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=3827",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=3825",
"results": [
{
"id": "jvasp-23772",
"created_at": "2022-09-04T14:37:35.001573Z",
"updated_at": "2022-09-04T14:37:35.001582Z",
"structure_string": "Hf6 Co6 Sn6\n1.0\n3.546389 -6.142526 0.000000\n3.546389 6.142526 -0.000000\n-0.000000 0.000000 7.161773\nHf Co Sn\n6 6 6\ndirect\n0.007676 0.400419 0.750000 Hf\n0.599581 0.607259 0.750000 Hf\n0.392741 0.992324 0.750000 Hf\n0.992324 0.392741 0.250000 Hf\n0.607259 0.599581 0.250000 Hf\n0.400419 0.007676 0.250000 Hf\n0.666667 0.333333 0.962172 Co\n0.000000 0.000000 0.250000 Co\n0.000000 0.000000 0.750000 Co\n0.333333 0.666667 0.037827 Co\n0.666667 0.333333 0.537827 Co\n0.333333 0.666667 0.462172 Co\n0.268926 0.268926 0.500000 Sn\n-0.000000 0.731074 0.500000 Sn\n-0.000000 0.731074 0.000000 Sn\n0.731074 -0.000000 0.500000 Sn\n0.731074 -0.000000 0.000000 Sn\n0.268926 0.268926 0.000000 Sn\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Hf",
"Co",
"Sn"
],
"chemical_system": "Co-Hf-Sn",
"density": 11.371791333122545,
"density_atomic": 0.05768841188062638,
"volume": 312.021069972373,
"volume_molar": 10.439082241441332,
"formula_full": "Hf6 Co6 Sn6",
"formula_reduced": "HfCoSn",
"formula_anonymous": "ABC",
"energy_above_hull": 2.5733618666666667,
"spacegroup": 190
},
{
"id": "jvasp-42119",
"created_at": "2022-09-04T14:37:35.227044Z",
"updated_at": "2022-09-04T14:37:35.227060Z",
"structure_string": "Pm1 Cd1 Pd2\n1.0\n0.000000 3.439105 3.439105\n3.439105 0.000000 3.439105\n3.439105 3.439105 -0.000000\nPm Cd Pd\n1 1 2\ndirect\n0.749998 0.749998 0.749998 Pm\n0.250000 0.250000 0.250000 Cd\n0.000000 0.000000 0.000000 Pd\n0.500000 0.500000 0.500000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Cd",
"Pd"
],
"chemical_system": "Cd-Pd-Pm",
"density": 9.598702310708397,
"density_atomic": 0.04916926190345097,
"volume": 81.35163809972217,
"volume_molar": 12.247775392327645,
"formula_full": "Pm1 Cd1 Pd2",
"formula_reduced": "PmCdPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5798205812499999,
"spacegroup": 225
},
{
"id": "jvasp-23549",
"created_at": "2022-09-04T14:37:34.817110Z",
"updated_at": "2022-09-04T14:37:34.817136Z",
"structure_string": "U6 Ti2 Sb10\n1.0\n4.524283 -7.836288 0.000000\n4.524283 7.836288 0.000000\n-0.000000 -0.000000 6.088509\nU Ti Sb\n6 2 10\ndirect\n-0.000000 0.612826 0.250000 U\n0.612825 0.612825 0.750000 U\n0.387174 -0.000000 0.750000 U\n0.612826 -0.000000 0.250000 U\n0.387174 0.387174 0.250000 U\n-0.000000 0.387174 0.750000 U\n0.000000 0.000000 0.000000 Ti\n0.000000 0.000000 0.500000 Ti\n0.735717 0.735717 0.250000 Sb\n-0.000000 0.735718 0.750000 Sb\n0.666667 0.333333 0.000000 Sb\n0.333333 0.666667 0.500000 Sb\n0.666667 0.333333 0.500000 Sb\n-0.000000 0.264282 0.250000 Sb\n0.333333 0.666667 0.000000 Sb\n0.264282 -0.000000 0.250000 Sb\n0.264282 0.264282 0.750000 Sb\n0.735718 -0.000000 0.750000 Sb\n",
