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=20",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density_atomic&page=18",
"results": [
{
"id": "jvasp-101833",
"created_at": "2022-09-04T14:36:39.661949Z",
"updated_at": "2022-09-04T14:36:39.661960Z",
"structure_string": "H8 C4 O4\n1.0\n3.823251 0.000329 -0.141544\n-0.093976 4.567683 -0.050676\n0.064895 0.001082 6.728326\nH C O\n8 4 4\ndirect\n0.399239 0.087801 0.831233 H\n0.399240 0.587801 0.831234 H\n0.811125 0.097302 0.968489 H\n0.811128 0.597302 0.968489 H\n0.899237 0.087792 0.331230 H\n0.899238 0.587792 0.331230 H\n0.311120 0.097293 0.468489 H\n0.311121 0.597292 0.468489 H\n0.686405 0.092587 0.818532 C\n0.686406 0.592587 0.818532 C\n0.186405 0.092578 0.318531 C\n0.186403 0.592578 0.318532 C\n0.794692 0.842627 0.710109 O\n0.294695 0.842619 0.210109 O\n0.794692 0.342627 0.710109 O\n0.294695 0.342618 0.210110 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"H",
"C",
"O"
],
"chemical_system": "C-H-O",
"density": 1.6967343249758453,
"density_atomic": 0.13612175776922836,
"volume": 117.5418262459211,
"volume_molar": 4.4240838927524955,
"formula_full": "H8 C4 O4",
"formula_reduced": "H2CO",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.284635875,
"spacegroup": 38
},
{
"id": "jvasp-112126",
"created_at": "2022-09-04T14:38:43.185858Z",
"updated_at": "2022-09-04T14:38:43.185874Z",
"structure_string": "H42 C22\n1.0\n6.025892 0.018949 0.253556\n2.905188 7.468771 0.507995\n-0.004236 -0.145276 10.463966\nH C\n42 22\ndirect\n0.539880 0.214857 0.486691 H\n0.228434 0.117528 0.616396 H\n0.621915 0.533161 0.318916 H\n0.378084 0.466838 0.681085 H\n0.366119 0.720087 0.275935 H\n0.633881 0.279912 0.724066 H\n0.567223 0.596359 0.155363 H\n0.432777 0.403641 0.844637 H\n0.017667 0.499844 0.120775 H\n0.771565 0.882472 0.383605 H\n0.227631 0.582527 0.041818 H\n0.040522 0.702085 0.167539 H\n0.959478 0.297914 0.832462 H\n0.098872 0.368734 0.362341 H\n0.901128 0.631265 0.637660 H\n0.040504 0.601315 0.372202 H\n0.959495 0.398685 0.627799 H\n0.289854 0.443227 0.448295 H\n0.710146 0.556772 0.551705 H\n0.772369 0.417473 0.958182 H\n0.538049 0.001440 0.641105 H\n0.982333 0.500156 0.879226 H\n0.346997 0.105218 0.770330 H\n0.461950 -0.001440 0.358896 H\n0.460120 0.785143 0.513309 H\n0.713561 0.340963 0.428490 H\n0.286439 0.659036 0.571510 H\n0.852308 0.112762 0.472258 H\n0.147692 0.887237 0.527743 H\n0.684808 0.687996 0.973480 H\n0.743078 0.956069 0.060230 H\n0.256921 0.043930 0.939771 H\n0.315191 0.312004 0.026521 H\n0.653002 0.894781 0.229671 H\n0.352615 0.911522 0.079718 H\n0.949386 0.062785 0.131132 H\n0.050614 0.937215 0.868869 H\n0.072502 0.019667 0.286232 H\n0.927498 0.980333 0.713769 H\n0.965156 0.240690 0.217654 H\n0.034844 0.759309 0.782347 H\n0.647385 0.088478 0.920282 H\n0.640563 0.970036 0.315505 C\n0.359437 0.029964 0.684495 C\n0.329020 0.467640 0.237015 C\n0.670980 0.532360 0.762985 C\n0.856244 0.433074 0.865328 C\n0.518271 0.415382 0.751657 C\n0.143755 0.566926 0.134672 C\n0.068827 0.884813 0.772935 C\n0.481728 0.584618 0.248344 C\n0.931173 0.115187 0.227065 C\n0.694114 0.211213 0.426463 C\n0.584281 0.049979 0.013469 C\n0.542307 0.780744 0.915615 C\n0.457693 0.219256 0.084385 C\n0.512121 0.725452 0.800068 C\n0.487879 0.274548 0.199932 C\n0.316754 0.852171 0.709533 C\n0.683246 0.147829 0.290467 C\n0.305886 0.788786 0.573538 C\n0.182983 0.469126 0.362745 C\n0.415719 0.950021 0.986531 C\n0.817017 0.530873 0.637255 C\n",
