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=1188",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=1186",
"results": [
{
"id": "jvasp-81311",
"created_at": "2022-09-04T14:37:05.469663Z",
"updated_at": "2022-09-04T14:37:05.469687Z",
"structure_string": "Ba2 Na1 Mg1\n1.0\n-13.301666 -3.603972 -4.737095\n-4.350589 -2.062743 -5.427754\n-6.295174 -5.297248 -3.909502\nBa Na Mg\n2 1 1\ndirect\n0.744914 -0.013722 0.013720 Ba\n0.255087 0.013720 -0.013721 Ba\n0.000000 0.000000 0.000000 Na\n0.500001 -0.000001 -0.000000 Mg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Na",
"Mg"
],
"chemical_system": "Ba-Mg-Na",
"density": 3.2267589612596668,
"density_atomic": 0.024142967483267257,
"volume": 165.67971616464612,
"volume_molar": 24.943664295508658,
"formula_full": "Ba2 Na1 Mg1",
"formula_reduced": "Ba2NaMg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 12
},
{
"id": "jvasp-7715",
"created_at": "2022-09-04T14:37:05.470880Z",
"updated_at": "2022-09-04T14:37:05.470902Z",
"structure_string": "Y1 Ni1 Sb1\n1.0\n3.892974 -0.000000 2.247610\n1.297658 3.670332 2.247610\n0.000000 0.000000 4.495220\nY Ni Sb\n1 1 1\ndirect\n0.500000 0.500000 0.500000 Y\n0.250000 0.250000 0.250000 Ni\n0.000000 0.000000 0.000000 Sb\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Y",
"Ni",
"Sb"
],
"chemical_system": "Ni-Sb-Y",
"density": 6.963750247545328,
"density_atomic": 0.04670715881043094,
"volume": 64.22998264946959,
"volume_molar": 12.893399884248787,
"formula_full": "Y1 Ni1 Sb1",
"formula_reduced": "YNiSb",
"formula_anonymous": "ABC",
"energy_above_hull": 1.3291679833333332,
"spacegroup": 216
},
{
"id": "jvasp-8353",
"created_at": "2022-09-04T14:37:05.486123Z",
"updated_at": "2022-09-04T14:37:05.486145Z",
"structure_string": "Mg1 Co1 F6\n1.0\n4.351528 0.066391 2.864168\n1.577764 4.055965 2.864168\n0.095494 0.066392 5.208659\nMg Co F\n1 1 6\ndirect\n0.499999 0.500000 0.500001 Mg\n0.000000 0.000000 0.000000 Co\n0.374258 0.095839 0.767880 F\n0.095838 0.767880 0.374259 F\n0.232120 0.625742 0.904162 F\n0.904160 0.232121 0.625743 F\n0.625741 0.904161 0.232122 F\n0.767879 0.374258 0.095840 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Co",
"F"
],
"chemical_system": "Co-F-Mg",
"density": 3.648409600029958,
"density_atomic": 0.0891198724210617,
"volume": 89.76673532702858,
"volume_molar": 6.757348946312884,
"formula_full": "Mg1 Co1 F6",
"formula_reduced": "MgCoF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0039387853124999,
"spacegroup": 148
},
{
"id": "jvasp-14099",
"created_at": "2022-09-04T14:37:05.496663Z",
"updated_at": "2022-09-04T14:37:05.496700Z",
"structure_string": "U4 Cr4 C8\n1.0\n3.731027 -0.000000 0.000000\n-0.000000 5.269821 0.000000\n0.000000 0.000000 10.401259\nU Cr C\n4 4 8\ndirect\n0.250000 0.605349 0.643951 U\n0.750001 0.394651 0.356049 U\n0.250000 0.105349 0.856049 U\n0.750001 0.894651 0.143951 U\n0.750001 0.597926 0.928546 Cr\n0.750001 0.097926 0.571454 Cr\n0.250000 0.402074 0.071454 Cr\n0.250000 0.902074 0.428546 Cr\n0.250000 0.253434 0.499906 C\n0.750001 0.746566 0.500094 C\n0.250000 0.753434 0.000094 C\n0.750001 0.246566 0.999906 C\n0.250000 0.102466 0.624666 C\n0.750001 0.397534 0.124666 C\n0.250000 0.602466 0.875335 C\n0.750001 0.897534 0.375334 C\n",
"nsites": 16,
"nelements": 3,
"elements": [
"U",
"Cr",
"C"
],
"chemical_system": "C-Cr-U",
"density": 10.199825820253338,
"density_atomic": 0.07823657253496405,
"volume": 204.50793639828194,
"volume_molar": 7.697347372047383,
"formula_full": "U4 Cr4 C8",
"formula_reduced": "UCrC2",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.701588350000001,
