n0.499999 0.176255 0.823744 Ni\n0.329919 0.329919 0.329920 Ni\n0.670080 0.670080 0.670081 Ni\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Ni"
],
"chemical_system": "Mg-Ni",
"density": 7.65819025397079,
"density_atomic": 0.08707884840491274,
"volume": 68.90307014741707,
"volume_molar": 6.915733120398326,
"formula_full": "Mg1 Ni5",
"formula_reduced": "MgNi5",
"formula_anonymous": "AB5",
"energy_above_hull": 0.925889085714286,
"spacegroup": 155
},
{
"id": "jvasp-33867",
"created_at": "2022-09-04T14:38:34.400234Z",
"updated_at": "2022-09-04T14:38:34.400269Z",
"structure_string": "Ho2 Br6\n1.0\n9.574858 -0.000000 -0.000000\n-4.787428 8.292070 0.000000\n0.000000 0.000000 3.720998\nHo Br\n2 6\ndirect\n0.333334 0.666667 0.750000 Ho\n0.666667 0.333334 0.250001 Ho\n0.206773 0.413546 0.250001 Br\n0.586454 0.793227 0.250001 Br\n0.206774 0.793227 0.250001 Br\n0.793226 0.586454 0.750000 Br\n0.413547 0.206775 0.750000 Br\n0.793227 0.206775 0.750000 Br\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ho",
"Br"
],
"chemical_system": "Br-Ho",
"density": 4.548787584778649,
"density_atomic": 0.02707916377342246,
"volume": 295.43009772893373,
"volume_molar": 22.239020415802443,
"formula_full": "Ho2 Br6",
"formula_reduced": "HoBr3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-21671",
"created_at": "2022-09-04T14:38:35.391193Z",
"updated_at": "2022-09-04T14:38:35.391219Z",
"structure_string": "Tb8 Al8\n1.0\n5.620582 -0.000000 0.000000\n-0.000000 5.854183 0.000000\n0.000000 0.000000 11.471698\nTb Al\n8 8\ndirect\n0.250000 0.161365 0.014739 Tb\n0.750000 0.838635 0.985261 Tb\n0.750000 0.161365 0.485261 Tb\n0.250000 0.838635 0.514739 Tb\n0.250000 0.400406 0.331875 Tb\n0.750000 0.599593 0.668125 Tb\n0.750000 0.400406 0.168125 Tb\n0.250000 0.599593 0.831875 Tb\n0.000000 0.930841 0.250000 Al\n0.500000 0.069158 0.750000 Al\n0.000000 0.069158 0.750000 Al\n0.500000 0.930841 0.250000 Al\n0.250000 0.661003 0.098208 Al\n0.750000 0.338997 0.901792 Al\n0.750000 0.661003 0.401792 Al\n0.250000 0.338997 0.598208 Al\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Tb",
"Al"
],
"chemical_system": "Al-Tb",
"density": 6.542734225736532,
"density_atomic": 0.04238817267395357,
"volume": 377.46378271766326,
"volume_molar": 14.207125195798897,
"formula_full": "Tb8 Al8",
"formula_reduced": "TbAl",
"formula_anonymous": "AB",
"energy_above_hull": 0.8155756000000001,
"spacegroup": 57
},
{
"id": "jvasp-17753",
"created_at": "2022-09-04T14:38:16.651065Z",
"updated_at": "2022-09-04T14:38:16.651091Z",
"structure_string": "Ce2 S2\n1.0\n4.036876 -0.000000 -0.000000\n0.000000 4.036876 -0.000000\n0.000000 0.000000 5.687693\nCe S\n2 2\ndirect\n0.000000 0.500000 0.250035 Ce\n0.500000 0.000000 0.749964 Ce\n0.500000 0.000000 0.249961 S\n0.000000 0.500000 0.750039 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ce",
"S"
],
"chemical_system": "Ce-S",
"density": 6.169320791279241,
"density_atomic": 0.04315518926190147,
"volume": 92.68873728544402,
"volume_molar": 13.954615569990105,
"formula_full": "Ce2 S2",
"formula_reduced": "CeS",
"formula_anonymous": "AB",
"energy_above_hull": 0.28651275,
"spacegroup": 225
},
{
"id": "jvasp-14526",
"created_at": "2022-09-04T14:38:10.773838Z",
"updated_at": "2022-09-04T14:38:10.773858Z",
"structure_string": "Er1 Rh1\n1.0\n3.380664 0.000000 0.000000\n0.000000 3.380664 0.000000\n-0.000000 0.000000 3.380664\nEr Rh\n1 1\ndirect\n0.000000 0.000000 0.000000 Er\n0.499999 0.499999 0.499999 Rh\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Er",
"Rh"
],
"chemical_system": "Er-Rh",
"density": 11.61104617635933,
"density_atomic": 0.05176353996847084,
"volume": 38.63723387577819,
"volume_molar": 11.633943048848831,
"formula_full": "Er1 Rh1",
"formula_reduced": "ErRh",
"formula_anonymous": "AB",
"energy_above_hull": 0.9228215000000002,
"spacegroup": 221
},
{
"id": "jvasp-38574",
"created_at": "2022-09-04T14:38:32.516429Z",
"updated_at": "2022-09-04T14:38:32.516451Z",
"structure_string": "Na1 Er3\n1.0\n0.000024 3.899832 3.899806\n3.899804 0.000026 3.899803\n3.899820 3.899847 0.000010\nNa Er\n1 3\ndirect\n0.749990 0.750003 0.749991 Na\n0.000010 0.000024 0.999961 Er\n0.499970 0.499984 0.500024 Er\n0.250032 0.249985 0.250024 Er\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Na",
"Er"
],
"chemical_system": "Er-Na",
"density": 7.346077862433108,
"density_atomic": 0.033720972840927364,
"volume": 118.62053977117688,
"volume_molar": 17.858739688230134,
"formula_full": "Na1 Er3",
"formula_reduced": "NaEr3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.92157725,
"spacegroup": 225
},
{
"id": "jvasp-117785",
"created_at": "2022-09-04T14:38:28.469812Z",
"updated_at": "2022-09-04T14:38:28.469838Z",
"structure_string": "I1 Br2\n1.0\n6.845676 0.000000 -5.441164\n0.000000 4.010337 0.000000\n-4.399287 0.000000 7.548472\nI Br\n1 2\ndirect\n-0.080119 0.000000 0.242959 I\n0.081596 0.000000 0.075634 Br\n0.225619 0.000000 -0.073517 Br\n",
"nsites": 3,
"nelements": 2,
"elements": [
"I",
"Br"
],
"chemical_system": "Br-I",
"density": 4.280090489382736,
"density_atomic": 0.02696984969105897,
"volume": 111.23532516366075,
"volume_molar": 22.3291595206645,
"formula_full": "I1 Br2",
"formula_reduced": "IBr2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0275386666666666,
"spacegroup": 38
}
]
}