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=spacegroup&page=1221",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=spacegroup&page=1219",
"results": [
{
"id": "jvasp-56550",
"created_at": "2022-09-04T14:38:18.796537Z",
"updated_at": "2022-09-04T14:38:18.796551Z",
"structure_string": "Dy2 Si2 Ru4 C2\n1.0\n3.802499 0.000000 0.000000\n-1.901249 5.579241 -0.000000\n0.000000 -0.000000 7.143270\nDy Si Ru C\n2 2 4 2\ndirect\n0.047246 0.094490 0.750000 Dy\n0.952755 0.905510 0.250000 Dy\n0.230855 0.461709 0.250000 Si\n0.769145 0.538291 0.750000 Si\n0.336278 0.672556 0.943782 Ru\n0.336278 0.672556 0.556218 Ru\n0.663722 0.327444 0.056218 Ru\n0.663722 0.327444 0.443782 Ru\n0.500000 0.000000 0.000000 C\n0.500000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Dy",
"Si",
"Ru",
"C"
],
"chemical_system": "C-Dy-Ru-Si",
"density": 8.869718711546351,
"density_atomic": 0.06598704860227099,
"volume": 151.54488966878634,
"volume_molar": 9.126246570441012,
"formula_full": "Dy2 Si2 Ru4 C2",
"formula_reduced": "DySiRu2C",
"formula_anonymous": "ABCD2",
"energy_above_hull": 4.04762922,
"spacegroup": 63
},
{
"id": "jvasp-109319",
"created_at": "2022-09-04T14:38:19.273454Z",
"updated_at": "2022-09-04T14:38:19.273480Z",
"structure_string": "Yb4 Mg2\n1.0\n6.183083 -0.014830 0.000000\n-3.138630 5.327263 0.000000\n-0.000000 -0.000000 5.797914\nYb Mg\n4 2\ndirect\n0.657205 0.977817 0.250000 Yb\n0.022182 0.342794 0.750000 Yb\n0.977817 0.657205 0.250000 Yb\n0.342794 0.022182 0.750000 Yb\n0.669362 0.669362 0.750000 Mg\n0.330637 0.330637 0.250000 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Yb",
"Mg"
],
"chemical_system": "Mg-Yb",
"density": 6.450087915550639,
"density_atomic": 0.031461860514257624,
"volume": 190.70709430171715,
"volume_molar": 19.14108276359224,
"formula_full": "Yb4 Mg2",
"formula_reduced": "Yb2Mg",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1445685714285714,
"spacegroup": 63
},
{
"id": "jvasp-17581",
"created_at": "2022-09-04T14:38:19.655316Z",
"updated_at": "2022-09-04T14:38:19.655334Z",
"structure_string": "Dy2 Sn4\n1.0\n4.346170 0.000000 -0.000000\n-0.000000 4.263707 -1.153215\n0.000000 0.013967 8.510210\nDy Sn\n2 4\ndirect\n0.250000 0.900839 0.801675 Dy\n0.750000 0.099162 0.198325 Dy\n0.250000 0.251238 0.502474 Sn\n0.750000 0.748763 0.497525 Sn\n0.750000 0.436856 0.873711 Sn\n0.250000 0.563145 0.126289 Sn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Dy",
"Sn"
],
"chemical_system": "Dy-Sn",
"density": 8.418314312214607,
"density_atomic": 0.038029811287956475,
"volume": 157.77096432503515,
"volume_molar": 15.835315916771668,
"formula_full": "Dy2 Sn4",
"formula_reduced": "DySn2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.4630866333333334,
"spacegroup": 63
},
{
"id": "jvasp-58569",
"created_at": "2022-09-04T14:38:19.700127Z",
"updated_at": "2022-09-04T14:38:19.700145Z",
"structure_string": "Mg2 Cu4 O8\n1.0\n2.930794 -0.000000 0.000000\n-1.465397 4.818896 -0.000000\n0.000000 0.000000 9.309096\nMg Cu O\n2 4 8\ndirect\n0.392616 0.785234 0.750000 Mg\n0.607383 0.214766 0.250000 Mg\n0.867022 0.734048 0.070762 Cu\n0.132976 0.265953 0.929239 Cu\n0.867022 0.734048 0.429239 Cu\n0.132976 0.265953 0.570762 Cu\n0.219338 0.438678 0.385589 O\n0.780660 0.561323 0.614411 O\n0.780660 0.561323 0.885590 O\n0.219338 0.438678 0.114411 O\n0.958521 0.917047 0.250000 O\n0.041477 0.082954 0.750000 O\n0.499999 0.000000 0.000000 O\n0.499999 0.000000 0.500000 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mg",
"Cu",
"O"
],
"chemical_system": "Cu-Mg-O",
"density": 5.440935129786177,
"density_atomic": 0.10648481466223916,
"volume": 131.47414534557643,
"volume_molar": 5.655398639798286,
"formula_full": "Mg2 Cu4 O8",
"formula_reduced": "Mg(CuO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.1217019928571428,
