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=350",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=348",
"results": [
{
"id": "jvasp-116902",
"created_at": "2022-09-04T14:38:45.091587Z",
"updated_at": "2022-09-04T14:38:45.091614Z",
"structure_string": "Li4 Mn4 F20\n1.0\n9.770600 -0.000000 0.000000\n-0.000000 4.242726 1.476599\n0.000000 -1.499724 7.222926\nLi Mn F\n4 4 20\ndirect\n0.283334 0.063490 0.842922 Li\n0.216666 0.063489 0.342922 Li\n0.783334 0.936513 0.657078 Li\n0.716666 0.936512 0.157078 Li\n0.573177 0.524611 0.820330 Mn\n0.073177 0.475392 0.679670 Mn\n0.926823 0.524610 0.320330 Mn\n0.426823 0.475391 0.179670 Mn\n0.199105 0.243327 0.579284 F\n0.206115 0.690616 0.762628 F\n0.558938 0.700699 0.258153 F\n0.699105 0.756675 0.920716 F\n0.565329 0.268634 0.054334 F\n0.058938 0.299303 0.241847 F\n0.571386 0.792361 0.624801 F\n0.065329 0.731368 0.445666 F\n0.428614 0.207641 0.375199 F\n0.934671 0.268634 0.554334 F\n0.793885 0.309386 0.237372 F\n0.441062 0.299303 0.741848 F\n0.928614 0.792360 0.124801 F\n0.434671 0.731368 0.945667 F\n0.941062 0.700699 0.758153 F\n0.300895 0.243326 0.079284 F\n0.071386 0.207641 0.875199 F\n0.706115 0.309386 0.737372 F\n0.800895 0.756675 0.420716 F\n0.293885 0.690616 0.262628 F\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Li",
"Mn",
"F"
],
"chemical_system": "F-Li-Mn",
"density": 3.245422425716906,
"density_atomic": 0.08721221995213882,
"volume": 321.05592559581805,
"volume_molar": 6.905157056321797,
"formula_full": "Li4 Mn4 F20",
"formula_reduced": "LiMnF5",
"formula_anonymous": "ABC5",
"energy_above_hull": 0.310506950554187,
"spacegroup": 14
},
{
"id": "jvasp-112872",
"created_at": "2022-09-04T14:38:45.090353Z",
"updated_at": "2022-09-04T14:38:45.090380Z",
"structure_string": "Rb2 V4 Fe2 Ag4 O16\n1.0\n4.702581 -0.000173 2.715123\n0.000509 14.848971 0.000209\n-0.000038 -0.000066 5.430104\nRb V Fe Ag O\n2 4 2 4 16\ndirect\n-0.000008 0.002044 0.000001 Rb\n-0.000000 0.497956 -0.000000 Rb\n0.666656 0.141578 0.666669 V\n0.666663 0.632958 0.666666 V\n0.333334 0.358423 0.333331 V\n0.333328 0.867041 0.333333 V\n-0.000004 0.750000 0.000000 Fe\n0.999995 0.250000 -0.000000 Fe\n0.666664 0.871030 0.666666 Ag\n0.666668 0.365442 0.666672 Ag\n0.333328 0.628970 0.333333 Ag\n0.333322 0.134558 0.333328 Ag\n0.742396 0.670453 0.928644 O\n0.756876 0.177219 0.922899 O\n0.328951 0.670452 0.742400 O\n0.320203 0.177217 0.756876 O\n0.071348 0.829546 0.671046 O\n0.077095 0.322782 0.679782 O\n0.257595 0.829547 0.071355 O\n0.333326 0.980803 0.333337 O\n0.671041 0.829547 0.257600 O\n0.679787 0.322783 0.243124 O\n0.666665 0.519197 0.666663 O\n0.666657 0.028259 0.666672 O\n0.922895 0.177218 0.320218 O\n0.333334 0.471742 0.333327 O\n0.243114 0.322781 0.077101 O\n0.928644 0.670454 0.328953 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Rb",
"V",
"Fe",
"Ag",
"O"
],
"chemical_system": "Ag-Fe-O-Rb-V",
"density": 5.140684267068416,
"density_atomic": 0.07384404609084969,
"volume": 379.1774893476428,
"volume_molar": 8.155215049553233,
"formula_full": "Rb2 V4 Fe2 Ag4 O16",
"formula_reduced": "RbV2Fe(AgO4)2",
"formula_anonymous": "ABC2D2E8",
"energy_above_hull": 2.51461403,
"spacegroup": 147
},
{
"id": "jvasp-115451",
"created_at": "2022-09-04T14:38:45.089083Z",
"updated_at": "2022-09-04T14:38:45.089115Z",
