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=-volume_molar&page=3390",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume_molar&page=3388",
"results": [
{
"id": "jvasp-74540",
"created_at": "2022-09-04T14:36:07.770059Z",
"updated_at": "2022-09-04T14:36:07.770083Z",
"structure_string": "Be2 Fe1 Pb1\n1.0\n-1.828104 1.828104 3.949402\n1.828104 -1.828104 3.949402\n1.828104 1.828104 -3.949402\nBe Fe Pb\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.499999 Be\n0.500000 0.500000 0.000000 Fe\n0.749999 0.250000 0.499999 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Fe",
"Pb"
],
"chemical_system": "Be-Fe-Pb",
"density": 8.840350364548714,
"density_atomic": 0.0757646917099475,
"volume": 52.795040931643115,
"volume_molar": 7.94847919800791,
"formula_full": "Be2 Fe1 Pb1",
"formula_reduced": "Be2FePb",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.97725963,
"spacegroup": 119
},
{
"id": "jvasp-9169",
"created_at": "2022-09-04T14:37:04.341325Z",
"updated_at": "2022-09-04T14:37:04.341358Z",
"structure_string": "Ca2 N12\n1.0\n5.280845 0.000000 2.774878\n2.640422 5.528393 1.387439\n0.034258 0.000000 6.347204\nCa N\n2 12\ndirect\n0.625000 0.750000 0.750000 Ca\n0.375000 0.250000 0.250000 Ca\n0.834459 0.386937 0.497961 N\n0.219356 0.113063 0.002040 N\n0.001174 0.250000 0.997651 N\n0.748825 0.250000 0.502348 N\n0.998825 0.750000 0.002349 N\n0.251174 0.750000 0.497652 N\n0.332419 0.886937 0.502040 N\n0.221396 0.613062 0.997960 N\n0.780643 0.886937 0.997960 N\n0.165541 0.613062 0.502040 N\n0.667580 0.113063 0.497960 N\n0.778603 0.386937 0.002040 N\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Ca",
"N"
],
"chemical_system": "Ca-N",
"density": 2.230813295731137,
"density_atomic": 0.07576640796088333,
"volume": 184.77845758806356,
"volume_molar": 7.948299150078636,
"formula_full": "Ca2 N12",
"formula_reduced": "CaN6",
"formula_anonymous": "AB6",
"energy_above_hull": 4.937862845714285,
"spacegroup": 70
},
{
"id": "jvasp-112621",
"created_at": "2022-09-04T14:38:41.396161Z",
"updated_at": "2022-09-04T14:38:41.396178Z",
"structure_string": "Ti3 Cr3 Si12\n1.0\n12.804066 -0.000000 0.000000\n-0.000000 4.010859 2.277565\n-0.000000 0.003065 4.627779\nTi Cr Si\n3 3 12\ndirect\n0.248767 -0.000001 0.500000 Ti\n0.585999 0.500000 0.500000 Ti\n0.082008 0.500000 0.500000 Ti\n0.914111 0.500000 -0.000001 Cr\n0.420147 0.500000 -0.000001 Cr\n0.749200 -0.000001 0.500000 Cr\n0.253261 0.677792 0.157806 Si\n0.752476 0.670780 0.157053 Si\n0.417982 0.165676 0.668517 Si\n0.912877 0.159934 0.666306 Si\n0.078852 0.835116 0.844087 Si\n0.752476 0.329219 0.842946 Si\n0.253261 0.322207 0.842193 Si\n0.584436 0.158631 0.161479 Si\n0.417982 0.834323 0.331482 Si\n0.912877 0.840065 0.333694 Si\n0.584436 0.841368 0.838521 Si\n0.078852 0.164883 0.155912 Si\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ti",
"Cr",
"Si"
],
"chemical_system": "Cr-Si-Ti",
"density": 4.449709140595257,
"density_atomic": 0.07576662802633018,
"volume": 237.5716125804714,
