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=updated_at&page=4399",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=updated_at&page=4397",
"results": [
{
"id": "jvasp-116582",
"created_at": "2022-09-04T14:38:48.307897Z",
"updated_at": "2022-09-04T14:38:48.307918Z",
"structure_string": "V6 Fe4 O16\n1.0\n5.636840 -0.000000 0.000000\n-2.818419 4.881647 0.000000\n-0.000000 -0.000000 9.084206\nV Fe O\n6 4 16\ndirect\n0.849668 0.699338 0.645420 V\n0.849668 0.150332 0.645420 V\n0.150332 0.300663 0.145419 V\n0.300663 0.150332 0.645420 V\n0.150332 0.849669 0.145419 V\n0.699337 0.849669 0.145419 V\n0.333333 0.666667 0.871638 Fe\n0.666667 0.333334 0.371638 Fe\n0.666667 0.333334 0.952175 Fe\n0.333333 0.666667 0.452175 Fe\n0.825887 0.651776 0.254290 O\n0.000000 0.000000 0.508024 O\n0.000000 0.000000 0.008024 O\n0.348225 0.174113 0.254290 O\n0.825887 0.174113 0.254290 O\n0.651776 0.825888 0.754291 O\n0.174113 0.825888 0.754291 O\n0.486525 0.973050 0.008335 O\n0.026951 0.513476 0.008335 O\n0.486525 0.513476 0.008335 O\n0.973049 0.486525 0.508335 O\n0.666667 0.333334 0.752631 O\n0.513476 0.486525 0.508335 O\n0.513475 0.026951 0.508335 O\n0.174113 0.348225 0.754291 O\n0.333333 0.666667 0.252631 O\n",
"nsites": 26,
"nelements": 3,
"elements": [
"V",
"Fe",
"O"
],
"chemical_system": "Fe-O-V",
"density": 5.214833341786128,
"density_atomic": 0.10401220292272764,
"volume": 249.97066949265388,
"volume_molar": 5.789840605985382,
"formula_full": "V6 Fe4 O16",
"formula_reduced": "V3(FeO4)2",
"formula_anonymous": "A2B3C8",
"energy_above_hull": 3.5490285846153844,
"spacegroup": 186
},
{
"id": "jvasp-113552",
"created_at": "2022-09-04T14:38:48.312991Z",
"updated_at": "2022-09-04T14:38:48.313012Z",
"structure_string": "Li1 Ca1 N1\n1.0\n5.301279 2.757968 0.000000\n1.680081 4.217336 0.000000\n0.000000 0.000000 4.062882\nLi Ca N\n1 1 1\ndirect\n0.424018 -0.085936 0.000000 Li\n-0.076008 -0.085921 0.000000 Ca\n-0.075982 0.414068 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Ca",
"N"
],
"chemical_system": "Ca-Li-N",
"density": 1.4072592824504326,
"density_atomic": 0.04166136638004209,
"volume": 72.00916006050997,
"volume_molar": 14.454976596458705,
"formula_full": "Li1 Ca1 N1",
"formula_reduced": "LiCaN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.5836312233333332,
"spacegroup": 47
},
{
"id": "jvasp-120355",
"created_at": "2022-09-04T14:38:48.313242Z",
"updated_at": "2022-09-04T14:38:48.313271Z",
"structure_string": "Na2 Se1\n1.0\n4.989955 0.000000 0.000000\n-2.494977 4.321427 0.000000\n-0.000000 0.000000 4.880693\nNa Se\n2 1\ndirect\n0.333333 0.666667 0.000000 Na\n0.666666 0.333333 0.000000 Na\n0.000000 0.000000 0.000000 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Na",
"Se"
],
"chemical_system": "Na-Se",
"density": 1.9712590216181414,
"density_atomic": 0.02850466580122472,
"volume": 105.24592783933299,
"volume_molar": 21.126859728842195,
"formula_full": "Na2 Se1",
"formula_reduced": "Na2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1206266666666667,
"spacegroup": 191
},
{
"id": "jvasp-117144",
"created_at": "2022-09-04T14:38:48.317340Z",
"updated_at": "2022-09-04T14:38:48.317369Z",