"nsites": 64,
"nelements": 2,
"elements": [
"H",
"C"
],
"chemical_system": "C-H",
"density": 1.081490861114441,
"density_atomic": 0.13596454170634384,
"volume": 470.7109603489649,
"volume_molar": 4.429199469525383,
"formula_full": "H42 C22",
"formula_reduced": "H21C11",
"formula_anonymous": "A11B21",
"energy_above_hull": 4.8471503125,
"spacegroup": 2
},
{
"id": "jvasp-56195",
"created_at": "2022-09-04T14:37:28.503454Z",
"updated_at": "2022-09-04T14:37:28.503474Z",
"structure_string": "Fe1 B2\n1.0\n1.500139 -2.598316 -0.000000\n1.500139 2.598316 0.000000\n-0.000000 0.000000 2.830645\nFe B\n1 2\ndirect\n0.000000 0.000000 0.000000 Fe\n0.333333 0.666668 0.500001 B\n0.666668 0.333333 0.500001 B\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Fe",
"B"
],
"chemical_system": "B-Fe",
"density": 5.829441702984711,
"density_atomic": 0.1359509926796694,
"volume": 22.066775246493883,
"volume_molar": 4.429640888455662,
"formula_full": "Fe1 B2",
"formula_reduced": "FeB2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.654450222222223,
"spacegroup": 191
},
{
"id": "jvasp-9090",
"created_at": "2022-09-04T14:37:00.272167Z",
"updated_at": "2022-09-04T14:37:00.272201Z",
"structure_string": "B12 O2\n1.0\n4.588541 -0.004789 2.326002\n1.426639 4.361127 2.326002\n-0.006613 -0.004789 5.144409\nB O\n12 2\ndirect\n0.798668 0.323572 0.798667 B\n0.798668 0.798668 0.323572 B\n0.323573 0.798668 0.798667 B\n0.676428 0.201332 0.201332 B\n0.201333 0.676428 0.201332 B\n0.201333 0.201332 0.676427 B\n0.997540 0.666698 0.997538 B\n0.997539 0.997539 0.666698 B\n0.666699 0.997539 0.997538 B\n0.333301 0.002461 0.002461 B\n0.002461 0.333302 0.002461 B\n0.002461 0.002461 0.333301 B\n0.377759 0.377759 0.377758 O\n0.622242 0.622242 0.622241 O\n",
"nsites": 14,
"nelements": 2,
"elements": [
"B",
"O"
],
"chemical_system": "B-O",
"density": 2.6052728232737294,
"density_atomic": 0.13581239647321633,
"volume": 103.08337356200728,
"volume_molar": 4.434161325757646,
"formula_full": "B12 O2",
"formula_reduced": "B6O",
"formula_anonymous": "AB6",
"energy_above_hull": 4.663505571428572,
"spacegroup": 166
},
{
"id": "jvasp-29840",
"created_at": "2022-09-04T14:38:01.028600Z",
"updated_at": "2022-09-04T14:38:01.028631Z",
"structure_string": "Al2 H6 O6\n1.0\n5.119133 0.120781 -0.010103\n-2.454968 4.252128 0.020206\n-0.008994 0.015579 4.674549\nAl H O\n2 6 6\ndirect\n0.325978 0.683803 0.001824 Al\n0.674021 0.357825 0.001824 Al\n0.779998 0.967601 0.722148 H\n0.220003 0.187602 0.722147 H\n0.000000 0.603593 0.580594 H\n0.446988 0.019171 0.415886 H\n0.553012 0.572184 0.415887 H\n0.000000 0.179002 0.246834 H\n0.618187 0.012941 0.766037 O\n0.381814 0.394755 0.766037 O\n0.000001 0.671989 0.778928 O\n0.370699 0.023644 0.221592 O\n0.629301 0.652945 0.221592 O\n0.000000 0.377681 0.217949 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 2.5117816811428058,
"density_atomic": 0.13574267870929058,
"volume": 103.13631742882207,
"volume_molar": 4.436438721602912,
"formula_full": "Al2 H6 O6",