"spacegroup": 62
},
{
"id": "jvasp-28461",
"created_at": "2022-09-04T14:37:05.503525Z",
"updated_at": "2022-09-04T14:37:05.503555Z",
"structure_string": "W3 Se2 S4\n1.0\n3.235786 0.000000 -0.000000\n-1.617892 2.802251 -0.000000\n0.000000 -0.000000 27.942260\nW Se S\n3 2 4\ndirect\n0.333339 0.666677 0.115678 W\n0.333339 0.666677 0.578287 W\n0.666640 0.333278 0.346982 W\n0.333308 0.666615 0.408428 Se\n0.333308 0.666615 0.285537 Se\n0.666674 0.333344 0.059868 S\n0.666663 0.333324 0.522417 S\n0.666663 0.333324 0.171548 S\n0.666674 0.333344 0.634096 S\n",
"nsites": 9,
"nelements": 3,
"elements": [
"W",
"Se",
"S"
],
"chemical_system": "S-Se-W",
"density": 5.49021382469611,
"density_atomic": 0.03552173381833518,
"volume": 253.36601096184356,
"volume_molar": 16.953397575688054,
"formula_full": "W3 Se2 S4",
"formula_reduced": "W3(SeS2)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 4.411560748148148,
"spacegroup": 187
},
{
"id": "jvasp-7826",
"created_at": "2022-09-04T14:37:05.514465Z",
"updated_at": "2022-09-04T14:37:05.514492Z",
"structure_string": "Rb1 Ti1 S2\n1.0\n3.378498 -0.118206 7.156604\n1.510183 3.024495 7.156604\n-0.198835 -0.118206 7.911492\nRb Ti S\n1 1 2\ndirect\n0.818071 0.818071 0.818073 Rb\n0.986873 0.986873 0.986875 Ti\n0.592983 0.592983 0.592985 S\n0.380070 0.380070 0.380071 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Rb",
"Ti",
"S"
],
"chemical_system": "Rb-S-Ti",
"density": 3.7131840661515176,
"density_atomic": 0.04529681669215209,
"volume": 88.3064261929254,
"volume_molar": 13.294843213658694,
"formula_full": "Rb1 Ti1 S2",
"formula_reduced": "RbTiS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.3046870833333333,
"spacegroup": 160
},
{
"id": "jvasp-8322",
"created_at": "2022-09-04T14:37:05.519424Z",
"updated_at": "2022-09-04T14:37:05.519442Z",
"structure_string": "Ti1 Bi2 O6\n1.0\n5.364388 -0.000000 -0.000000\n0.000000 5.364388 -0.000000\n-0.000000 0.000000 4.651859\nTi Bi O\n1 2 6\ndirect\n0.500000 0.500000 0.594650 Ti\n0.500000 0.000000 0.996077 Bi\n0.000000 0.500000 0.996077 Bi\n0.741330 0.741330 0.730494 O\n0.258671 0.741330 0.730494 O\n0.000000 0.000000 0.177809 O\n0.500000 0.500000 0.207500 O\n0.258671 0.258671 0.730494 O\n0.741330 0.258671 0.730494 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ti",
"Bi",
"O"
],
"chemical_system": "Bi-O-Ti",
"density": 6.969195255046566,
"density_atomic": 0.06723193365804898,
"volume": 133.86495836599403,
"volume_molar": 8.957262467906173,
"formula_full": "Ti1 Bi2 O6",
"formula_reduced": "Ti(BiO3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.472165325925926,
"spacegroup": 99
},
{
"id": "jvasp-8032",
"created_at": "2022-09-04T14:37:05.522657Z",
"updated_at": "2022-09-04T14:37:05.522679Z",
"structure_string": "Al2 Cu2 O4\n1.0\n1.437946 -2.490595 0.000000\n1.437946 2.490595 0.000000\n-0.000000 0.000000 11.397516\nAl Cu O\n2 2 4\ndirect\n0.000000 0.000000 0.000000 Al\n0.000000 0.000000 0.500000 Al\n0.333335 0.666668 0.250000 Cu\n0.666668 0.333335 0.750000 Cu\n0.666668 0.333335 0.584981 O\n0.333335 0.666668 0.084980 O\n0.666668 0.333335 0.915020 O\n0.333335 0.666668 0.415020 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Al",
"Cu",
"O"
],
"chemical_system": "Al-Cu-O",
"density": 4.984512091548757,
"density_atomic": 0.09799503939670325,
"volume": 81.6367853847624,
"volume_molar": 6.145352659761875,
"formula_full": "Al2 Cu2 O4",
"formula_reduced": "AlCuO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9424350625000002,
"spacegroup": 194
},
{
"id": "jvasp-80162",
"created_at": "2022-09-04T14:37:05.553673Z",