"structure_string": "Rb4 S4 O16\n1.0\n7.554833 0.000000 0.000000\n-0.000000 6.797994 3.303685\n-0.000000 0.458871 7.706271\nRb S O\n4 4 16\ndirect\n0.493073 0.249989 0.000007 Rb\n0.993073 0.750010 -0.000006 Rb\n0.743424 0.249987 0.500021 Rb\n0.243424 0.750012 0.499980 Rb\n0.993052 0.250019 0.000001 S\n0.493052 0.749980 -0.000000 S\n0.243471 0.250012 0.500004 S\n0.743471 0.749987 0.499997 S\n0.629570 0.926821 0.373390 O\n0.129570 0.073178 0.626611 O\n0.857388 0.698829 0.374088 O\n0.357388 0.301170 0.625913 O\n0.857392 0.801182 0.625877 O\n0.357392 0.198817 0.374124 O\n0.606948 0.926821 0.873409 O\n0.606903 0.573107 0.126621 O\n0.379116 0.801162 0.125877 O\n0.879116 0.198837 0.874124 O\n0.129615 0.426883 0.373374 O\n0.106903 0.426893 0.873380 O\n0.379145 0.698837 0.874073 O\n0.879145 0.301162 0.125928 O\n0.106948 0.073178 0.126592 O\n0.629615 0.573116 0.626627 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Rb",
"S",
"O"
],
"chemical_system": "O-Rb-S",
"density": 3.1373389557182976,
"density_atomic": 0.0624473811869401,
"volume": 384.3235623949468,
"volume_molar": 9.64354412552922,
"formula_full": "Rb4 S4 O16",
"formula_reduced": "RbSO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.7077456666666668,
"spacegroup": 141
},
{
"id": "jvasp-119399",
"created_at": "2022-09-04T14:38:48.318131Z",
"updated_at": "2022-09-04T14:38:48.318156Z",
"structure_string": "V6 O6 F12\n1.0\n5.038121 -0.004497 -0.111655\n-2.484782 4.640263 -0.110876\n0.005581 -0.098977 12.389761\nV O F\n6 6 12\ndirect\n0.170218 0.385995 0.336774 V\n0.172614 0.313257 0.838479 V\n0.499999 -0.000001 0.500000 V\n0.500000 -0.000000 -0.000000 V\n0.827385 0.686741 0.161520 V\n0.829781 0.614003 0.663225 V\n0.427732 0.669468 0.418509 O\n0.970608 0.532797 0.283665 O\n0.572267 0.330530 0.581491 O\n0.698463 0.809223 0.056299 O\n0.301536 0.190775 0.943700 O\n0.029391 0.467201 0.716334 O\n0.370895 0.137368 0.378962 F\n0.580904 0.548688 0.786008 F\n0.419095 0.451310 0.213991 F\n0.112448 0.001733 0.741078 F\n0.887551 -0.001735 0.258922 F\n0.919275 0.204218 0.455935 F\n0.629104 0.862630 0.621038 F\n0.754114 0.115926 0.875536 F\n0.787375 0.345798 0.081204 F\n0.212624 0.654200 0.918796 F\n0.245885 0.884072 0.124464 F\n0.080724 0.795780 0.544064 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"V",
"O",
"F"
],
"chemical_system": "F-O-V",
"density": 3.6123118191524064,
"density_atomic": 0.08292100522397208,
"volume": 289.43209184663516,
"volume_molar": 7.262503323173688,
"formula_full": "V6 O6 F12",
"formula_reduced": "VOF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.91053956625,
"spacegroup": 2
},
{
"id": "jvasp-111898",
"created_at": "2022-09-04T14:38:48.320372Z",
"updated_at": "2022-09-04T14:38:48.320397Z",
"structure_string": "Li4 Cr4 P4 O16\n1.0\n4.722610 0.011478 0.000058\n-0.015163 6.276704 0.000100\n-0.000366 0.000025 10.122512\nLi Cr P O\n4 4 4 16\ndirect\n0.251257 0.270136 0.297596 Li\n0.748748 0.729860 0.797601 Li\n0.751230 0.229841 0.796540 Li\n0.248772 0.770161 0.296534 Li\n0.794943 0.501987 0.078688 Cr\n0.205060 0.498016 0.578686 Cr\n0.294902 -0.001930 0.015451 Cr\n0.705100 0.001926 0.515450 Cr\n0.662896 0.521496 0.388939 P\n0.337100 0.478506 0.888941 P\n0.162924 0.978500 0.705191 P\n0.837077 0.021496 0.205191 P\n0.989242 0.515286 