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=density_atomic&page=4446",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=4444",
"results": [
{
"id": "jvasp-32216",
"created_at": "2022-09-04T14:36:02.911053Z",
"updated_at": "2022-09-04T14:36:02.911077Z",
"structure_string": "Zn2 H8 C4 O12\n1.0\n5.209607 -0.000000 1.793026\n2.559194 5.625834 1.029031\n0.075055 0.023285 8.246655\nZn H C O\n2 8 4 12\ndirect\n0.435761 0.749999 0.750000 Zn\n0.564239 0.250000 0.250000 Zn\n0.180377 0.190408 0.641564 H\n0.647772 0.311516 0.650719 H\n0.110008 0.188483 0.849281 H\n0.352228 0.688483 0.349281 H\n0.819623 0.809591 0.358436 H\n0.487648 0.690408 0.141564 H\n0.889992 0.811516 0.150719 H\n0.512351 0.309591 0.858436 H\n0.116993 0.248128 0.149717 C\n0.985163 0.748127 0.649717 C\n0.883007 0.751870 0.850283 C\n0.014836 0.251871 0.350283 C\n0.818767 0.746092 0.575962 O\n0.049377 0.752578 0.925191 O\n0.359176 0.246093 0.075962 O\n0.227148 0.747419 0.574809 O\n0.640823 0.753905 0.924038 O\n0.772852 0.252579 0.425191 O\n0.374660 0.625121 0.240082 O\n0.739863 0.874878 0.259918 O\n0.260136 0.125121 0.740082 O\n0.950623 0.247420 0.074809 O\n0.181232 0.253906 0.424038 O\n0.625340 0.374878 0.759918 O\n",
"nsites": 26,
"nelements": 4,
"elements": [
"Zn",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Zn",
"density": 2.611671627975519,
"density_atomic": 0.1079191693339313,
"volume": 240.92105378933115,
"volume_molar": 5.580232684488014,
"formula_full": "Zn2 H8 C4 O12",
"formula_reduced": "ZnH4(CO3)2",
"formula_anonymous": "AB2C4D6",
"energy_above_hull": 3.240247030769231,
"spacegroup": 15
},
{
"id": "jvasp-36739",
"created_at": "2022-09-04T14:38:00.445791Z",
"updated_at": "2022-09-04T14:38:00.445809Z",
"structure_string": "Li4 Al4 B16\n1.0\n3.339529 0.000000 0.000000\n0.000000 5.890668 -0.000000\n0.000000 0.000000 11.303647\nLi Al B\n4 4 16\ndirect\n0.000000 0.372366 0.149606 Li\n0.000000 0.627634 0.850395 Li\n0.000000 0.127634 0.649606 Li\n0.000000 0.872366 0.350395 Li\n0.000000 0.856731 0.092903 Al\n0.000000 0.143270 0.907097 Al\n0.000000 0.643270 0.592903 Al\n0.000000 0.356731 0.407097 Al\n0.500000 0.302208 0.813642 B\n0.500000 0.697792 0.186358 B\n0.500000 0.131800 0.471523 B\n0.500000 0.868200 0.528477 B\n0.500000 0.368200 0.971523 B\n0.500000 0.631800 0.028477 B\n0.500000 0.616356 0.449867 B\n0.500000 0.518777 0.303184 B\n0.500000 0.883645 0.949867 B\n0.500000 0.116356 0.050133 B\n0.500000 0.802208 0.686358 B\n0.500000 0.481223 0.696816 B\n0.500000 0.981224 0.803184 B\n0.500000 0.018777 0.196816 B\n0.500000 0.383644 0.550134 B\n0.500000 0.197792 0.313642 B\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"Al",
"B"
],
"chemical_system": "Al-B-Li",
"density": 2.3049937732744734,
"density_atomic": 0.10793017707065625,
