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=-created_at&page=412",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=410",
"results": [
{
"id": "jvasp-115116",
"created_at": "2022-09-04T14:38:43.223512Z",
"updated_at": "2022-09-04T14:38:43.223538Z",
"structure_string": "Sc2 I2 O2\n1.0\n3.452827 0.000000 0.000000\n0.000000 3.363355 0.000000\n0.000000 0.000000 11.547824\nSc I O\n2 2 2\ndirect\n0.000000 0.500001 0.652033 Sc\n0.500000 0.500001 0.992024 Sc\n0.500000 0.000000 0.193634 I\n0.500000 0.500001 0.466578 I\n0.000000 0.000000 -0.032785 O\n0.000000 0.000000 0.728516 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sc",
"I",
"O"
],
"chemical_system": "I-O-Sc",
"density": 4.65227333237337,
"density_atomic": 0.04474078151207796,
"volume": 134.10583805694756,
"volume_molar": 13.460070558611717,
"formula_full": "Sc2 I2 O2",
"formula_reduced": "ScIO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.8125616750000002,
"spacegroup": 25
},
{
"id": "jvasp-117114",
"created_at": "2022-09-04T14:38:43.220977Z",
"updated_at": "2022-09-04T14:38:43.220992Z",
"structure_string": "Bi2 Pd4 O8\n1.0\n5.663957 -0.015924 -0.584492\n-2.525392 4.992985 -2.566015\n-0.009649 0.005003 6.454458\nBi Pd O\n2 4 8\ndirect\n0.861937 0.242846 0.641683 Bi\n0.138064 0.757155 0.358319 Bi\n0.000000 0.000000 0.000000 Pd\n0.500001 0.500001 0.000001 Pd\n0.500001 0.500001 0.500001 Pd\n0.500000 0.000000 0.000000 Pd\n0.646950 0.394294 0.228567 O\n0.353051 0.605707 0.771435 O\n0.842137 0.858595 0.642349 O\n0.157865 0.141406 0.357653 O\n0.521670 0.874255 0.247483 O\n0.478331 0.125746 0.752519 O\n0.878792 0.647255 0.988563 O\n0.121209 0.352746 0.011439 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Bi",
"Pd",
"O"
],
"chemical_system": "Bi-O-Pd",
"density": 8.849279668425106,
"density_atomic": 0.0767862151348756,
"volume": 182.3243921504516,
"volume_molar": 7.842736810796133,
"formula_full": "Bi2 Pd4 O8",
"formula_reduced": "Bi(PdO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.1281328142857143,
"spacegroup": 2
},
{
"id": "jvasp-114691",
"created_at": "2022-09-04T14:38:43.220133Z",
"updated_at": "2022-09-04T14:38:43.220159Z",
"structure_string": "Sn1 H1 C2\n1.0\n2.679365 -0.000000 0.000000\n-0.000000 2.679365 -0.000000\n0.000000 -0.000000 6.383129\nSn H C\n1 1 2\ndirect\n0.499999 0.499999 0.410743 Sn\n0.000000 0.000000 0.003395 H\n0.000000 0.000000 0.830934 C\n0.499999 0.499999 0.764928 C\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sn",
"H",
"C"
],
"chemical_system": "C-H-Sn",
"density": 5.208676228569215,
"density_atomic": 0.08728962142876026,
"volume": 45.8244626855728,
"volume_molar": 6.899034113597176,
"formula_full": "Sn1 H1 C2",
"formula_reduced": "SnHC2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.126305425,
"spacegroup": 99
},
{
"id": "jvasp-116723",
"created_at": "2022-09-04T14:38:43.213231Z",
"updated_at": "2022-09-04T14:38:43.213252Z",
"structure_string": "Al5 Ag15\n1.0\n6.995451 0.001317 -0.028934\n-0.029058 6.995391 -0.028934\n0.001311 0.001317 6.995510\nAl Ag\n5 15\ndirect\n0.690817 0.690818 0.690818 Al\n0.193148 0.317178 0.803302 Al\n0.317177 0.803302 0.193149 Al\n0.803302 0.193149 0.317178 Al\n0.058250 0.058250 0.058250 Al\n0.565992 0.934791 0.439441 Ag\n0.360312 0.961286 0.801334 Ag\n0.297944 0.630607 0.544219 Ag\n0.039651 0.701204 0.880874 Ag\n0.880874 0.039652 0.701204 Ag\n0.801333 0.360315 0.961286 Ag\n0.701204 0.880874 0.039652 Ag\n0.630606 0.544219 0.297945 Ag\n0.934790 0.439441 0.565993 Ag\n0.961285 0.801334 0.360315 Ag\n0.129015 0.450733 0.199904 Ag\n0.199904 0.129015 0.450733 Ag\n0.450732 0.199904 0.129015 Ag\n0.544218 0.297945 0.630607 Ag\n0.439440 0.565993 0.934791 Ag\n",
"nsites": 20,
"nelements": 2,
"elements": [
"Al",
"Ag"
],
"chemical_system": "Ag-Al",
"density": 8.502873783893802,
"density_atomic": 0.05842273515239067,