0.397495 O\n0.010756 0.484717 0.897495 O\n0.447811 0.488380 0.743820 O\n0.552188 0.511617 0.243816 O\n0.530669 0.728141 0.447912 O\n0.469333 0.271862 0.947921 O\n0.030712 0.771825 0.646257 O\n0.052173 0.988484 0.850301 O\n-0.020882 0.830759 0.131080 O\n0.020873 0.169239 0.631076 O\n0.489272 0.984702 0.696653 O\n0.510732 0.015292 0.196652 O\n0.520841 0.330718 0.463002 O\n0.947829 0.011515 0.350300 O\n0.969289 0.228167 0.146251 O\n0.479152 0.669285 0.962999 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Cr",
"P",
"O"
],
"chemical_system": "Cr-Li-O-P",
"density": 3.406959774322627,
"density_atomic": 0.09331542753122499,
"volume": 300.0575654077211,
"volume_molar": 6.4535317678150115,
"formula_full": "Li4 Cr4 P4 O16",
"formula_reduced": "LiCrPO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.640516700000001,
"spacegroup": 19
},
{
"id": "jvasp-110979",
"created_at": "2022-09-04T14:38:48.321538Z",
"updated_at": "2022-09-04T14:38:48.321560Z",
"structure_string": "Tc3 Mo1\n1.0\n2.766214 0.000000 0.000000\n-1.383107 2.395611 0.000000\n-0.000000 -0.000000 8.951996\nTc Mo\n3 1\ndirect\n0.333332 0.666666 -0.000000 Tc\n0.666665 0.333333 0.757691 Tc\n0.666665 0.333333 0.242309 Tc\n0.333332 0.666666 0.500000 Mo\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Tc",
"Mo"
],
"chemical_system": "Mo-Tc",
"density": 10.915029951660893,
"density_atomic": 0.0674276522452002,
"volume": 59.32284258473107,
"volume_molar": 8.931262708214318,
"formula_full": "Tc3 Mo1",
"formula_reduced": "Tc3Mo",
"formula_anonymous": "AB3",
"energy_above_hull": 5.6051226,
"spacegroup": 187
},
{
"id": "jvasp-120358",
"created_at": "2022-09-04T14:38:48.327349Z",
"updated_at": "2022-09-04T14:38:48.327370Z",
"structure_string": "Na2 Se1\n1.0\n4.839598 0.000000 -1.209126\n0.000000 4.879754 0.000000\n-1.368477 0.000000 4.796338\nNa Se\n2 1\ndirect\n-0.200015 0.000000 -0.199965 Na\n0.133350 0.000000 0.466614 Na\n0.466665 0.000000 0.133351 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Na",
"Se"
],
"chemical_system": "Na-Se",
"density": 1.9721907201061106,
"density_atomic": 0.02851813828441228,
"volume": 105.1962077636663,
"volume_molar": 21.11687901903344,
"formula_full": "Na2 Se1",
"formula_reduced": "Na2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 0.12069,
"spacegroup": 191
},
{
"id": "jvasp-119405",
"created_at": "2022-09-04T14:38:48.334716Z",
"updated_at": "2022-09-04T14:38:48.334749Z",
"structure_string": "Dy3 Al9\n1.0\n5.683321 -0.017309 5.469353\n2.316233 5.189942 5.469353\n-0.026769 -0.017309 7.887536\nDy Al\n3 9\ndirect\n0.000000 0.000000 0.000000 Dy\n0.782232 0.782232 0.782233 Dy\n0.217767 0.217767 0.217767 Dy\n0.500000 0.500000 0.000000 Al\n-0.000000 0.500000 0.500000 Al\n0.500000 -0.000000 0.500000 Al\n0.703145 0.263461 0.703146 Al\n0.703145 0.703145 0.263461 Al\n0.263461 0.703145 0.703146 Al\n0.296854 0.736538 0.296855 Al\n0.296854 0.296854 0.736539 Al\n0.736539 0.296854 0.296855 Al\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Dy",
"Al"
],
"chemical_system": "Al-Dy",
"density": 5.1815988271837075,
"density_atomic": 0.05127132084214245,
"volume": 234.04897324464096,
"volume_molar": 11.745632180105847,
"formula_full": "Dy3 Al9",