"volume": 222.36598374417986,
"volume_molar": 5.579663559763845,
"formula_full": "Li4 Al4 B16",
"formula_reduced": "LiAlB4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.734188855555556,
"spacegroup": 55
},
{
"id": "jvasp-114670",
"created_at": "2022-09-04T14:38:42.560572Z",
"updated_at": "2022-09-04T14:38:42.560596Z",
"structure_string": "Mg1 H1 C2\n1.0\n2.990061 0.000000 0.000000\n0.000000 2.990061 -0.000000\n-0.000000 0.000000 4.144981\nMg H C\n1 1 2\ndirect\n0.500000 0.500000 0.407481 Mg\n0.000000 0.000000 -0.013023 H\n0.000000 0.000000 0.723709 C\n0.500000 0.500000 0.891834 C\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"H",
"C"
],
"chemical_system": "C-H-Mg",
"density": 2.2106285725455113,
"density_atomic": 0.10793874154633491,
"volume": 37.058056659692646,
"volume_molar": 5.579220837418113,
"formula_full": "Mg1 H1 C2",
"formula_reduced": "MgHC2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.8159822625,
"spacegroup": 99
},
{
"id": "jvasp-63708",
"created_at": "2022-09-04T14:35:42.430684Z",
"updated_at": "2022-09-04T14:35:42.430706Z",
"structure_string": "Sc4 B8 C8\n1.0\n3.444869 0.000000 0.000000\n0.000000 5.276118 -0.000000\n0.000000 -0.000000 10.191704\nSc B C\n4 8 8\ndirect\n0.000000 0.137864 0.851294 Sc\n0.000000 0.862137 0.148706 Sc\n0.000000 0.362137 0.351294 Sc\n0.000000 0.637864 0.648706 Sc\n0.500000 0.986573 0.688992 B\n0.500000 0.013427 0.311007 B\n0.500000 0.486573 0.811007 B\n0.500000 0.513428 0.188992 B\n0.500000 0.143704 0.035428 B\n0.500000 0.643704 0.464572 B\n0.500000 0.356296 0.535427 B\n0.500000 0.856296 0.964572 B\n0.500000 0.202864 0.190905 C\n0.500000 0.392505 0.955371 C\n0.500000 0.607496 0.044629 C\n0.500000 0.107495 0.455371 C\n0.500000 0.892505 0.544628 C\n0.500000 0.297136 0.690905 C\n0.500000 0.702864 0.309095 C\n0.500000 0.797136 0.809095 C\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Sc",
"B",
"C"
],
"chemical_system": "B-C-Sc",
"density": 3.2486279410451453,
"density_atomic": 0.10796823018150316,
"volume": 185.23967621195987,
"volume_molar": 5.577697022426229,
"formula_full": "Sc4 B8 C8",
"formula_reduced": "Sc(BC)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 4.923468083333334,
"spacegroup": 55
},
{
"id": "jvasp-112209",
"created_at": "2022-09-04T14:38:46.680337Z",
"updated_at": "2022-09-04T14:38:46.680363Z",
"structure_string": "Sn2 H16 C8 F4\n1.0\n4.422193 0.011810 -0.034387\n-1.841858 7.114428 -0.316533\n0.037711 0.011421 8.824541\nSn H C F\n2 16 8 4\ndirect\n0.999492 0.896753 0.008952 Sn\n0.429489 0.580829 0.497564 Sn\n0.122445 0.849096 0.722152 H\n0.815568 0.964535 0.729734 H\n0.379420 0.142233 0.631860 H\n0.334590 0.626133 0.204551 H\n0.648526 0.519195 0.226802 H\n0.240154 0.294817 0.087121 H\n0.945886 0.327358 