"spacegroup": 63
},
{
"id": "jvasp-20890",
"created_at": "2022-09-04T14:38:19.757556Z",
"updated_at": "2022-09-04T14:38:19.757584Z",
"structure_string": "Na2 B2 F8\n1.0\n4.581032 -0.001963 0.000000\n-0.446285 4.559242 0.000000\n0.000000 0.000000 6.785924\nNa B F\n2 2 8\ndirect\n0.353364 0.353363 0.250000 Na\n0.646637 0.646637 0.750000 Na\n0.850498 0.850498 0.250000 B\n0.149503 0.149503 0.750000 B\n0.715293 0.715293 0.418840 F\n0.284707 0.284707 0.918840 F\n0.715293 0.715293 0.081160 F\n0.284707 0.284707 0.581159 F\n0.184651 0.846298 0.750000 F\n0.815350 0.153703 0.250000 F\n0.846298 0.184651 0.750000 F\n0.153703 0.815349 0.250000 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Na",
"B",
"F"
],
"chemical_system": "B-F-Na",
"density": 2.572838151650378,
"density_atomic": 0.08467096337953832,
"volume": 141.72509111783572,
"volume_molar": 7.11240373279527,
"formula_full": "Na2 B2 F8",
"formula_reduced": "NaBF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0778137855555555,
"spacegroup": 63
},
{
"id": "jvasp-16842",
"created_at": "2022-09-04T14:38:19.864644Z",
"updated_at": "2022-09-04T14:38:19.864670Z",
"structure_string": "Th2 Ir2\n1.0\n3.713487 -0.000000 -1.299220\n0.000000 4.257009 0.000000\n0.025960 0.000000 6.030836\nTh Ir\n2 2\ndirect\n0.136999 0.750000 0.273999 Th\n0.863001 0.250000 0.726002 Th\n0.401565 0.750000 0.803129 Ir\n0.598436 0.250000 0.196872 Ir\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Th",
"Ir"
],
"chemical_system": "Ir-Th",
"density": 14.756676921244399,
"density_atomic": 0.0418930940271108,
"volume": 95.48113102869486,
"volume_molar": 14.375020274470101,
"formula_full": "Th2 Ir2",
"formula_reduced": "ThIr",
"formula_anonymous": "AB",
"energy_above_hull": 2.10380335,
"spacegroup": 63
},
{
"id": "jvasp-109331",
"created_at": "2022-09-04T14:38:20.170379Z",
"updated_at": "2022-09-04T14:38:20.170394Z",
"structure_string": "Y2 Si4 Ni2\n1.0\n8.450975 0.012823 0.000000\n-7.509207 3.876977 0.000000\n0.000000 0.000000 3.976062\nY Si Ni\n2 4 2\ndirect\n0.605274 0.394725 0.750000 Y\n0.394725 0.605275 0.250000 Y\n0.959726 0.040272 0.750000 Si\n0.040273 0.959728 0.250000 Si\n0.249887 0.750113 0.750000 Si\n0.750112 0.249887 0.250000 Si\n0.821998 0.178000 0.750000 Ni\n0.178001 0.822000 0.250000 Ni\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Y",
"Si",
"Ni"
],
"chemical_system": "Ni-Si-Y",
"density": 5.1795521383859295,
"density_atomic": 0.06122972722838266,
"volume": 130.65548977803792,
"volume_molar": 9.83532188137607,
"formula_full": "Y2 Si4 Ni2",
"formula_reduced": "YSi2Ni",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.3437012625,
"spacegroup": 63
},
{
"id": "jvasp-20192",
"created_at": "2022-09-04T14:38:20.295092Z",
"updated_at": "2022-09-04T14:38:20.295118Z",
"structure_string": "Mn2 Al12\n1.0\n4.977724 -0.005711 -0.000000\n-0.745516 4.921582 0.000000\n-0.000000 -0.000000 8.874366\nMn Al\n2 12\ndirect\n0.545103 0.545103 0.750000 Mn\n0.454896 0.454896 0.250000 Mn\n0.034006 0.398966 0.750000 Al\n0.965992 0.601034 0.250000 Al\n0.326730 0.673269 0.000000 Al\n0.673268 0.326731 0.500000 Al\n0.673268 0.326731 0.000000 Al\n0.326730 0.673269 0.500000 Al\n0.138654 0.138654 0.101407 Al\n0.861345 0.861346 0.601407 Al\n0.138654 0.138654 0.398593 Al\n0.861345 0.861346 0.898594 Al\n0.601033 0.965993 0.250000 Al\n0.398965 0.034006 0.750000 Al\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Mn",
"Al"
],
"chemical_system": "Al-Mn",
"density": 3.312803056237772,
"density_atomic": 0.0644066403645522,
"volume": 217.3688911695703,
"volume_molar": 9.350186139059096,
"formula_full": "Mn2 Al12",
"formula_reduced": "MnAl6",
"formula_anonymous": "AB6",
"energy_above_hull": 2.3157477201970447,
"spacegroup": 63
},
{
"id": "jvasp-108910",
"created_at": "2022-09-04T14:38:20.441835Z",