"formula_reduced": "Al(HO)3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 2.449410471428572,
"spacegroup": 8
},
{
"id": "jvasp-29843",
"created_at": "2022-09-04T14:37:07.931459Z",
"updated_at": "2022-09-04T14:37:07.931475Z",
"structure_string": "Al2 H6 O6\n1.0\n5.119305 -0.122094 -0.010031\n-2.663238 4.373584 -0.010455\n-0.009419 -0.015466 4.674709\nAl H O\n2 6 6\ndirect\n0.357802 0.682598 0.981172 Al\n0.683785 0.356618 0.981166 Al\n0.572161 0.017954 0.567086 H\n0.178919 0.177759 0.736252 H\n0.019130 0.570938 0.567088 H\n0.187657 0.966429 0.260902 H\n0.603771 0.602565 0.402421 H\n0.967641 0.186445 0.260844 H\n0.652879 0.022413 0.761398 O\n0.377609 0.376431 0.765121 O\n0.023594 0.651683 0.761385 O\n0.394777 0.011746 0.216954 O\n0.672043 0.670849 0.204059 O\n0.012951 0.393583 0.216966 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 2.5116028444385177,
"density_atomic": 0.13573301394683376,
"volume": 103.14366116915197,
"volume_molar": 4.436754614731281,
"formula_full": "Al2 H6 O6",
"formula_reduced": "Al(HO)3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 2.449407614285714,
"spacegroup": 8
},
{
"id": "jvasp-96964",
"created_at": "2022-09-04T14:36:44.340195Z",
"updated_at": "2022-09-04T14:36:44.340215Z",
"structure_string": "Al8 H24 O24\n1.0\n8.764797 0.083939 -0.149935\n0.052043 5.036616 0.099372\n-0.176024 0.251858 9.361865\nAl H O\n8 24 24\ndirect\n0.388800 0.944142 0.492067 Al\n0.715571 0.038361 0.495117 Al\n0.877611 0.506376 0.497059 Al\n0.216959 0.454352 0.495863 Al\n0.769882 0.069963 0.003626 Al\n0.119381 0.016661 0.006520 Al\n0.282206 0.505872 -0.001683 Al\n0.612596 0.569166 0.995567 Al\n0.493546 0.205325 0.106083 H\n0.410754 0.880787 0.876648 H\n0.594452 0.210912 0.793422 H\n0.369438 0.878108 0.131624 H\n0.260267 0.185734 0.785771 H\n0.747062 0.360175 0.223547 H\n0.094852 0.716829 0.802707 H\n-0.091128 0.668645 0.109885 H\n0.605421 0.872530 0.211441 H\n0.217999 0.259016 0.212999 H\n0.913160 0.864967 0.242833 H\n0.767187 0.755004 0.793686 H\n0.648601 0.619871 0.627068 H\n0.957644 0.381826 0.916416 H\n0.034737 0.360545 0.289533 H\n0.600039 0.651063 0.387623 H\n0.505327 0.306893 0.596706 H\n0.139890 0.024162 0.607513 H\n0.052362 0.444436 0.693469 H\n0.396504 0.626286 0.707413 H\n0.873352 0.169673 0.718047 H\n0.230245 0.779401 0.288874 H\n0.426754 0.345114 0.318113 H\n0.974517 0.960030 0.418042 H\n0.111777 0.702613 0.907586 O\n0.950127 0.187370 0.911760 O\n0.768204 0.373967 0.114692 O\n0.757725 0.766671 0.899002 O\n0.153559 0.302049 0.125005 O\n0.267195 0.806435 0.116311 O\n0.638305 0.273860 0.883561 O\n0.429974 0.687257 0.883380 O\n0.460587 0.393784 0.105347 O\n0.934570 0.857365 0.129855 O\n0.746044 0.707828 0.614440 O\n0.884080 0.854542 0.393227 O\n0.231844 0.775345 0.395025 O\n0.867336 0.187661 0.613247 O\n0.389727 0.610635 0.601280 O\n0.720650 0.359551 0.391403 O\n0.235472 0.122802 0.608433 O\n0.540350 0.117940 0.605248 O\n0.564297 0.844080 0.385234 O\n0.037765 0.354005 0.394415 O\n0.063253 0.587909 0.620683 O\n0.263376 0.199079 0.892117 O\n0.347702 0.261897 0.376009 O\n0.611392 0.885729 0.104504 O\n",
"nsites": 56,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 2.509732368295918,
"density_atomic": 0.13563192895048853,
"volume": 412.88213205640096,
"volume_molar": 4.4400612795224195,