0.212086 H\n0.487291 0.176271 0.824262 H\n0.049693 0.335527 0.874742 H\n0.306538 0.628634 0.784335 H\n0.613457 0.513227 0.776826 H\n0.780519 0.958488 0.279715 H\n0.094440 0.851539 0.301979 H\n0.483176 0.150311 0.294404 H\n0.188927 0.182856 0.419377 H\n0.941729 0.301439 0.682351 H\n0.048515 0.968488 0.774654 C\n0.284870 0.153951 0.746453 C\n0.405733 0.510688 0.257276 C\n0.237311 0.156695 0.298334 C\n0.144185 0.323772 0.760141 C\n0.380508 0.509226 0.731889 C\n0.023305 0.966977 0.249237 C\n0.191750 0.320974 0.208161 C\n0.527215 0.860448 0.506825 F\n0.901728 0.617137 -0.000288 F\n0.501612 0.896159 0.010141 F\n0.927290 0.581204 0.496345 F\n",
"nsites": 30,
"nelements": 4,
"elements": [
"Sn",
"H",
"C",
"F"
],
"chemical_system": "C-F-H-Sn",
"density": 2.543707737195351,
"density_atomic": 0.1079719539164568,
"volume": 277.8499315036243,
"volume_molar": 5.577504658903946,
"formula_full": "Sn2 H16 C8 F4",
"formula_reduced": "SnH8(C2F)2",
"formula_anonymous": "AB2C4D8",
"energy_above_hull": 3.679760151,
"spacegroup": 2
},
{
"id": "jvasp-103762",
"created_at": "2022-09-04T14:36:58.417108Z",
"updated_at": "2022-09-04T14:36:58.417124Z",
"structure_string": "H16 C24 O4\n1.0\n7.547333 -0.000000 0.000000\n0.000000 5.450407 0.000000\n0.000000 0.000000 9.906295\nH C O\n16 24 4\ndirect\n0.843523 0.393687 0.040042 H\n0.654402 0.709630 0.809660 H\n0.656476 0.893687 0.040042 H\n0.843523 0.606313 0.540042 H\n0.345598 0.709630 0.690339 H\n0.343523 0.893687 0.459957 H\n0.154402 0.790371 0.190340 H\n0.156476 0.606313 0.959957 H\n0.845597 0.790371 0.309660 H\n0.343523 0.106313 0.959957 H\n0.154402 0.209629 0.690339 H\n0.156476 0.393687 0.459957 H\n0.654402 0.290371 0.309660 H\n0.656476 0.106313 0.540042 H\n0.845597 0.209629 0.809660 H\n0.345598 0.290371 0.190340 H\n0.911700 0.221152 0.021309 C\n0.502621 0.396605 0.627943 C\n0.585886 0.381373 0.392385 C\n0.588299 0.278848 0.521308 C\n0.002621 0.103396 0.372057 C\n0.497379 0.396605 0.872056 C\n0.088299 0.221152 0.478691 C\n0.414114 0.381373 0.107614 C\n0.411701 0.278848 0.978691 C\n0.914114 0.118627 0.892385 C\n0.085886 0.118627 0.607614 C\n0.997379 0.103396 0.127943 C\n0.411701 0.721152 0.478691 C\n0.585886 0.618627 0.892385 C\n0.502621 0.603396 0.127943 C\n0.911700 0.778849 0.521308 C\n0.914114 0.881373 0.392385 C\n0.997379 0.896605 0.627943 C\n0.414114 0.618627 0.607614 C\n0.497379 0.603396 0.372057 C\n0.088299 0.778849 0.978691 C\n0.085886 0.881373 0.107614 C\n0.002621 0.896605 0.872056 C\n0.588299 0.721152 0.021309 C\n0.000000 0.230251 0.250000 O\n0.000000 0.769750 0.750000 O\n0.500000 0.730251 0.250000 O\n0.500000 0.269750 0.750000 O\n",
"nsites": 44,
"nelements": 3,
"elements": [
"H",
"C",
"O"
],
"chemical_system": "C-H-O",
"density": 1.501112136010515,
