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=-spacegroup&page=4530",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=4528",
"results": [
{
"id": "jvasp-29456",
"created_at": "2022-09-04T14:37:03.476757Z",
"updated_at": "2022-09-04T14:37:03.476783Z",
"structure_string": "Tl4 Te6 O14\n1.0\n6.488485 0.049583 -2.293399\n-3.090402 6.761455 -0.244791\n-0.082686 -0.012580 10.004134\nTl Te O\n4 6 14\ndirect\n0.879846 0.152685 0.827885 Tl\n0.295179 0.023367 0.571043 Tl\n0.120152 0.847314 0.172114 Tl\n0.704819 0.976632 0.428956 Tl\n0.485532 0.215923 0.983279 Te\n0.132725 0.352774 0.233066 Te\n0.263303 0.505988 0.660435 Te\n0.867274 0.647225 0.766933 Te\n0.514466 0.784076 0.016720 Te\n0.736696 0.494011 0.339564 Te\n0.761028 0.837693 0.960312 O\n0.939340 0.532305 0.623596 O\n0.443479 0.550567 0.306557 O\n0.894092 0.766872 0.367672 O\n0.660428 0.101970 0.123373 O\n0.681969 0.475542 0.130709 O\n0.556520 0.449432 0.693443 O\n0.818611 0.848481 0.673001 O\n0.339571 0.898029 0.876626 O\n0.181388 0.151518 0.326998 O\n0.105907 0.233127 0.632328 O\n0.060659 0.467694 0.376403 O\n0.318029 0.524457 0.869290 O\n0.238970 0.162305 0.039687 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Tl",
"Te",
"O"
],
"chemical_system": "O-Te-Tl",
"density": 6.834915883306285,
"density_atomic": 0.054664725596710734,
"volume": 439.0399794020757,
"volume_molar": 11.016502313445002,
"formula_full": "Tl4 Te6 O14",
"formula_reduced": "Tl2Te3O7",
"formula_anonymous": "A2B3C7",
"energy_above_hull": 1.773824416666667,
"spacegroup": 2
},
{
"id": "jvasp-103903",
"created_at": "2022-09-04T14:37:03.705258Z",
"updated_at": "2022-09-04T14:37:03.705278Z",
"structure_string": "Zn1 H4 C4 O4\n1.0\n3.692658 0.062373 0.152379\n1.070635 4.100915 0.780411\n0.010388 -0.060135 7.329476\nZn H C O\n1 4 4 4\ndirect\n0.839987 0.933781 0.284771 Zn\n0.982800 0.611490 0.672650 H\n0.158625 0.176205 0.737854 H\n0.521587 0.691603 0.831681 H\n0.697445 0.256322 0.896880 H\n0.465174 0.393447 0.526646 C\n0.234794 0.407711 0.702638 C\n0.445438 0.460090 0.866892 C\n0.215073 0.474332 0.042887 C\n0.405732 0.646557 0.399802 O\n0.709966 0.124698 0.513821 O\n0.274514 0.221254 0.169745 O\n0.970257 0.743087 0.055691 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Zn",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Zn",
"density": 2.7232573542322656,
"density_atomic": 0.11747660668538328,
"volume": 110.66032946300186,
"volume_molar": 5.12624677364748,
"formula_full": "Zn1 H4 C4 O4",
"formula_reduced": "ZnH4(CO)4",
"formula_anonymous": "AB4C4D4",
"energy_above_hull": 3.958581876923077,
"spacegroup": 2
},
{
"id": "jvasp-48571",
"created_at": "2022-09-04T14:37:03.802292Z",
"updated_at": "2022-09-04T14:37:03.802310Z",