"nsites": 18,
"nelements": 3,
"elements": [
"U",
"Ti",
"Sb"
],
"chemical_system": "Sb-Ti-U",
"density": 10.544777729396083,
"density_atomic": 0.041693792955904085,
"volume": 431.7189376134966,
"volume_molar": 14.443734505922974,
"formula_full": "U6 Ti2 Sb10",
"formula_reduced": "U3TiSb5",
"formula_anonymous": "AB3C5",
"energy_above_hull": 3.8863840925925928,
"spacegroup": 193
},
{
"id": "jvasp-22213",
"created_at": "2022-09-04T14:37:34.822694Z",
"updated_at": "2022-09-04T14:37:34.822728Z",
"structure_string": "Lu10 Sb2 Pd4\n1.0\n6.790613 -0.000000 -3.344818\n-1.647540 6.587719 -3.344818\n-0.024225 -0.031029 8.516343\nLu Sb Pd\n10 2 4\ndirect\n0.202517 0.011828 0.714345 Lu\n0.011829 0.511828 0.714345 Lu\n0.702517 0.202517 0.714345 Lu\n0.988171 0.488172 0.285654 Lu\n0.511829 0.702517 0.714345 Lu\n0.797483 0.988172 0.285654 Lu\n0.488172 0.297483 0.285655 Lu\n0.297483 0.797483 0.285655 Lu\n0.500000 0.500000 -0.000000 Lu\n0.000000 0.000000 0.000000 Lu\n0.250000 0.250000 0.500000 Sb\n0.750000 0.750000 0.499999 Sb\n0.361042 0.861042 -0.000000 Pd\n0.138958 0.361042 -0.000000 Pd\n0.638958 0.138958 -0.000000 Pd\n0.861042 0.638958 -0.000001 Pd\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Lu",
"Sb",
"Pd"
],
"chemical_system": "Lu-Pd-Sb",
"density": 10.582158034608955,
"density_atomic": 0.04215339906716962,
"volume": 379.56606950022444,
"volume_molar": 14.28625186406434,
"formula_full": "Lu10 Sb2 Pd4",
"formula_reduced": "Lu5SbPd2",
"formula_anonymous": "AB2C5",
"energy_above_hull": 1.5923020312500002,
"spacegroup": 140
},
{
"id": "jvasp-54362",
"created_at": "2022-09-04T14:37:34.849653Z",
"updated_at": "2022-09-04T14:37:34.849662Z",
"structure_string": "Lu4 C6 N12\n1.0\n5.984040 0.032747 8.656537\n2.724808 5.327779 8.656537\n0.053201 0.032747 10.523380\nLu C N\n4 6 12\ndirect\n0.664530 0.664532 0.664530 Lu\n0.835469 0.835471 0.835469 Lu\n0.335469 0.335470 0.335469 Lu\n0.164531 0.164531 0.164531 Lu\n0.449943 0.050058 0.750000 C\n0.550057 0.949944 0.250000 C\n0.949943 0.250001 0.550057 C\n0.250000 0.550058 0.949943 C\n0.750000 0.449944 0.050057 C\n0.050057 0.750000 0.449943 C\n0.358037 0.551321 0.959016 N\n0.948680 0.141964 0.540984 N\n0.551320 0.959017 0.358037 N\n0.040984 0.641963 0.448680 N\n0.641963 0.448681 0.040984 N\n0.051320 0.858038 0.459016 N\n0.540984 0.948681 0.141963 N\n0.459016 0.051320 0.858037 N\n0.959016 0.358038 0.551319 N\n0.858037 0.459017 0.051320 N\n0.448680 0.040984 0.641963 N\n0.141962 0.540985 0.948680 N\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Lu",
"C",
"N"
],
"chemical_system": "C-Lu-N",
"density": 4.712929012376956,
"density_atomic": 0.0664248843167698,
"volume": 331.2011789901729,
"volume_molar": 9.06609145343989,
"formula_full": "Lu4 C6 N12",
"formula_reduced": "Lu2(CN2)3",
"formula_anonymous": "A2B3C6",