"density_atomic": 0.10797394614664564,
"volume": 407.5057138343454,
"volume_molar": 5.577401748215244,
"formula_full": "H16 C24 O4",
"formula_reduced": "H4C6O",
"formula_anonymous": "AB4C6",
"energy_above_hull": 5.370340318181819,
"spacegroup": 60
},
{
"id": "jvasp-36375",
"created_at": "2022-09-04T14:37:14.292514Z",
"updated_at": "2022-09-04T14:37:14.292538Z",
"structure_string": "Ca1 C2\n1.0\n1.382678 -2.394868 -0.000000\n1.382678 2.394868 0.000000\n0.000000 -0.000000 4.194984\nCa C\n1 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.333334 0.666668 0.500000 C\n0.666668 0.333334 0.500000 C\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ca",
"C"
],
"chemical_system": "C-Ca",
"density": 3.8312467513237385,
"density_atomic": 0.10798372791666178,
"volume": 27.781963615067074,
"volume_molar": 5.576896515971079,
"formula_full": "Ca1 C2",
"formula_reduced": "CaC2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.6405434733333326,
"spacegroup": 191
},
{
"id": "jvasp-118645",
"created_at": "2022-09-04T14:38:26.600013Z",
"updated_at": "2022-09-04T14:38:26.600039Z",
"structure_string": "Na1 Al1 O2\n1.0\n3.043256 0.000000 -0.000000\n0.000000 3.043256 0.000000\n0.000000 0.000000 3.999560\nNa Al O\n1 1 2\ndirect\n0.500001 0.500001 0.502502 Na\n0.000000 0.000000 0.002539 Al\n0.000000 0.000000 0.502457 O\n0.500001 0.500001 0.002502 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Al",
"O"
],
"chemical_system": "Al-Na-O",
"density": 3.6746452099332094,
"density_atomic": 0.10798683216238278,
"volume": 37.04155330702812,
"volume_molar": 5.57673619959917,
"formula_full": "Na1 Al1 O2",
"formula_reduced": "NaAlO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9023122,
"spacegroup": 123
},
{
"id": "jvasp-101981",
"created_at": "2022-09-04T14:37:02.063863Z",
"updated_at": "2022-09-04T14:37:02.063899Z",
"structure_string": "H16 Pb2 C12 O8\n1.0\n4.290954 0.110635 0.392233\n1.450933 7.645815 1.749500\n0.029888 0.036346 10.787396\nH Pb C O\n16 2 12 8\ndirect\n0.314605 0.832934 0.317396 H\n0.865447 0.123171 0.699685 H\n0.868259 0.625274 0.698645 H\n0.778384 0.355875 0.659656 H\n0.774833 0.857891 0.659622 H\n0.291814 0.854423 0.549342 H\n0.363543 0.123679 0.592676 H\n0.365331 0.622776 0.593048 H\n0.293083 0.355312 0.549234 H\n0.817505 0.835433 0.423004 H\n0.889781 0.102877 0.466816 H\n0.891019 0.603787 0.466716 H\n0.404445 0.102351 0.356401 H\n0.407985 0.600315 0.356451 H\n0.317469 0.335053 0.316353 H\n0.819365 0.334509 0.423377 H\n0.094343 0.478827 0.007704 Pb\n0.088532 0.979365 0.008355 Pb\n0.670536 0.239393 0.681170 C\n0.462370 0.248279 0.801603 C\n0.464341 0.746129 0.802164 C\n0.483216 0.235851 0.567879 C\n0.483302 0.735587 0.567969 C\n0.670649 0.740137 0.680993 C\n0.718525 0.712028 0.213903 C\n0.699533 0.722624 0.448087 C\n0.512343 0.218815 0.334880 C\n0.512193 0.718062 0.335066 C\n0.720518 0.209888 0.214453 C\n0.699667 0.222347 0.448172 C\n0.552559 0.631259 0.904468 O\n0.975990 0.596966 0.215260 O\n0.975004 0.092449 0.217215 O\n0.630350 0.826885 0.111586 O\n0.636748 0.324174 0.111413 O\n0.206850 0.861170 0.800825 O\n0.207878 0.365711 0.798860 O\n0.546152 0.133961 0.904627 O\n",