"updated_at": "2022-09-04T14:38:20.441866Z",
"structure_string": "Ni4 P2 Pd2\n1.0\n4.607172 0.006989 0.000000\n-3.277371 3.238043 0.000000\n-0.000000 0.000000 6.515244\nNi P Pd\n4 2 2\ndirect\n0.853475 0.146524 0.052961 Ni\n0.146524 0.853475 0.947038 Ni\n0.146524 0.853475 0.552961 Ni\n0.853475 0.146524 0.447039 Ni\n0.270915 0.729083 0.250000 P\n0.729084 0.270916 0.750000 P\n0.553340 0.446660 0.250000 Pd\n0.446660 0.553339 0.750000 Pd\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ni",
"P",
"Pd"
],
"chemical_system": "Ni-P-Pd",
"density": 8.692232894959321,
"density_atomic": 0.08218185817525113,
"volume": 97.34508537079027,
"volume_molar": 7.327822579963948,
"formula_full": "Ni4 P2 Pd2",
"formula_reduced": "Ni2PPd",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.5657664999999998,
"spacegroup": 63
},
{
"id": "jvasp-110086",
"created_at": "2022-09-04T14:38:26.249330Z",
"updated_at": "2022-09-04T14:38:26.249350Z",
"structure_string": "Th2 Co2 Si4\n1.0\n8.495406 -0.005704 0.000000\n-7.488193 4.012346 0.000000\n-0.000000 0.000000 4.100953\nTh Co Si\n2 2 4\ndirect\n0.608125 0.391878 0.749999 Th\n0.391878 0.608124 0.250000 Th\n0.820318 0.179684 0.749999 Co\n0.179685 0.820318 0.250000 Co\n0.958790 0.041212 0.749999 Si\n0.041212 0.958790 0.250000 Si\n0.250402 0.749601 0.749999 Si\n0.749601 0.250401 0.250000 Si\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Th",
"Co",
"Si"
],
"chemical_system": "Co-Si-Th",
"density": 8.257789474696803,
"density_atomic": 0.05730166222519478,
"volume": 139.6120058186114,
"volume_molar": 10.509539385320211,
"formula_full": "Th2 Co2 Si4",
"formula_reduced": "ThCoSi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.026150925,
"spacegroup": 63
},
{
"id": "jvasp-109321",
"created_at": "2022-09-04T14:38:26.913581Z",
"updated_at": "2022-09-04T14:38:26.913605Z",
"structure_string": "Tm2 Re4 Si2 C2\n1.0\n5.812250 -0.010751 0.000000\n-4.490544 3.690174 0.000000\n0.000000 -0.000000 7.264250\nTm Re Si C\n2 4 2 2\ndirect\n0.542016 0.457984 0.250000 Tm\n0.457984 0.542016 0.750000 Tm\n0.827243 0.172757 0.060563 Re\n0.172757 0.827242 0.939437 Re\n0.172757 0.827242 0.560563 Re\n0.827243 0.172757 0.439437 Re\n0.264757 0.735242 0.250000 Si\n0.735243 0.264757 0.750000 Si\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Tm",
"Re",
"Si",
"C"
],
"chemical_system": "C-Re-Si-Tm",
"density": 12.421785806082553,
"density_atomic": 0.06432751038113038,
"volume": 155.45448503683062,
"volume_molar": 9.361687906651078,
"formula_full": "Tm2 Re4 Si2 C2",
"formula_reduced": "TmRe2SiC",
"formula_anonymous": "ABCD2",
"energy_above_hull": 5.10563577,
"spacegroup": 63
},
{
"id": "jvasp-117353",
"created_at": "2022-09-04T14:38:27.023847Z",
"updated_at": "2022-09-04T14:38:27.023870Z",
"structure_string": "K2 Al2 C2 O10\n1.0\n6.252472 0.466135 0.000000\n-2.794873 5.612431 0.000000\n0.000000 0.000000 5.943181\nK Al C O\n2 2 2 10\ndirect\n0.376904 0.623097 0.250000 K\n0.623097 0.376904 0.750000 K\n0.000000 0.000000 0.000000 Al\n0.000000 0.000000 0.500000 Al\n0.755291 0.244710 0.250000 C\n0.244710 0.755291 0.750000 C\n0.632794 0.367207 0.250000 O\n0.367207 0.632794 0.750000 O\n0.815916 0.184085 0.057676 O\n0.184085 0.815916 0.942324 O\n0.184085 0.815916 0.557676 O\n0.815916 0.184085 0.442324 O\n0.866785 0.820672 0.250000 O\n0.133215 0.179328 0.750000 O\n0.179328 0.133215 0.250000 O\n0.820672 0.866786 0.750000 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"K",
"Al",
"C",
"O"
],
"chemical_system": "Al-C-K-O",
"density": 2.427301572303435,
"density_atomic": 0.07397193666184193,
"volume": 216.2982439292214,
"volume_molar": 8.141115444266168,
"formula_full": "K2 Al2 C2 O10",
"formula_reduced": "KAlCO5",
"formula_anonymous": "ABCD5",
"energy_above_hull": 2.5265722875,
"spacegroup": 63
}
]
}