"structure_string": "V4 O6 F4\n1.0\n4.714419 0.346381 -0.085430\n-0.295152 5.318037 0.115856\n-2.196674 -1.851403 5.936113\nV O F\n4 6 4\ndirect\n0.901334 0.298598 0.803628 V\n0.593818 0.232682 0.195581 V\n0.406183 0.767319 0.804419 V\n0.098667 0.701403 0.196372 V\n0.864403 0.369867 0.097293 O\n0.720150 0.866705 0.086583 O\n0.449811 0.519552 0.281179 O\n0.550191 0.480449 0.718821 O\n0.279851 0.133296 0.913417 O\n0.135598 0.630134 0.902707 O\n0.901189 0.241716 0.497728 F\n0.670594 0.967398 0.704498 F\n0.329408 0.032603 0.295502 F\n0.098813 0.758285 0.502272 F\n",
"nsites": 14,
"nelements": 3,
"elements": [
"V",
"O",
"F"
],
"chemical_system": "F-O-V",
"density": 4.178876719560674,
"density_atomic": 0.09376322976995742,
"volume": 149.31226275319418,
"volume_molar": 6.422710453527432,
"formula_full": "V4 O6 F4",
"formula_reduced": "V2O3F2",
"formula_anonymous": "A2B2C3",
"energy_above_hull": 2.165647066428572,
"spacegroup": 2
},
{
"id": "jvasp-58927",
"created_at": "2022-09-04T14:37:03.815612Z",
"updated_at": "2022-09-04T14:37:03.815626Z",
"structure_string": "Ge2 P4 O14\n1.0\n4.698623 -0.031301 0.011515\n-1.831059 6.542357 0.005245\n-0.367786 -0.318797 7.803299\nGe P O\n2 4 14\ndirect\n0.499999 0.500000 0.500000 Ge\n0.000000 0.000000 0.000000 Ge\n0.888353 0.254280 0.310476 P\n0.111645 0.745720 0.689524 P\n0.469232 0.858248 0.235783 P\n0.530767 0.141752 0.764217 P\n0.964882 0.236686 0.123160 O\n0.035116 0.763314 0.876840 O\n0.378953 0.667203 0.339554 O\n0.621046 0.332797 0.660446 O\n0.702438 0.405644 0.324007 O\n0.297560 0.594356 0.675994 O\n0.848909 0.709632 0.559231 O\n0.687249 0.032350 0.360014 O\n0.365542 0.165282 0.924291 O\n0.151089 0.290368 0.440770 O\n0.808476 0.072436 0.804424 O\n0.191522 0.927564 0.195576 O\n0.312749 0.967650 0.639987 O\n0.634457 0.834718 0.075710 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Ge",
"P",
"O"
],
"chemical_system": "Ge-O-P",
"density": 3.4197423753701854,
"density_atomic": 0.0835180969274829,
"volume": 239.46905803380076,
"volume_molar": 7.210581875720786,
"formula_full": "Ge2 P4 O14",
"formula_reduced": "GeP2O7",
"formula_anonymous": "AB2C7",
"energy_above_hull": 2.622853145,
"spacegroup": 2
},
{
"id": "jvasp-103976",
"created_at": "2022-09-04T14:37:03.877780Z",
"updated_at": "2022-09-04T14:37:03.877806Z",
"structure_string": "Cd1 H12 C8 O4\n1.0\n4.039981 -0.081997 -0.350977\n-0.866040 4.009591 0.038974\n-0.276020 0.092723 12.573411\nCd H C O\n1 12 8 4\ndirect\n0.100152 0.635724 0.176907 Cd\n0.704940 0.802351 0.545057 H\n0.187301 0.846526 0.936410 H\n0.614780 0.962891 0.904167 H\n0.948549 0.831818 0.743923 H\n0.365193 0.925842 0.705902 H\n0.835183 0.345680 0.647897 H\n0.124115 0.897686 0.507856 H\n0.076274 0.373895 0.845928 H\n0.495483 0.469130 0.808753 H\n0.585432 0.308510 0.449649 H\n0.012890 0.425014 0.417390 H\n0.251825 0.439713 0.609871 H\n0.500988 0.266644 0.022988 C\n0.395397 0.059915 0.921538 C\n0.282296 0.260877 0.825419 C\n0.159326 0.041114 0.725630 C\n0.918075 0.010645 0.528382 C\n0.804858 0.211574 0.432268 C\n0.699315 0.004821 0.330822 C\n0.041051 0.230414 0.628168 C\n0.326281 0.194023 0.102703 O\n0.439577 0.759090 0.329569 O\n0.874061 0.077429 0.251116 O\n0.760741 0.512360 0.024238 O\n",
"nsites": 25,
"nelements": 4,
"elements": [