"nsites": 38,
"nelements": 4,
"elements": [
"H",
"Pb",
"C",
"O"
],
"chemical_system": "C-H-O-Pb",
"density": 3.316186819761636,
"density_atomic": 0.10800255803290568,
"volume": 351.84351826576506,
"volume_molar": 5.575924190763338,
"formula_full": "H16 Pb2 C12 O8",
"formula_reduced": "H8Pb(C3O2)2",
"formula_anonymous": "AB4C6D8",
"energy_above_hull": 4.3948813063157885,
"spacegroup": 2
},
{
"id": "jvasp-119521",
"created_at": "2022-09-04T14:38:49.944640Z",
"updated_at": "2022-09-04T14:38:49.944667Z",
"structure_string": "Li4 Cr2 Co6 O16\n1.0\n4.924623 -0.038350 2.889079\n1.687271 9.165518 2.880765\n-0.040400 -0.008436 5.709312\nLi Cr Co O\n4 2 6 16\ndirect\n0.560373 0.318664 0.560484 Li\n0.060362 0.818662 0.060558 Li\n0.937180 0.188270 0.937281 Li\n0.437171 0.688267 0.437301 Li\n0.252624 0.241740 0.252834 Cr\n0.752616 0.741742 0.752895 Cr\n0.000187 0.501060 0.498552 Co\n0.500151 0.001080 0.500169 Co\n0.998687 0.001119 0.500118 Co\n0.000157 0.501082 0.000113 Co\n0.498699 0.501121 0.000062 Co\n0.500176 0.001062 -0.001390 Co\n0.353389 0.381181 0.911993 O\n0.101898 0.617097 0.640434 O\n0.601910 0.117097 0.140484 O\n0.640546 0.617042 0.102110 O\n0.140563 0.117057 0.602094 O\n0.853369 0.881181 0.412066 O\n0.411987 0.881090 0.853464 O\n0.367584 0.897073 0.367687 O\n0.853422 0.881169 0.853440 O\n0.353430 0.381170 0.353378 O\n0.131343 0.606355 0.131107 O\n0.631332 0.106356 0.631169 O\n0.140602 0.117041 0.140301 O\n0.867598 0.397073 0.867630 O\n0.911999 0.381092 0.353405 O\n0.640636 0.617054 0.640257 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Cr",
"Co",
"O"
],
"chemical_system": "Co-Cr-Li-O",
"density": 4.748957552425443,
"density_atomic": 0.10801558143481675,
"volume": 259.22186066180575,
"volume_molar": 5.5752519034803605,
"formula_full": "Li4 Cr2 Co6 O16",
"formula_reduced": "Li2CrCo3O8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.997266292857143,
"spacegroup": 160
},
{
"id": "jvasp-112125",
"created_at": "2022-09-04T14:38:41.706789Z",
"updated_at": "2022-09-04T14:38:41.706806Z",