"formula_full": "Al8 H24 O24",
"formula_reduced": "Al(HO)3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 2.452259042857144,
"spacegroup": 1
},
{
"id": "jvasp-29489",
"created_at": "2022-09-04T14:38:06.714849Z",
"updated_at": "2022-09-04T14:38:06.714877Z",
"structure_string": "Al8 H24 O24\n1.0\n5.075468 0.000000 -0.027961\n0.000000 8.726173 0.000000\n-0.009479 0.000000 9.323782\nAl H O\n8 24 24\ndirect\n0.463619 0.832864 0.503582 Al\n0.029212 0.334991 0.496389 Al\n0.963619 0.667136 0.003583 Al\n0.529212 0.165009 0.996389 Al\n0.036381 0.332864 0.996417 Al\n0.970788 0.665009 0.503611 Al\n0.470788 0.834990 0.003611 Al\n0.536381 0.167136 0.496418 Al\n0.825726 0.204360 0.710052 H\n0.355928 0.598092 0.153338 H\n0.046042 0.505530 0.289396 H\n0.546042 0.994469 0.789396 H\n0.455752 0.419053 0.615151 H\n0.544248 0.580947 0.384849 H\n0.325726 0.295640 0.210052 H\n0.644072 0.401908 0.846662 H\n0.674274 0.704360 0.789948 H\n0.453958 0.005531 0.210604 H\n0.812669 0.958464 0.371010 H\n0.735735 0.765943 0.215647 H\n0.955753 0.080947 0.115151 H\n0.855928 0.901908 0.653338 H\n0.235734 0.734056 0.715647 H\n0.687331 0.458465 0.128990 H\n0.144072 0.098092 0.346662 H\n0.264265 0.234056 0.784353 H\n0.044247 0.919052 0.884848 H\n0.312669 0.541535 0.871010 H\n0.174274 0.795640 0.289948 H\n0.764266 0.265944 0.284353 H\n0.187331 0.041535 0.628990 H\n0.953958 0.494469 0.710604 H\n0.142026 0.827290 0.390556 O\n0.354098 0.323773 0.603988 O\n0.371881 0.012381 0.611861 O\n0.857974 0.172709 0.609444 O\n0.642026 0.672709 0.890556 O\n0.275150 0.696033 0.618223 O\n0.775371 0.807575 0.618094 O\n0.724850 0.303967 0.381777 O\n0.724629 0.307575 0.881906 O\n0.645903 0.676226 0.396012 O\n0.128119 0.512381 0.888139 O\n0.127459 0.510351 0.386220 O\n0.871881 0.487618 0.111861 O\n0.224850 0.196033 0.881777 O\n0.224629 0.192425 0.381906 O\n0.775150 0.803966 0.118223 O\n0.275371 0.692425 0.118094 O\n0.627459 0.989648 0.886220 O\n0.372541 0.010352 0.113779 O\n0.628119 0.987618 0.388139 O\n0.145902 0.823773 0.896012 O\n0.872541 0.489648 0.613779 O\n0.854098 0.176226 0.103988 O\n0.357974 0.327291 0.109444 O\n",
"nsites": 56,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 2.509365422944332,
"density_atomic": 0.1356120983476387,
"volume": 412.9425079497347,
"volume_molar": 4.44071055117986,
"formula_full": "Al8 H24 O24",
"formula_reduced": "Al(HO)3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 2.4483790428571437,
"spacegroup": 14
},
{
"id": "jvasp-91628",
"created_at": "2022-09-04T14:35:44.574093Z",
"updated_at": "2022-09-04T14:35:44.574120Z",
"structure_string": "Mg1 Si1 H2 O4\n1.0\n0.000000 0.000000 -2.852760\n0.233299 -4.320768 0.000000\n-4.787290 -0.013451 0.000000\nMg Si H O\n1 1 2 4\ndirect\n0.500000 0.498522 0.526147 Mg\n0.000000 0.999211 0.995777 Si\n0.000000 0.023561 0.479971 H\n0.500000 0.538391 0.031954 H\n0.000000 0.771118 0.693564 O\n0.500000 0.751438 0.144432 O\n0.000000 0.199858 0.338853 O\n0.500000 0.226403 0.889501 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Mg",
"Si",
"H",
"O"
],
"chemical_system": "H-Mg-O-Si",
"density": 3.3314522687642767,
"density_atomic": 0.1355527035807613,
"volume": 59.017635123991894,
"volume_molar": 4.442656325487491,
"formula_full": "Mg1 Si1 H2 O4",