"Cd",
"H",
"C",
"O"
],
"chemical_system": "C-Cd-H-O",
"density": 2.334775745777662,
"density_atomic": 0.12351430022084804,
"volume": 202.40571298464303,
"volume_molar": 4.875662776886721,
"formula_full": "Cd1 H12 C8 O4",
"formula_reduced": "CdH12(C2O)4",
"formula_anonymous": "AB4C8D12",
"energy_above_hull": 4.42212095,
"spacegroup": 2
},
{
"id": "jvasp-60687",
"created_at": "2022-09-04T14:37:03.959580Z",
"updated_at": "2022-09-04T14:37:03.959607Z",
"structure_string": "Ba1 Sb2 F12\n1.0\n4.833144 -0.977672 -0.827215\n-3.228962 5.703053 0.933293\n-1.774831 -0.588327 9.179899\nBa Sb F\n1 2 12\ndirect\n0.276616 0.087368 0.865214 Ba\n0.088268 0.489691 0.584407 Sb\n0.464792 0.684978 0.145996 Sb\n0.368362 0.916936 0.161199 F\n0.507735 0.628371 0.772692 F\n0.045452 0.546453 0.957670 F\n0.116680 0.400269 0.245785 F\n0.531239 0.463510 0.081440 F\n0.184687 0.257705 0.569236 F\n0.890270 0.847514 0.315785 F\n0.021859 0.711204 0.648941 F\n0.662646 0.327015 0.414669 F\n-0.207056 0.215213 0.717170 F\n0.436186 0.774249 0.484500 F\n0.760258 0.959518 0.013290 F\n",
"nsites": 15,
"nelements": 3,
"elements": [
"Ba",
"Sb",
"F"
],
"chemical_system": "Ba-F-Sb",
"density": 4.629446957721637,
"density_atomic": 0.06868735167380262,
"volume": 218.38081734807963,
"volume_molar": 8.767466809026569,
"formula_full": "Ba1 Sb2 F12",
"formula_reduced": "BaSb2F12",
"formula_anonymous": "AB2C12",
"energy_above_hull": 0.0,
"spacegroup": 2
},
{
"id": "jvasp-29466",
"created_at": "2022-09-04T14:37:03.978105Z",
"updated_at": "2022-09-04T14:37:03.978140Z",
"structure_string": "Pb6 S2 O12\n1.0\n5.848965 -0.045335 -0.089597\n-0.251021 7.066620 -1.576908\n-0.034725 -0.050795 8.135102\nPb S O\n6 2 12\ndirect\n0.741678 0.603160 0.411667 Pb\n0.251793 0.918590 0.624111 Pb\n0.230970 0.778130 0.150431 Pb\n0.769029 0.221871 0.849569 Pb\n0.258321 0.396841 0.588333 Pb\n0.748206 0.081412 0.375888 Pb\n0.271798 0.292617 0.139566 S\n0.728201 0.707385 0.860433 S\n0.766151 0.840482 0.025363 O\n0.007285 0.173423 0.623705 O\n0.233847 0.159520 0.974636 O\n0.492168 0.816530 0.377275 O\n0.500638 0.391568 0.149850 O\n0.499361 0.608434 0.850149 O\n0.907217 0.561835 0.831534 O\n0.992713 0.826578 0.376294 O\n0.744121 0.816723 0.722922 O\n0.092782 0.438166 0.168465 O\n0.255878 0.183279 0.277078 O\n0.507830 0.183471 0.622725 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Pb",
"S",
"O"
],
"chemical_system": "O-Pb-S",
"density": 7.417352319459651,
"density_atomic": 0.05958468683292874,
"volume": 335.656710860604,
"volume_molar": 10.10685979920589,
"formula_full": "Pb6 S2 O12",
"formula_reduced": "Pb3SO6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 1.905317346,
"spacegroup": 2
},
{
"id": "jvasp-13023",
"created_at": "2022-09-04T14:37:04.031694Z",
"updated_at": "2022-09-04T14:37:04.031739Z",