"structure_string": "H16 Pb2 C12 O8\n1.0\n4.290578 0.114077 0.391140\n1.446163 7.646215 1.750649\n0.032281 0.035410 10.787550\nH Pb C O\n16 2 12 8\ndirect\n0.321520 0.834320 0.316276 H\n0.872302 0.124590 0.698588 H\n0.873023 0.625132 0.698322 H\n0.782904 0.357293 0.658893 H\n0.781968 0.857813 0.658889 H\n0.298057 0.855420 0.548529 H\n0.370029 0.124008 0.592088 H\n0.370500 0.623768 0.592178 H\n0.298382 0.355656 0.548507 H\n0.824043 0.835747 0.422403 H\n0.896201 0.103860 0.466085 H\n0.896548 0.604095 0.466063 H\n0.411679 0.102180 0.355720 H\n0.412657 0.601641 0.355723 H\n0.322244 0.334883 0.316003 H\n0.824506 0.335508 0.422495 H\n0.098076 0.479679 0.007217 Pb\n0.096540 0.979824 0.007386 Pb\n0.676387 0.240344 0.680367 C\n0.468849 0.248215 0.801056 C\n0.469345 0.747647 0.801203 C\n0.489065 0.236419 0.567173 C\n0.489093 0.736346 0.567194 C\n0.676406 0.740533 0.680322 C\n0.725229 0.711833 0.213396 C\n0.705484 0.723156 0.447397 C\n0.518173 0.219137 0.334231 C\n0.518173 0.718938 0.334277 C\n0.725717 0.211252 0.213546 C\n0.705496 0.223087 0.447418 C\n0.555909 0.632964 0.903793 O\n0.981644 0.595866 0.215282 O\n0.981318 0.094639 0.215810 O\n0.638657 0.826504 0.110803 O\n0.640342 0.325777 0.110761 O\n0.212951 0.863628 0.799321 O\n0.213243 0.364823 0.798806 O\n0.554245 0.133678 0.903833 O\n",
"nsites": 38,
"nelements": 4,
"elements": [
"H",
"Pb",
"C",
"O"
],
"chemical_system": "C-H-O-Pb",
"density": 3.316710041730934,
"density_atomic": 0.10801959848152166,
"volume": 351.7880137880762,
"volume_molar": 5.575044570296358,
"formula_full": "H16 Pb2 C12 O8",
"formula_reduced": "H8Pb(C3O2)2",
"formula_anonymous": "AB4C6D8",
"energy_above_hull": 4.394882885263158,
"spacegroup": 2
},
{
"id": "jvasp-44518",
"created_at": "2022-09-04T14:37:15.954640Z",
"updated_at": "2022-09-04T14:37:15.954665Z",
"structure_string": "Li5 Nb2 Fe5 O12\n1.0\n5.036491 -0.017115 0.011216\n-2.481048 -4.525033 -0.014256\n-1.936933 0.041881 -9.735011\nLi Nb Fe O\n5 2 5 12\ndirect\n0.684148 0.855872 0.492311 Li\n0.813625 0.137046 0.011345 Li\n0.157268 0.845568 0.001959 Li\n0.303322 0.121366 0.493687 Li\n0.933902 0.845351 0.252858 Li\n0.267368 0.501032 0.247751 Nb\n0.742296 0.465304 0.745765 Nb\n0.446800 0.879782 0.749843 Fe\n0.004749 0.503671 0.492523 Fe\n0.587467 0.184396 0.247333 Fe\n0.049427 0.173737 0.752332 Fe\n0.494057 0.493171 0.025013 Fe\n0.031542 0.803688 0.622848 O\n0.180973 0.148684 0.128501 O\n0.984003 0.195023 0.378314 O\n0.360061 0.493896 0.626406 O\n0.126546 0.503808 0.878399 O\n0.541380 0.840165 0.132088 O\n0.286114 0.811734 0.374980 O\n0.705439 0.179733 0.599184 O\n0.468357 0.181970 0.879175 O\n0.891210 0.504529 0.127991 O\n0.650132 0.513838 0.374341 O\n0.789818 0.816642 0.865051 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Nb",
"Fe",
"O"
],
"chemical_system": "Fe-Li-Nb-O",
"density": 5.169921496673629,
"density_atomic": 0.10802045214576869,
"volume": 222.18014758550623,
"volume_molar": 5.5750005118228865,
"formula_full": "Li5 Nb2 Fe5 O12",
"formula_reduced": "Li5Nb2Fe5O12",
"formula_anonymous": "A2B5C5D12",
"energy_above_hull": 3.1396682625,
"spacegroup": 1
}
]
}