"volume_molar": 7.948276064109921,
"formula_full": "Ti3 Cr3 Si12",
"formula_reduced": "TiCrSi4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.8617316888888897,
"spacegroup": 3
},
{
"id": "jvasp-102083",
"created_at": "2022-09-04T14:37:10.522493Z",
"updated_at": "2022-09-04T14:37:10.522518Z",
"structure_string": "Na2 Li1 In1 F6\n1.0\n4.949277 -0.000000 2.857466\n1.649759 4.666223 2.857466\n0.000000 -0.000000 5.714933\nNa Li In F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Na\n0.750001 0.750000 0.750000 Na\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 In\n0.256599 0.256598 0.743401 F\n0.256599 0.743401 0.743402 F\n0.743402 0.743401 0.256599 F\n0.256599 0.743401 0.256599 F\n0.743402 0.256598 0.743402 F\n0.743402 0.256598 0.256599 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Na",
"Li",
"In",
"F"
],
"chemical_system": "F-In-Li-Na",
"density": 3.5445588546249933,
"density_atomic": 0.07576726415257923,
"volume": 131.98312109913482,
"volume_molar": 7.948209332031159,
"formula_full": "Na2 Li1 In1 F6",
"formula_reduced": "Na2LiInF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-111673",
"created_at": "2022-09-04T14:38:40.878886Z",
"updated_at": "2022-09-04T14:38:40.878907Z",
"structure_string": "Tb4 Mo4 C8\n1.0\n3.409430 -0.000000 0.000000\n-0.000000 5.727858 0.000000\n0.000000 0.000000 10.813026\nTb Mo C\n4 4 8\ndirect\n0.250000 0.087690 0.862550 Tb\n0.250000 0.587690 0.637450 Tb\n0.750000 0.912311 0.137450 Tb\n0.750000 0.412311 0.362550 Tb\n0.250000 0.402053 0.110036 Mo\n0.250000 0.902053 0.389965 Mo\n0.750000 0.597947 0.889965 Mo\n0.750000 0.097947 0.610036 Mo\n0.250000 0.158027 0.247417 C\n0.250000 0.658027 0.252583 C\n0.750000 0.841974 0.752583 C\n0.750000 0.341974 0.747418 C\n0.250000 0.720865 0.982575 C\n0.250000 0.220865 0.517426 C\n0.750000 0.279136 0.017426 C\n0.750000 0.779136 0.482574 C\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Tb",
"Mo",
"C"
],
"chemical_system": "C-Mo-Tb",
"density": 8.772344968749199,
"density_atomic": 0.07577024898506912,
"volume": 211.16467497886768,
"volume_molar": 7.947896226639946,
"formula_full": "Tb4 Mo4 C8",
"formula_reduced": "TbMoC2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.773681075000001,
"spacegroup": 62
},
{
"id": "jvasp-115400",
"created_at": "2022-09-04T14:38:44.886584Z",
"updated_at": "2022-09-04T14:38:44.886600Z",
"structure_string": "Pd1 F3\n1.0\n4.912772 0.758892 -0.880808\n-2.469913 -3.881112 0.011285\n0.293209 1.169233 -2.984520\nPd F\n1 3\ndirect\n0.804612 0.219175 0.598482 Pd\n0.930865 0.036512 0.945026 F\n0.678363 0.401846 0.251947 F\n0.304596 0.719197 0.598523 F\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pd",
"F"
],
"chemical_system": "F-Pd",
"density": 5.140243168204877,
"density_atomic": 0.07577083671960876,
"volume": 52.79075925744448,
"volume_molar": 7.947834576890094,
"formula_full": "Pd1 F3",
"formula_reduced": "PdF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.014905,
"spacegroup": 12
},
{