"structure_string": "Hf1 Te4 Cl6\n1.0\n6.718259 -0.347817 0.265088\n0.875103 6.655041 0.156764\n2.057536 1.461493 7.621205\nHf Te Cl\n1 4 6\ndirect\n0.000000 0.000000 0.000000 Hf\n0.413303 0.509121 0.289097 Te\n0.586698 0.490878 0.710902 Te\n0.681132 0.270209 0.452117 Te\n0.318868 0.729790 0.547883 Te\n0.019304 0.210010 0.697808 Cl\n-0.019304 0.789990 0.302191 Cl\n0.129949 0.281379 0.080068 Cl\n0.870051 0.718620 0.919932 Cl\n0.640450 0.119885 0.110701 Cl\n0.359550 0.880114 0.889298 Cl\n",
"nsites": 11,
"nelements": 3,
"elements": [
"Hf",
"Te",
"Cl"
],
"chemical_system": "Cl-Hf-Te",
"density": 4.427832122719309,
"density_atomic": 0.03253246548973407,
"volume": 338.1237737260078,
"volume_molar": 18.511172360730985,
"formula_full": "Hf1 Te4 Cl6",
"formula_reduced": "Hf(Te2Cl3)2",
"formula_anonymous": "AB4C6",
"energy_above_hull": 0.9794244065151516,
"spacegroup": 2
},
{
"id": "jvasp-101973",
"created_at": "2022-09-04T14:37:04.135164Z",
"updated_at": "2022-09-04T14:37:04.135182Z",
"structure_string": "Sn2 H16 C8 F4\n1.0\n4.269866 0.073776 -0.320759\n-1.738391 4.299468 -0.088712\n0.275159 -0.072247 14.189947\nSn H C F\n2 16 8 4\ndirect\n-0.031622 0.924752 0.949054 Sn\n0.715146 0.059081 0.471616 Sn\n0.602989 0.495672 0.828721 H\n0.013817 0.631011 0.789336 H\n0.522409 0.715813 0.682122 H\n0.564295 0.255535 0.306697 H\n0.005394 0.390390 0.332985 H\n0.567050 0.730823 0.254700 H\n0.999138 0.850576 0.287467 H\n0.554908 0.010933 0.767092 H\n0.080586 0.488130 0.591950 H\n0.161130 0.267980 0.738550 H\n0.128632 0.972862 0.653578 H\n0.678028 0.593401 0.087665 H\n0.119114 0.728257 0.113984 H\n0.684218 0.133177 0.133192 H\n0.116299 0.252967 0.165968 H\n0.669768 0.352832 0.631341 H\n0.809347 0.702554 0.810453 C\n0.697410 0.881704 0.735579 C\n0.775142 0.183994 0.327623 C\n0.880806 0.050394 0.160641 C\n0.986136 0.102096 0.685091 C\n0.874214 0.281261 0.610219 C\n0.908281 0.799800 0.093042 C\n0.802561 0.933379 0.260023 C\n0.547486 0.590711 0.471319 F\n0.136059 0.393132 0.949366 F\n0.493838 0.024219 0.947786 F\n0.189675 0.959588 0.472871 F\n",
"nsites": 30,
"nelements": 4,
"elements": [
"Sn",
"H",
"C",
"F"
],
"chemical_system": "C-F-H-Sn",
"density": 2.6911093221493,
"density_atomic": 0.11422866214796469,
"volume": 262.6311070783607,
"volume_molar": 5.272004982601735,
"formula_full": "Sn2 H16 C8 F4",
"formula_reduced": "SnH8(C2F)2",
"formula_anonymous": "AB2C4D8",
"energy_above_hull": 3.678734151,
"spacegroup": 2
},
{
"id": "jvasp-12729",
"created_at": "2022-09-04T14:37:04.380712Z",
"updated_at": "2022-09-04T14:37:04.380726Z",
"structure_string": "P12 Ru3\n1.0\n4.771449 -0.003701 -0.001346\n-1.316939 7.103738 0.006350\n-0.050181 -2.796897 7.080843\nP Ru\n12 3\ndirect\n0.599157 0.368311 0.900193 P\n0.400842 0.631688 0.099806 P\n0.177603 0.162118 0.785002 P\n0.822397 0.837881 0.214997 P\n0.272895 0.426653 0.450758 P\n0.727105 0.573346 0.549241 P\n0.660265 0.085858 0.437795 P\n0.339735 0.914142 0.562204 P\n0.205312 0.704085 0.876006 P\n0.794688 0.295914 0.123992 P\n0.390916 0.168392 0.231176 P\n0.609084 0.831607 0.768823 P\n0.000000 0.000000 0.000000 Ru\n0.941818 0.373753 0.671127 Ru\n0.058182 0.626247 0.328872 Ru\n",
"nsites": 15,