"volume": 342.33248319907864,
"volume_molar": 10.307872002725935,
"formula_full": "Al5 Ag15",
"formula_reduced": "AlAg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.198708645,
"spacegroup": 146
},
{
"id": "jvasp-114780",
"created_at": "2022-09-04T14:38:43.212567Z",
"updated_at": "2022-09-04T14:38:43.212596Z",
"structure_string": "Rb1 Na1 Cl1\n1.0\n4.431903 0.000000 -0.000000\n0.000000 4.431903 0.000000\n-0.000000 -0.000000 9.376430\nRb Na Cl\n1 1 1\ndirect\n0.000000 0.000000 -0.029419 Rb\n0.000000 0.000000 0.544822 Na\n0.000000 0.000000 0.280464 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Rb",
"Na",
"Cl"
],
"chemical_system": "Cl-Na-Rb",
"density": 1.2975490374535825,
"density_atomic": 0.016289330912266014,
"volume": 184.16962711101738,
"volume_molar": 36.96984727264196,
"formula_full": "Rb1 Na1 Cl1",
"formula_reduced": "RbNaCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0817933333333333,
"spacegroup": 99
},
{
"id": "jvasp-114897",
"created_at": "2022-09-04T14:38:43.212280Z",
"updated_at": "2022-09-04T14:38:43.212297Z",
"structure_string": "Al1 B1 O4\n1.0\n2.648140 -3.158786 0.000000\n2.648140 3.158786 0.000000\n0.000000 0.000000 2.916843\nAl B O\n1 1 4\ndirect\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 B\n0.733043 0.733043 0.000000 O\n0.796355 0.203645 0.500000 O\n0.203645 0.796355 0.500000 O\n0.266958 0.266958 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Al",
"B",
"O"
],
"chemical_system": "Al-B-O",
"density": 3.46378245393001,
"density_atomic": 0.12295524376146173,
"volume": 48.79824411263214,
"volume_molar": 4.897831581451868,
"formula_full": "Al1 B1 O4",
"formula_reduced": "AlBO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.6353765638888893,
"spacegroup": 65
},
{
"id": "jvasp-114790",
"created_at": "2022-09-04T14:38:43.205497Z",
"updated_at": "2022-09-04T14:38:43.205511Z",
"structure_string": "Na1 Tl1 Cl1\n1.0\n5.442718 0.000000 0.000000\n-2.721359 4.713532 -0.000000\n0.000000 -0.000000 3.527742\nNa Tl Cl\n1 1 1\ndirect\n0.333333 0.666666 0.000000 Na\n0.666667 0.333333 0.000000 Tl\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"Tl",
"Cl"
],
"chemical_system": "Cl-Na-Tl",
"density": 4.8223466813123315,
"density_atomic": 0.03314836758542298,
"volume": 90.50219418102665,
"volume_molar": 18.167231748233178,
"formula_full": "Na1 Tl1 Cl1",
"formula_reduced": "NaTlCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 187
},
{
"id": "jvasp-115210",
"created_at": "2022-09-04T14:38:43.204753Z",
"updated_at": "2022-09-04T14:38:43.204771Z",
"structure_string": "Sr1 Li1 P1\n1.0\n4.479938 1.550422 0.000000\n2.348314 7.003021 0.000000\n0.000000 0.000000 3.657208\nSr Li P\n1 1 1\ndirect\n-0.076535 0.424051 0.000000 Sr\n-0.075666 -0.076085 0.000000 Li\n0.424229 -0.075938 0.000000 P\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Li",
"P"
],
"chemical_system": "Li-P-Sr",
"density": 2.055316783161878,
"density_atomic": 0.029579233946853533,
"volume": 101.4225049029413,
"volume_molar": 20.359353358576755,
"formula_full": "Sr1 Li1 P1",
"formula_reduced": "SrLiP",
"formula_anonymous": "ABC",
"energy_above_hull": 0.8384139366666669,
"spacegroup": 47
},
{
"id": "jvasp-112033",
"created_at": "2022-09-04T14:38:43.200494Z",
"updated_at": "2022-09-04T14:38:43.200518Z",
"structure_string": "H4 C12 S4 O4\n1.0\n3.695350 -0.019468 -0.078754\n0.487572 7.491464 2.563233\n-0.369587 -0.272098 10.474797\nH C S O\n4 12 4 4\ndirect\n0.237933 0.419412 0.267036 H\n0.237934 0.919412 0.767036 H\n0.218374 0.251142 0.091843 H\n0.218374 0.751142 0.591843 H\n0.020442 0.779065 0.296969 C\n0.020444 0.279065 0.796969 C\n0.861357 0.949014 0.319798 C\n0.861357 0.449014 0.819799 C\n0.952463 0.646233 0.115900 C\n0.952463 0.146233 0.615900 C\n0.938311 0.484594 0.946652 C\n0.105685 0.885861 0.570128 C\n0.105686 0.385861 0.070128 C\n0.117049 0.976483 0.666416 C\n0.117049 0.476483 0.166416 C\n0.938310 0.984593 0.446652 C\n0.782755 0.694832 0.950578 S\n0.782754 0.194833 0.450579 S\n0.296339 0.128183 0.902218 S\n0.296337 0.628183 0.402218 S\n0.893143 0.779716 0.171399 O\n0.664023 0.555976 0.728808 O\n0.664024 0.055976 0.228809 O\n0.893143 0.279717 0.671399 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"H",