"energy_above_hull": 5.604134636363636,
"spacegroup": 167
},
{
"id": "jvasp-35908",
"created_at": "2022-09-04T14:37:34.852245Z",
"updated_at": "2022-09-04T14:37:34.852272Z",
"structure_string": "K2 Cd2 As2\n1.0\n4.583222 -0.000000 0.000000\n0.000000 4.583222 0.000000\n0.000000 -0.000000 7.907407\nK Cd As\n2 2 2\ndirect\n0.500000 0.000000 0.349132 K\n0.000000 0.500000 0.650869 K\n0.500000 0.500000 0.000000 Cd\n0.000000 0.000000 0.000000 Cd\n0.500000 0.000000 0.788359 As\n0.000000 0.500000 0.211642 As\n",
"nsites": 6,
"nelements": 3,
"elements": [
"K",
"Cd",
"As"
],
"chemical_system": "As-Cd-K",
"density": 4.527296157724548,
"density_atomic": 0.0361222978844048,
"volume": 166.1023896984804,
"volume_molar": 16.671532855610383,
"formula_full": "K2 Cd2 As2",
"formula_reduced": "KCdAs",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 129
},
{
"id": "jvasp-9287",
"created_at": "2022-09-04T14:37:34.857676Z",
"updated_at": "2022-09-04T14:37:34.857694Z",
"structure_string": "Mg4 Fe4 O8\n1.0\n2.864468 0.000072 0.008692\n1.429911 7.709655 0.048109\n1.407888 0.748005 7.850262\nMg Fe O\n4 4 8\ndirect\n0.668349 0.671509 0.971901 Mg\n0.315530 0.300287 0.048184 Mg\n0.422795 0.882257 0.252753 Mg\n0.561079 0.089541 0.767325 Mg\n0.934813 0.411875 0.697902 Fe\n0.311248 0.727408 0.630266 Fe\n0.672653 0.244389 0.389816 Fe\n0.049053 0.559917 0.322186 Fe\n0.679023 0.443373 0.178459 O\n0.099144 0.199152 0.581814 O\n0.884757 0.772643 0.438270 O\n0.304859 0.528423 0.841626 O\n0.936537 0.201502 0.904734 O\n0.690066 0.840003 0.760112 O\n0.047338 0.770296 0.115347 O\n0.293831 0.131793 0.259969 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Mg",
"Fe",
"O"
],
"chemical_system": "Fe-Mg-O",
"density": 4.301443253091996,
"density_atomic": 0.09239116869810159,
"volume": 173.1767248478237,
"volume_molar": 6.51809133368365,
"formula_full": "Mg4 Fe4 O8",
"formula_reduced": "MgFeO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.3759703874999998,
"spacegroup": 12
},
{
"id": "jvasp-35730",
"created_at": "2022-09-04T14:37:34.866502Z",
"updated_at": "2022-09-04T14:37:34.866539Z",
"structure_string": "Cr1 Co2 Bi1\n1.0\n3.082870 3.082870 0.000000\n3.082870 0.000000 -3.082870\n-0.000000 3.082870 -3.082870\nCr Co Bi\n1 2 1\ndirect\n0.750000 0.750000 0.750000 Cr\n0.000000 0.000000 0.000000 Co\n0.500000 0.500000 0.500000 Co\n0.250000 0.250000 0.250000 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cr",
"Co",
"Bi"
],
"chemical_system": "Bi-Co-Cr",
"density": 10.735261010458432,
"density_atomic": 0.06825969775772948,
"volume": 58.59973207319182,
"volume_molar": 8.822395876076195,
"formula_full": "Cr1 Co2 Bi1",
"formula_reduced": "CrCo2Bi",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.170318375,
"spacegroup": 225
},
{
"id": "jvasp-17618",
"created_at": "2022-09-04T14:37:34.885403Z",
"updated_at": "2022-09-04T14:37:34.885435Z",