"structure_string": "Mg1 Au1 O3\n1.0\n4.013826 -0.000000 -0.000000\n-0.000000 4.013826 -0.000000\n0.000000 -0.000000 4.013826\nMg Au O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500001 0.500001 0.500001 Au\n0.500001 0.500001 0.000000 O\n0.500001 0.000000 0.500001 O\n0.000000 0.500001 0.500001 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Mg",
"Au",
"O"
],
"chemical_system": "Au-Mg-O",
"density": 6.914504598113569,
"density_atomic": 0.07732045105645909,
"volume": 64.66594454226632,
"volume_molar": 7.788548408237631,
"formula_full": "Mg1 Au1 O3",
"formula_reduced": "MgAuO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.3598914239999995,
"spacegroup": 221
},
{
"id": "jvasp-112913",
"created_at": "2022-09-04T14:38:45.087825Z",
"updated_at": "2022-09-04T14:38:45.087851Z",
"structure_string": "Li7 Co5 O12\n1.0\n4.653413 -0.005650 -1.613927\n-0.354623 5.559015 -1.044861\n-0.001329 -0.040889 7.481696\nLi Co O\n7 5 12\ndirect\n0.500401 0.261086 0.999849 Li\n0.514455 0.418439 0.675616 Li\n0.499599 0.738915 0.000152 Li\n0.508380 0.917542 0.669144 Li\n0.491620 0.082459 0.330856 Li\n0.485545 0.581562 0.324384 Li\n0.000000 0.500000 0.000000 Li\n0.002712 0.665615 0.670201 Co\n0.997287 0.334386 0.329799 Co\n0.997019 0.830184 0.329446 Co\n0.000000 0.000000 0.000000 Co\n0.002981 0.169817 0.670555 Co\n0.223558 0.278157 0.168033 O\n0.779061 0.043055 0.171809 O\n0.776098 0.194233 0.832305 O\n0.768563 0.546139 0.185752 O\n0.776442 0.721843 0.831967 O\n0.785770 0.877618 0.508597 O\n0.783604 0.376963 0.509603 O\n0.231437 0.453862 0.814248 O\n0.216396 0.623038 0.490397 O\n0.220939 0.956946 0.828191 O\n0.214230 0.122383 0.491403 O\n0.223902 0.805768 0.167695 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"Co",
"O"
],
"chemical_system": "Co-Li-O",
"density": 4.598246489757571,
"density_atomic": 0.12416555794047551,
"volume": 193.29031655868295,
"volume_molar": 4.850089557755615,
"formula_full": "Li7 Co5 O12",
"formula_reduced": "Li7Co5O12",
"formula_anonymous": "A5B7C12",
"energy_above_hull": 2.5957181875,
"spacegroup": 2
},
{
"id": "jvasp-115161",
"created_at": "2022-09-04T14:38:45.087502Z",
"updated_at": "2022-09-04T14:38:45.087534Z",
"structure_string": "K2 Te2\n1.0\n4.815235 -0.000000 0.000000\n0.000000 4.815235 -0.000000\n-0.000000 0.000000 6.989022\nK Te\n2 2\ndirect\n0.000000 0.000000 0.306614 K\n0.500000 0.500000 0.693388 K\n0.000000 0.000000 0.822659 Te\n0.500000 0.500000 0.177339 Te\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Te"
],
"chemical_system": "K-Te",
"density": 3.4163226663565336,
"density_atomic": 0.024683606234121587,
"volume": 162.05087547015586,
"volume_molar": 24.397329559062747,
"formula_full": "K2 Te2",
"formula_reduced": "KTe",
"formula_anonymous": "AB",
"energy_above_hull": 0.2142969416666667,
"spacegroup": 129
},
{
"id": "jvasp-117038",
"created_at": "2022-09-04T14:38:45.086572Z",
"updated_at": "2022-09-04T14:38:45.086598Z",
"structure_string": "Ba6 Ho2 Ru2 Ir2 O18\n1.0\n5.915939 0.000000 0.000000\n-2.957970 5.123353 0.000000\n-0.000000 -0.000000 14.580156\nBa Ho Ru Ir O\n6 2 2 2 18\ndirect\n0.000000 0.000000 0.749754 Ba\n0.000000 0.000000 0.249754 Ba\n0.666667 0.333333 0.408169 Ba\n0.333333 0.666666 0.594048 Ba\n0.333333 0.666666 0.908169 Ba\n0.666667 0.333333 0.094047 Ba\n0.000000 0.000000 0.500232 Ho\n0.000000 0.000000 0.000232 Ho\n0.666667 0.333333 0.836945 Ru\n0.333333 0.666666 0.336945 Ru\n0.333333 0.666666 0.164376 Ir\n0.666667 0.333333 0.664376 Ir\n0.491145 0.982289 0.251271 O\n0.982290 0.491145 0.751271 O\n0.508855 0.491145 0.751271 O\n0.508855 0.017710 0.751271 O\n0.350663 0.175331 0.585597 O\n0.824669 0.175331 0.585597 O\n0.824668 0.649337 0.585597 O\n0.647533 0.823766 0.411967 O\n0.352467 0.176233 0.911967 O\n0.176233 0.352467 0.411967 O\n0.649337 0.824668 0.085597 O\n0.175331 0.824668 0.085597 O\n0.175331 0.350663 0.085597 O\n0.491145 0.508855 0.251271 O\n0.823767 0.176233 0.911967 O\n0.823766 0.647533 0.911967 O\n0.176233 0.823766 0.411967 O\n0.017710 0.508855 0.251271 O\n",