"C",
"S",
"O"
],
"chemical_system": "C-H-O-S",
"density": 1.9327857336999672,
"density_atomic": 0.08206040308555071,
"volume": 292.46748855205107,
"volume_molar": 7.338668265767251,
"formula_full": "H4 C12 S4 O4",
"formula_reduced": "HC3SO",
"formula_anonymous": "ABCD3",
"energy_above_hull": 4.6087455833333335,
"spacegroup": 1
},
{
"id": "jvasp-117111",
"created_at": "2022-09-04T14:38:43.197833Z",
"updated_at": "2022-09-04T14:38:43.197860Z",
"structure_string": "Ce4 Ni4 P4\n1.0\n3.958162 0.000000 0.000000\n-1.979082 3.427869 0.000000\n-0.000000 -0.000000 15.842517\nCe Ni P\n4 4 4\ndirect\n0.000000 0.000000 0.500000 Ce\n0.000000 0.000000 0.000000 Ce\n0.000000 0.000000 0.250000 Ce\n0.000000 0.000000 0.750000 Ce\n0.333334 0.666667 0.378519 Ni\n0.666667 0.333333 0.621481 Ni\n0.666667 0.333333 0.878519 Ni\n0.333334 0.666667 0.121481 Ni\n0.333334 0.666667 0.873045 P\n0.666667 0.333333 0.126955 P\n0.666667 0.333333 0.373045 P\n0.333334 0.666667 0.626955 P\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ce",
"Ni",
"P"
],
"chemical_system": "Ce-Ni-P",
"density": 7.100441060542231,
"density_atomic": 0.05582635624900038,
"volume": 214.95223414683937,
"volume_molar": 10.787271755906213,
"formula_full": "Ce4 Ni4 P4",
"formula_reduced": "CeNiP",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4248044666666664,
"spacegroup": 194
},
{
"id": "jvasp-112668",
"created_at": "2022-09-04T14:38:43.191355Z",
"updated_at": "2022-09-04T14:38:43.191381Z",
"structure_string": "Li4 Co1 Te1 O6\n1.0\n5.106866 0.002294 0.911144\n-2.762661 4.295090 0.911144\n-0.000811 -0.001486 5.141744\nLi Co Te O\n4 1 1 6\ndirect\n0.825427 0.174572 0.499999 Li\n0.173703 0.826296 0.499999 Li\n0.501565 0.498434 0.499999 Li\n0.666044 0.333956 -0.000001 Li\n0.334814 0.665186 -0.000001 Co\n-0.000441 0.000441 -0.000000 Te\n0.084057 0.393334 0.763287 O\n0.386356 0.071204 0.762569 O\n0.928795 0.613643 0.237430 O\n0.606666 0.915942 0.236711 O\n0.230589 0.237572 0.227259 O\n0.762428 0.769410 0.772739 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Li",
"Co",
"Te",
"O"
],
"chemical_system": "Co-Li-O-Te",
"density": 4.566737388663542,
"density_atomic": 0.10635682780880072,
"volume": 112.82773515558947,
"volume_molar": 5.6622041894913355,
"formula_full": "Li4 Co1 Te1 O6",
"formula_reduced": "Li4CoTeO6",
"formula_anonymous": "ABC4D6",
"energy_above_hull": 2.033468305555556,
"spacegroup": 5
},
{
"id": "jvasp-116467",
"created_at": "2022-09-04T14:38:43.190776Z",
"updated_at": "2022-09-04T14:38:43.190804Z",
"structure_string": "Dy4 Ni4 P4\n1.0\n3.907059 -0.000000 0.000000\n-1.953530 3.383612 0.000000\n0.000000 0.000000 15.281769\nDy Ni P\n4 4 4\ndirect\n0.000000 0.000000 0.500000 Dy\n0.000000 0.000000 0.000000 Dy\n0.000000 0.000000 0.250000 Dy\n0.000000 0.000000 0.750000 Dy\n0.333333 0.666666 0.371057 Ni\n0.666667 0.333333 0.628943 Ni\n0.666667 0.333333 0.871057 Ni\n0.333333 0.666666 0.128943 Ni\n0.333333 0.666666 0.877447 P\n0.666667 0.333333 0.122553 P\n0.666667 0.333333 0.377447 P\n0.333333 0.666666 0.622553 P\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Dy",
"Ni",
"P"
],
"chemical_system": "Dy-Ni-P",
"density": 8.29074319119183,
"density_atomic": 0.0593987204245367,
"volume": 202.02455396737778,
"volume_molar": 10.138502508064713,
"formula_full": "Dy4 Ni4 P4",
"formula_reduced": "DyNiP",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1820881333333335,
"spacegroup": 194
}
]
}