"structure_string": "Mn2 Ga1 Co1\n1.0\n3.518655 0.000000 2.031496\n1.172885 3.317420 2.031496\n0.000000 -0.000000 4.062992\nMn Ga Co\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.749998 0.750000 0.750002 Mn\n0.249999 0.250000 0.250001 Ga\n0.499999 0.500000 0.500001 Co\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Ga",
"Co"
],
"chemical_system": "Co-Ga-Mn",
"density": 8.351666684585172,
"density_atomic": 0.08434063736496762,
"volume": 47.426722455164544,
"volume_molar": 7.140259960261342,
"formula_full": "Mn2 Ga1 Co1",
"formula_reduced": "Mn2GaCo",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.795976926939655,
"spacegroup": 216
},
{
"id": "jvasp-41438",
"created_at": "2022-09-04T14:37:34.889185Z",
"updated_at": "2022-09-04T14:37:34.889216Z",
"structure_string": "Lu1 Mg1 Zn2\n1.0\n-0.000000 3.354675 3.354675\n3.354675 0.000000 3.354675\n3.354675 3.354675 -0.000000\nLu Mg Zn\n1 1 2\ndirect\n0.249999 0.249999 0.249999 Lu\n0.750002 0.750002 0.750002 Mg\n0.000000 0.000000 0.000000 Zn\n0.499999 0.499999 0.499999 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"Mg",
"Zn"
],
"chemical_system": "Lu-Mg-Zn",
"density": 7.2593897323014875,
"density_atomic": 0.05297593603529457,
"volume": 75.50598062741258,
"volume_molar": 11.367691089002793,
"formula_full": "Lu1 Mg1 Zn2",
"formula_reduced": "LuMgZn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-41924",
"created_at": "2022-09-04T14:37:34.898879Z",
"updated_at": "2022-09-04T14:37:34.898912Z",
"structure_string": "Li1 Hf1 Ir2\n1.0\n-0.000000 3.124805 3.124805\n3.124805 0.000000 3.124805\n3.124805 3.124805 -0.000000\nLi Hf Ir\n1 1 2\ndirect\n0.750001 0.750001 0.750001 Li\n0.250001 0.250001 0.250001 Hf\n0.000000 0.000000 0.000000 Ir\n0.500000 0.500000 0.500000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Hf",
"Ir"
],
"chemical_system": "Hf-Ir-Li",
"density": 15.50680492430661,
"density_atomic": 0.065548269870448,
"volume": 61.02373118170391,
"volume_molar": 9.187337471915551,
"formula_full": "Li1 Hf1 Ir2",
"formula_reduced": "LiHfIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.6603313,
"spacegroup": 225
},
{
"id": "jvasp-41290",
"created_at": "2022-09-04T14:37:34.924712Z",
"updated_at": "2022-09-04T14:37:34.924733Z",
"structure_string": "Mn1 Ga1 Ir2\n1.0\n-0.000090 3.042853 3.042883\n3.043318 -0.000027 3.042820\n3.043380 3.042853 -0.000090\nMn Ga Ir\n1 1 2\ndirect\n0.750002 0.749999 0.750001 Mn\n0.249995 0.250001 0.250002 Ga\n-0.000001 0.000002 -0.000003 Ir\n0.500000 0.500001 0.500000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Ga",
"Ir"
],
"chemical_system": "Ga-Ir-Mn",
"density": 14.99994658402279,
"density_atomic": 0.07097440105918386,
"volume": 56.35834808474812,
"volume_molar": 8.484947629185742,
"formula_full": "Mn1 Ga1 Ir2",
"formula_reduced": "MnGaIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.182727941594828,
"spacegroup": 225
}
]
}