"formula_reduced": "DyAl3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.5001912250000002,
"spacegroup": 166
},
{
"id": "jvasp-117108",
"created_at": "2022-09-04T14:38:48.334787Z",
"updated_at": "2022-09-04T14:38:48.334813Z",
"structure_string": "Sc1 P4 Ru6\n1.0\n6.941334 0.000000 0.000000\n-3.470667 6.011372 0.000000\n-0.000000 -0.000000 3.682055\nSc P Ru\n1 4 6\ndirect\n0.000000 0.000000 0.000000 Sc\n0.186178 0.372356 0.500001 P\n0.627643 0.813822 0.500001 P\n0.186177 0.813822 0.500001 P\n0.666666 0.333333 -0.000000 P\n0.803892 0.607785 0.500001 Ru\n0.392214 0.196107 0.500001 Ru\n0.803892 0.196107 0.500001 Ru\n0.464410 0.928821 -0.000000 Ru\n0.071179 0.535589 -0.000000 Ru\n0.464410 0.535589 -0.000000 Ru\n",
"nsites": 11,
"nelements": 3,
"elements": [
"Sc",
"P",
"Ru"
],
"chemical_system": "P-Ru-Sc",
"density": 8.37906957119045,
"density_atomic": 0.07159552326618498,
"volume": 153.6408911923599,
"volume_molar": 8.411337029565779,
"formula_full": "Sc1 P4 Ru6",
"formula_reduced": "Sc(P2Ru3)2",
"formula_anonymous": "AB4C6",
"energy_above_hull": 4.505908204545454,
"spacegroup": 187
},
{
"id": "jvasp-113553",
"created_at": "2022-09-04T14:38:48.336720Z",
"updated_at": "2022-09-04T14:38:48.336753Z",
"structure_string": "Li1 Ca1 N1\n1.0\n4.011054 -0.000000 -0.000000\n-2.005527 3.473674 0.000000\n-0.000000 -0.000000 4.372570\nLi Ca N\n1 1 1\ndirect\n0.333332 0.666666 0.000000 Li\n0.000000 0.000000 0.000000 Ca\n0.666665 0.333333 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Ca",
"N"
],
"chemical_system": "Ca-Li-N",
"density": 1.663326587412752,
"density_atomic": 0.049242139833111084,
"volume": 60.92342879833096,
"volume_molar": 12.229648793512892,
"formula_full": "Li1 Ca1 N1",
"formula_reduced": "LiCaN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.5920645566666662,
"spacegroup": 187
},
{
"id": "jvasp-117152",
"created_at": "2022-09-04T14:38:48.339858Z",
"updated_at": "2022-09-04T14:38:48.339884Z",
"structure_string": "Nd6 Ga2 Ni2 S14\n1.0\n9.787365 0.000000 0.000000\n-4.893683 8.476107 0.000000\n-0.000000 -0.000000 6.275144\nNd Ga Ni S\n6 2 2 14\ndirect\n0.835546 0.624175 0.676272 Nd\n0.788630 0.164455 0.676272 Nd\n0.375825 0.211370 0.676272 Nd\n0.164455 0.375825 0.176273 Nd\n0.211371 0.835546 0.176273 Nd\n0.624176 0.788630 0.176273 Nd\n0.333334 0.666667 0.600784 Ga\n0.666667 0.333333 0.100784 Ga\n0.000000 0.000000 0.996953 Ni\n0.000000 0.000000 0.496953 Ni\n0.873147 0.101658 0.262457 S\n0.101658 0.228511 0.762457 S\n0.771489 0.873147 0.762457 S\n0.126854 0.898342 0.762457 S\n0.666667 0.333333 0.461341 S\n0.333334 0.666667 0.961341 S\n0.914357 0.441066 0.955781 S\n0.085644 0.558934 0.455781 S\n0.441066 0.526710 0.455781 S\n0.526710 0.085643 0.955781 S\n0.228512 0.126853 0.262457 S\n0.558935 0.473291 0.955781 S\n0.473291 0.914357 0.455781 S\n0.898343 0.771489 0.262457 S\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Nd",
"Ga",
"Ni",
"S"
],
"chemical_system": "Ga-Nd-Ni-S",
"density": 5.011794082555541,
"density_atomic": 0.046102590618117674,
"volume": 520.5781210604754,
"volume_molar": 13.062478006677097,
"formula_full": "Nd6 Ga2 Ni2 S14",
"formula_reduced": "Nd3GaNiS7",
"formula_anonymous": "ABC3D7",
"energy_above_hull": 1.7739682687499996,
"spacegroup": 173
}
]
}