"id": "jvasp-102601",
"created_at": "2022-09-04T14:37:08.994676Z",
"updated_at": "2022-09-04T14:37:08.994694Z",
"structure_string": "Tb2 Fe4 Si2 C2\n1.0\n5.551297 -0.009005 0.000000\n-4.272484 3.544412 0.000000\n-0.000000 -0.000000 6.720423\nTb Fe Si C\n2 4 2 2\ndirect\n0.551452 0.448549 0.250000 Tb\n0.448550 0.551451 0.750000 Tb\n0.834895 0.165107 0.062556 Fe\n0.165107 0.834893 0.937443 Fe\n0.165107 0.834893 0.562556 Fe\n0.834895 0.165107 0.437443 Fe\n0.271047 0.728954 0.250000 Si\n0.728955 0.271047 0.750000 Si\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Tb",
"Fe",
"Si",
"C"
],
"chemical_system": "C-Fe-Si-Tb",
"density": 7.819000676794771,
"density_atomic": 0.07577304849862465,
"volume": 131.9730458011269,
"volume_molar": 7.947602583403131,
"formula_full": "Tb2 Fe4 Si2 C2",
"formula_reduced": "TbFe2SiC",
"formula_anonymous": "ABCD2",
"energy_above_hull": 3.6037756,
"spacegroup": 63
},
{
"id": "jvasp-103673",
"created_at": "2022-09-04T14:37:13.363296Z",
"updated_at": "2022-09-04T14:37:13.363324Z",
"structure_string": "V6 Si1 Ge1\n1.0\n4.726322 -0.000000 0.000000\n0.000000 4.726322 0.000000\n0.000000 -0.000000 4.726322\nV Si Ge\n6 1 1\ndirect\n-0.000000 0.500000 0.756386 V\n0.500000 0.243614 -0.000000 V\n0.756386 0.000000 0.500000 V\n-0.000000 0.500000 0.243614 V\n0.500000 0.756386 -0.000000 V\n0.243614 0.000000 0.500000 V\n0.000000 0.000000 0.000000 Si\n0.500000 0.500000 0.500000 Ge\n",
"nsites": 8,
"nelements": 3,
"elements": [
"V",
"Si",
"Ge"
],
"chemical_system": "Ge-Si-V",
"density": 6.391541696099167,
"density_atomic": 0.07577397455917123,
"volume": 105.57714632948111,
"volume_molar": 7.947505452940656,
"formula_full": "V6 Si1 Ge1",
"formula_reduced": "V6SiGe",
"formula_anonymous": "ABC6",
"energy_above_hull": 4.33366746875,
"spacegroup": 200
},
{
"id": "jvasp-120595",
"created_at": "2022-09-04T14:38:52.914009Z",
"updated_at": "2022-09-04T14:38:52.914037Z",
"structure_string": "V4 O2 F14\n1.0\n5.262954 -0.000000 0.000000\n-0.000000 5.572079 0.872392\n-0.000000 -0.309280 8.951907\nV O F\n4 2 14\ndirect\n0.668838 0.178380 0.801471 V\n0.331162 0.178380 0.301471 V\n0.163552 0.832809 0.672146 V\n0.836448 0.832809 0.172145 V\n0.469940 0.958850 0.776869 O\n0.530059 0.958850 0.276869 O\n0.351266 0.649902 0.576063 F\n0.054679 0.611517 0.815431 F\n0.259469 0.104409 0.513578 F\n0.129683 -0.161811 0.078224 F\n-0.012253 0.076019 0.292261 F\n0.740530 0.104409 0.013578 F\n0.012253 0.076019 0.792261 F\n0.273760 0.310203 0.117492 F\n0.494330 0.417792 0.849686 F\n0.505669 0.417792 0.349686 F\n0.648733 0.649902 0.076063 F\n-0.054679 0.611517 0.315431 F\n0.870316 -0.161811 0.578225 F\n0.726240 0.310203 0.617492 F\n",
"nsites": 20,
"nelements": 3,
"elements": [
"V",
"O",
"F"
],
"chemical_system": "F-O-V",
"density": 3.15663738594439,
"density_atomic": 0.07577479190775815,
"volume": 263.94001879076507,
"volume_molar": 7.94741972677516,
"formula_full": "V4 O2 F14",
"formula_reduced": "V2OF7",
"formula_anonymous": "AB2C7",
"energy_above_hull": 0.9305293877500004,