"updated_at": "2022-09-04T14:37:05.553700Z",
"structure_string": "Zr2 Co1 Pt1\n1.0\n-8.716592 -0.000000 -5.032526\n-5.661342 -1.156274 -0.259322\n-4.247572 2.842470 -2.708043\nZr Co Pt\n2 1 1\ndirect\n0.765151 -0.000001 -0.000000 Zr\n0.234850 -0.000000 -0.000000 Zr\n0.000000 0.000000 0.000000 Co\n0.500001 -0.000001 -0.000000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Co",
"Pt"
],
"chemical_system": "Co-Pt-Zr",
"density": 10.068725423749614,
"density_atomic": 0.05556940850375488,
"volume": 71.98205105475823,
"volume_molar": 10.837151091131512,
"formula_full": "Zr2 Co1 Pt1",
"formula_reduced": "Zr2CoPt",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.693632825,
"spacegroup": 71
},
{
"id": "jvasp-51303",
"created_at": "2022-09-04T14:37:05.561705Z",
"updated_at": "2022-09-04T14:37:05.561731Z",
"structure_string": "Si1 B1 Au1\n1.0\n-0.000000 2.826185 2.826185\n2.826185 0.000000 2.826185\n2.826185 2.826185 -0.000000\nSi B Au\n1 1 1\ndirect\n0.250000 0.250000 0.250000 Si\n0.500001 0.500001 0.500001 B\n0.000000 0.000000 0.000000 Au\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Si",
"B",
"Au"
],
"chemical_system": "Au-B-Si",
"density": 8.675155853770685,
"density_atomic": 0.06644916040382623,
"volume": 45.14729729869177,
"volume_molar": 9.06277930887632,
"formula_full": "Si1 B1 Au1",
"formula_reduced": "SiBAu",
"formula_anonymous": "ABC",
"energy_above_hull": 2.6945529177777776,
"spacegroup": 216
},
{
"id": "jvasp-58596",
"created_at": "2022-09-04T14:37:05.576208Z",
"updated_at": "2022-09-04T14:37:05.576240Z",
"structure_string": "Zn2 Ni4 O8\n1.0\n5.851872 -0.017216 -0.017187\n2.911026 5.076477 -0.017187\n2.906932 1.678319 4.747001\nZn Ni O\n2 4 8\ndirect\n0.125000 0.625001 0.624999 Zn\n0.625000 0.125000 0.624999 Zn\n0.996733 0.996733 0.003266 Ni\n0.253268 0.253268 0.246732 Ni\n0.625000 0.625000 0.124999 Ni\n0.625000 0.625000 0.624999 Ni\n0.393715 0.393715 0.365073 O\n0.405998 0.857267 0.368367 O\n0.393715 0.393715 0.847497 O\n0.857267 0.405998 0.368367 O\n0.392734 0.844003 0.881631 O\n0.844002 0.392734 0.881631 O\n0.856286 0.856285 0.402501 O\n0.856285 0.856285 0.884926 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Zn",
"Ni",
"O"
],
"chemical_system": "Ni-O-Zn",
"density": 5.788446694666971,
"density_atomic": 0.09887293806220668,
"volume": 141.59587319223579,
"volume_molar": 6.090787709991103,
"formula_full": "Zn2 Ni4 O8",
"formula_reduced": "Zn(NiO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.5048741714285714,
"spacegroup": 74
},
{
"id": "jvasp-59709",
"created_at": "2022-09-04T14:37:05.582232Z",
"updated_at": "2022-09-04T14:37:05.582258Z",
"structure_string": "In4 Co2 S8\n1.0\n6.481490 0.000000 3.742091\n2.160496 6.110808 3.742091\n-0.000000 -0.000000 7.484180\nIn Co S\n4 2 8\ndirect\n0.500000 0.500000 -0.000000 In\n0.500000 0.500000 0.500000 In\n0.000000 0.500000 0.500000 In\n0.500000 0.000000 0.500000 In\n0.875000 0.875000 0.875000 Co\n0.125000 0.125000 0.125000 Co\n0.750024 0.750024 0.750023 S\n0.249977 0.249977 0.750071 S\n0.249977 0.750071 0.249976 S\n0.750071 0.249977 0.249976 S\n0.750023 0.249929 0.750023 S\n0.249929 0.750024 0.750023 S\n0.249977 0.249977 0.249977 S\n0.750024 0.750024 0.249929 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"In",
"Co",
"S"
],
"chemical_system": "Co-In-S",
"density": 4.67002821957008,
"density_atomic": 0.047229170477848796,
"volume": 296.42697210966713,
"volume_molar": 12.750892507892926,
"formula_full": "In4 Co2 S8",
"formula_reduced": "In2CoS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.544802977142857,
"spacegroup": 227
}
]
}