"nsites": 30,
"nelements": 5,
"elements": [
"Ba",
"Ho",
"Ru",
"Ir",
"O"
],
"chemical_system": "Ba-Ho-Ir-O-Ru",
"density": 7.621834770040842,
"density_atomic": 0.0678861402185348,
"volume": 441.9164192193853,
"volume_molar": 8.87094293564769,
"formula_full": "Ba6 Ho2 Ru2 Ir2 O18",
"formula_reduced": "Ba3HoIrRuO9",
"formula_anonymous": "ABCD3E9",
"energy_above_hull": 2.444714438444444,
"spacegroup": 186
},
{
"id": "jvasp-115275",
"created_at": "2022-09-04T14:38:45.083361Z",
"updated_at": "2022-09-04T14:38:45.083395Z",
"structure_string": "B1 As1 O1\n1.0\n3.884176 0.000000 -0.000000\n-1.942088 3.363795 0.000000\n-0.000000 0.000000 2.660261\nB As O\n1 1 1\ndirect\n0.333334 0.666666 0.000000 B\n0.000000 0.000000 0.000000 As\n0.666668 0.333333 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"B",
"As",
"O"
],
"chemical_system": "As-B-O",
"density": 4.860198547027994,
"density_atomic": 0.08631148443517694,
"volume": 34.757831123309074,
"volume_molar": 6.977218384562539,
"formula_full": "B1 As1 O1",
"formula_reduced": "BAsO",
"formula_anonymous": "ABC",
"energy_above_hull": 3.0392492777777784,
"spacegroup": 187
},
{
"id": "jvasp-115183",
"created_at": "2022-09-04T14:38:45.082274Z",
"updated_at": "2022-09-04T14:38:45.082296Z",
"structure_string": "Li1 B3\n1.0\n3.117828 0.380520 0.217575\n1.936384 -3.303434 0.787633\n0.108599 0.840033 -3.032561\nLi B\n1 3\ndirect\n0.964709 0.006920 0.005944 Li\n0.596058 0.743927 0.374371 B\n0.333043 0.269960 0.637360 B\n0.714727 0.506893 0.755905 B\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"B"
],
"chemical_system": "B-Li",
"density": 2.0515164684616254,
"density_atomic": 0.12550943210040602,
"volume": 31.870114724127255,
"volume_molar": 4.798157922651073,
"formula_full": "Li1 B3",
"formula_reduced": "LiB3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.5305719375000004,
"spacegroup": 119
},
{
"id": "jvasp-113094",
"created_at": "2022-09-04T14:38:45.080857Z",
"updated_at": "2022-09-04T14:38:45.080881Z",
"structure_string": "K8 La1 P4 Se16\n1.0\n9.251756 0.037344 -7.133460\n-1.809546 8.200549 -8.121525\n0.072409 -0.037344 11.682294\nK La P Se\n8 1 4 16\ndirect\n0.839508 0.201361 0.872639 K\n0.671277 0.798639 0.638147 K\n0.160492 0.033132 0.361853 K\n0.328722 0.966868 0.127361 K\n0.746354 0.746354 0.000000 K\n0.253646 0.253646 0.000000 K\n0.788077 0.288077 0.500000 K\n0.211923 0.711923 0.500000 K\n0.500000 0.500000 0.000000 La\n0.872395 0.834902 0.452206 P\n0.617304 0.165098 0.037492 P\n0.382696 0.420189 0.547794 P\n0.127605 0.579812 0.962508 P\n-0.002188 0.720522 0.875814 Se\n0.011572 0.520666 0.017629 Se\n0.496962 0.479334 0.490906 Se\n0.844708 0.121998 0.124186 Se\n0.002187 0.878002 0.722709 Se\n0.155292 0.279479 0.277291 Se\n0.645395 0.876988 0.378838 Se\n0.615740 0.427847 0.258860 Se\n0.354605 0.733443 0.231593 Se\n0.498151 0.266557 0.621162 Se\n0.384260 0.643118 0.812106 Se\n0.168987 0.356882 0.741141 Se\n0.503038 -0.006055 0.982371 Se\n0.831013 0.572153 0.187894 Se\n0.501849 0.123012 0.768407 Se\n0.988429 0.006055 0.509094 Se\n",