"spacegroup": 7
},
{
"id": "jvasp-36168",
"created_at": "2022-09-04T14:37:31.784324Z",
"updated_at": "2022-09-04T14:37:31.784353Z",
"structure_string": "Cr1 Fe2 Sn1\n1.0\n2.977376 2.977376 0.000000\n2.977376 0.000000 -2.977376\n-0.000000 2.977376 -2.977376\nCr Fe Sn\n1 2 1\ndirect\n0.500001 0.500001 0.500001 Cr\n0.250000 0.250000 0.250000 Fe\n0.750001 0.750001 0.750001 Fe\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cr",
"Fe",
"Sn"
],
"chemical_system": "Cr-Fe-Sn",
"density": 8.88334945017486,
"density_atomic": 0.07577552356807896,
"volume": 52.78749405678843,
"volume_molar": 7.9473429894410845,
"formula_full": "Cr1 Fe2 Sn1",
"formula_reduced": "CrFe2Sn",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.069392525,
"spacegroup": 225
},
{
"id": "jvasp-108125",
"created_at": "2022-09-04T14:35:52.786840Z",
"updated_at": "2022-09-04T14:35:52.786865Z",
"structure_string": "Fe1 Ni1 Pt2\n1.0\n2.692552 -0.000000 0.000000\n0.000000 2.692552 0.000000\n0.000000 -0.000000 7.280740\nFe Ni Pt\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Fe\n0.000000 0.000000 0.500000 Ni\n0.500000 0.500000 0.244660 Pt\n0.500000 0.500000 0.755340 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Fe",
"Ni",
"Pt"
],
"chemical_system": "Fe-Ni-Pt",
"density": 15.877575561336826,
"density_atomic": 0.0757802912671205,
"volume": 52.78417294412692,
"volume_molar": 7.9468429842429,
"formula_full": "Fe1 Ni1 Pt2",
"formula_reduced": "FeNiPt2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.419537675,
"spacegroup": 123
},
{
"id": "jvasp-25001",
"created_at": "2022-09-04T14:37:42.641870Z",
"updated_at": "2022-09-04T14:37:42.641893Z",
"structure_string": "Pr2 Ta6 O18\n1.0\n0.000000 5.460343 -0.004007\n7.609638 0.000000 0.000000\n0.000000 -0.349160 -8.256637\nPr Ta O\n2 6 18\ndirect\n0.966824 0.250000 0.565115 Pr\n0.033175 0.750000 0.434886 Pr\n0.526209 0.492789 0.300248 Ta\n0.526209 0.007211 0.300248 Ta\n0.473791 0.992789 0.699752 Ta\n0.000000 0.000000 0.000000 Ta\n0.473791 0.507211 0.699752 Ta\n0.000000 0.500000 0.000000 Ta\n0.267423 0.462034 0.466627 O\n0.732576 0.962034 0.533374 O\n0.317989 0.450029 0.120716 O\n0.557935 0.250000 0.689732 O\n0.846582 0.555430 0.213445 O\n0.442064 0.750000 0.310268 O\n0.846582 0.944571 0.213445 O\n0.087083 0.750000 0.984348 O\n0.267423 0.037966 0.466627 O\n0.682010 0.549971 0.879284 O\n0.153418 0.444571 0.786556 O\n0.647545 0.250000 0.338278 O\n0.352455 0.750000 0.661723 O\n0.153418 0.055430 0.786556 O\n0.317989 0.049971 0.120716 O\n0.682010 0.950029 0.879284 O\n0.732576 0.537966 0.533374 O\n0.912916 0.250000 0.015653 O\n",
"nsites": 26,
"nelements": 3,
"elements": [
"Pr",
"Ta",
"O"
],
"chemical_system": "O-Pr-Ta",
"density": 8.012638248123402,
"density_atomic": 0.07578316822277968,
"volume": 343.08409914412437,
"volume_molar": 7.946541298321972,
"formula_full": "Pr2 Ta6 O18",
"formula_reduced": "PrTa3O9",
"formula_anonymous": "AB3C9",
"energy_above_hull": 3.865162226923077,
"spacegroup": 11
}
]
}