"nelements": 2,
"elements": [
"P",
"Ru"
],
"chemical_system": "P-Ru",
"density": 4.668551632253082,
"density_atomic": 0.062486762575828324,
"volume": 240.0508424771942,
"volume_molar": 9.637466419695006,
"formula_full": "P12 Ru3",
"formula_reduced": "P4Ru",
"formula_anonymous": "AB4",
"energy_above_hull": 3.4049865,
"spacegroup": 2
},
{
"id": "jvasp-33059",
"created_at": "2022-09-04T14:37:04.181954Z",
"updated_at": "2022-09-04T14:37:04.181962Z",
"structure_string": "Cu1 H6 N4 O4\n1.0\n4.359304 -0.045230 1.075831\n0.741699 5.364561 1.069456\n0.063508 -0.028976 5.975277\nCu H N O\n1 6 4 4\ndirect\n0.000000 0.000000 0.000000 Cu\n0.878161 0.222419 0.610758 H\n0.121839 0.777580 0.389243 H\n0.885334 0.435893 0.770923 H\n0.114666 0.564106 0.229079 H\n0.784903 0.707389 0.373591 H\n0.215097 0.292610 0.626410 H\n0.610117 0.191084 0.186282 N\n0.389881 0.808915 0.813720 N\n0.005620 0.732618 0.277237 N\n0.994380 0.267381 0.722764 N\n0.630756 0.745506 0.892184 O\n0.369243 0.254493 0.107817 O\n0.616684 0.254501 0.375774 O\n0.383315 0.745498 0.624228 O\n",
"nsites": 15,
"nelements": 4,
"elements": [
"Cu",
"H",
"N",
"O"
],
"chemical_system": "Cu-H-N-O",
"density": 2.2542242161297796,
"density_atomic": 0.10738895575673217,
"volume": 139.67916806994052,
"volume_molar": 5.607784075712528,
"formula_full": "Cu1 H6 N4 O4",
"formula_reduced": "CuH6(NO)4",
"formula_anonymous": "AB4C4D6",
"energy_above_hull": 3.72584783,
"spacegroup": 2
},
{
"id": "jvasp-31822",
"created_at": "2022-09-04T14:37:04.274298Z",
"updated_at": "2022-09-04T14:37:04.274317Z",
"structure_string": "Sb2 Kr6 F22\n1.0\n7.136516 -0.068229 3.511253\n-0.338832 7.952100 2.999912\n-0.065096 0.014342 8.976062\nSb Kr F\n2 6 22\ndirect\n0.292329 0.678139 0.780504 Sb\n0.707671 0.321861 0.219495 Sb\n0.807686 0.854689 0.712179 Kr\n0.192314 0.145311 0.287820 Kr\n0.227146 0.164517 0.778034 Kr\n0.772855 0.835483 0.221966 Kr\n0.693602 0.330389 0.726750 Kr\n0.306398 0.669610 0.273249 Kr\n0.128549 0.555215 0.260792 F\n0.871452 0.444785 0.739207 F\n0.774789 0.444895 0.330666 F\n0.225211 0.555105 0.669334 F\n0.484266 0.799669 0.312017 F\n0.515734 0.200331 0.687982 F\n0.669043 0.530523 0.063622 F\n0.024065 0.893130 0.148662 F\n0.036673 0.681651 0.939788 F\n0.632586 0.198304 0.113601 F\n0.367414 0.801696 0.886399 F\n0.448735 0.317630 0.380838 F\n0.551265 0.682369 0.619161 F\n0.261661 0.887625 0.619065 F\n0.738339 0.112374 0.380934 F\n0.674294 0.927796 0.915059 F\n0.325706 0.072204 0.084940 F\n0.946465 0.790710 0.504324 F\n0.053535 0.209289 0.495675 F\n0.975935 0.106870 0.851337 F\n0.963327 0.318348 0.060212 F\n0.330957 0.469477 0.936377 F\n",
"nsites": 30,
"nelements": 3,
"elements": [
"Sb",
"Kr",
"F"
],
"chemical_system": "F-Kr-Sb",
"density": 3.7856775266725387,
"density_atomic": 0.05874365930463531,
"volume": 510.69341534249264,
"volume_molar": 10.25155877465878,
"formula_full": "Sb2 Kr6 F22",
"formula_reduced": "SbKr3F11",
"formula_anonymous": "AB3C11",
"energy_above_hull": 0.0,
"spacegroup": 2
}
]
}