"nsites": 29,
"nelements": 4,
"elements": [
"K",
"La",
"P",
"Se"
],
"chemical_system": "K-La-P-Se",
"density": 3.4386138387887297,
"density_atomic": 0.03265600950560716,
"volume": 888.0448174483962,
"volume_molar": 18.441141006423262,
"formula_full": "K8 La1 P4 Se16",
"formula_reduced": "K8La(PSe4)4",
"formula_anonymous": "AB4C8D16",
"energy_above_hull": 1.2389908574712645,
"spacegroup": 23
},
{
"id": "jvasp-112968",
"created_at": "2022-09-04T14:38:45.080177Z",
"updated_at": "2022-09-04T14:38:45.080214Z",
"structure_string": "Li8 Dy8 Sn8\n1.0\n9.315986 -0.000000 0.000000\n-4.657993 8.067880 0.000000\n0.000000 -0.000000 7.301738\nLi Dy Sn\n8 8 8\ndirect\n0.166781 0.333561 0.288740 Li\n0.166781 0.833219 0.288740 Li\n0.666439 0.833219 0.288740 Li\n0.833220 0.666439 0.788740 Li\n0.833220 0.166781 0.788740 Li\n0.333562 0.166781 0.788740 Li\n0.333334 0.666667 0.675958 Li\n0.666667 0.333333 0.175958 Li\n0.000000 0.000000 -0.000916 Dy\n0.000000 0.000000 0.499084 Dy\n0.022975 0.511488 0.993791 Dy\n0.488512 0.511488 0.993791 Dy\n0.488512 0.977025 0.993791 Dy\n0.977025 0.488512 0.493791 Dy\n0.511488 0.488512 0.493791 Dy\n0.511488 0.022975 0.493791 Dy\n0.166698 0.333396 0.729641 Sn\n0.166698 0.833302 0.729641 Sn\n0.666605 0.833302 0.729641 Sn\n0.833303 0.666604 0.229641 Sn\n0.833302 0.166698 0.229641 Sn\n0.333396 0.166698 0.229641 Sn\n0.333334 0.666667 0.259444 Sn\n0.666667 0.333333 0.759444 Sn\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"Dy",
"Sn"
],
"chemical_system": "Dy-Li-Sn",
"density": 6.975008043475286,
"density_atomic": 0.04373173813846513,
"volume": 548.8005055735555,
"volume_molar": 13.770641223846315,
"formula_full": "Li8 Dy8 Sn8",
"formula_reduced": "LiDySn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.5102927333333335,
"spacegroup": 186
},
{
"id": "jvasp-102710",
"created_at": "2022-09-04T14:38:45.077095Z",
"updated_at": "2022-09-04T14:38:45.077112Z",
"structure_string": "Mn1 Au4\n1.0\n2.955100 -0.012362 10.980082\n1.441324 2.579797 10.980082\n-0.021168 -0.012362 11.370768\nMn Au\n1 4\ndirect\n0.000000 0.000000 0.000000 Mn\n0.605512 0.605515 0.605514 Au\n0.201579 0.201580 0.201580 Au\n0.798418 0.798422 0.798421 Au\n0.394485 0.394487 0.394487 Au\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Mn",
"Au"
],
"chemical_system": "Au-Mn",
"density": 15.958597667240161,
"density_atomic": 0.057014967248571864,
"volume": 87.69627066873817,
"volume_molar": 10.562385721884011,
"formula_full": "Mn1 Au4",
"formula_reduced": "MnAu4",
"formula_anonymous": "AB4",
"energy_above_hull": 1.2751555042758618,
"spacegroup": 166
},
{
"id": "jvasp-115181",
"created_at": "2022-09-04T14:38:45.074305Z",
"updated_at": "2022-09-04T14:38:45.074329Z",
"structure_string": "Li1 B2\n1.0\n3.333457 0.000000 -0.000000\n-1.666728 2.886858 0.000000\n0.000000 0.000000 2.685899\nLi B\n1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.333333 0.666667 0.000000 B\n0.666666 0.333333 0.000000 B\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"B"
],
"chemical_system": "B-Li",
"density": 1.835029119697417,
"density_atomic": 0.1160676784091551,
"volume": 25.846988938854903,
"volume_molar": 5.188473520398242,
"formula_full": "Li1 B2",
"formula_reduced": "LiB2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.039405055555556,
"spacegroup": 191
}
]
}