"formula_reduced": "MgSi(HO2)2",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.21443895625,
"spacegroup": 6
},
{
"id": "jvasp-104151",
"created_at": "2022-09-04T14:36:49.170686Z",
"updated_at": "2022-09-04T14:36:49.170712Z",
"structure_string": "H12 C6 O2\n1.0\n4.384654 -0.106124 -1.061813\n-1.988179 4.043526 -0.402143\n0.026650 0.138323 8.388412\nH C O\n12 6 2\ndirect\n0.062371 0.217219 0.095272 H\n0.381145 0.464635 0.664199 H\n0.067968 0.489444 0.851111 H\n0.889409 0.734203 0.924614 H\n0.372880 0.217045 0.924643 H\n0.562359 0.216716 0.595237 H\n0.545856 0.966982 0.850825 H\n0.567988 0.490020 0.351141 H\n0.045819 0.967555 0.350882 H\n0.389356 0.734693 0.424651 H\n0.872884 0.217700 0.424669 H\n0.881163 0.465179 0.164208 H\n0.886587 0.092951 0.309911 C\n0.400382 0.606961 0.309980 C\n0.044473 0.345426 0.206582 C\n0.386605 0.092367 0.809871 C\n0.900389 0.606415 0.809946 C\n0.544468 0.344891 0.706558 C\n0.548145 0.847989 0.212874 O\n0.048170 0.847401 0.712826 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"H",
"C",
"O"
],
"chemical_system": "C-H-O",
"density": 1.3067794987167058,
"density_atomic": 0.13549804777195068,
"volume": 147.6036026265183,
"volume_molar": 4.4444483584999945,
"formula_full": "H12 C6 O2",
"formula_reduced": "H6C3O",
"formula_anonymous": "AB3C6",
"energy_above_hull": 4.280253350000001,
"spacegroup": 8
},
{
"id": "jvasp-29414",
"created_at": "2022-09-04T14:37:56.689127Z",
"updated_at": "2022-09-04T14:37:56.689158Z",
"structure_string": "Al4 H12 O12\n1.0\n4.975421 -0.133538 0.616251\n0.625833 5.209154 0.822584\n-0.363454 0.021729 7.907272\nAl H O\n4 12 12\ndirect\n0.026087 0.653493 0.330364 Al\n0.524870 0.827349 0.162930 Al\n0.973913 0.346506 0.669635 Al\n0.475130 0.172650 0.837069 Al\n0.791832 0.426806 0.135914 H\n0.569987 0.256950 0.528149 H\n0.787772 0.111555 0.300583 H\n0.784432 0.828709 0.588772 H\n0.430013 0.743049 0.471850 H\n0.208168 0.573192 0.864085 H\n0.212228 0.888444 0.699416 H\n0.215568 0.171290 0.411227 H\n0.132688 0.116077 0.085936 H\n0.300265 0.453115 0.113606 H\n0.867313 0.883922 0.914064 H\n0.699735 0.546884 0.886394 H\n0.325677 0.141716 0.070572 O\n0.174550 0.031859 0.764948 O\n0.825450 0.968140 0.235051 O\n0.757395 0.362740 0.879481 O\n0.320252 0.835432 0.379717 O\n0.742731 0.515404 0.235893 O\n0.833714 0.662084 0.547213 O\n0.166286 0.337915 0.452786 O\n0.679748 0.164567 0.620282 O\n0.674323 0.858283 0.929428 O\n0.242605 0.637259 0.120518 O\n0.257270 0.484595 0.764106 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 2.506278994572175,
"density_atomic": 0.13544530038982802,
"volume": 206.7255188582594,
"volume_molar": 4.446179190173116,
"formula_full": "Al4 H12 O12",
"formula_reduced": "Al(HO)3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 2.449216185714286,
"spacegroup": 2
},
{
"id": "jvasp-19590",
"created_at": "2022-09-04T14:38:01.446864Z",
"updated_at": "2022-09-04T14:38:01.446892Z",
"structure_string": "Mn1 B4\n1.0\n2.728529 0.005992 1.131230\n1.552735 3.519585 0.092512\n0.003448 0.014736 3.847960\nMn B\n1 4\ndirect\n0.000000 0.000000 0.000000 Mn\n0.797266 0.862027 0.543439 B\n0.202736 0.456561 0.137974 B\n0.202735 0.137975 0.456560 B\n0.797266 0.543441 0.862025 B\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Mn",
"B"
],
"chemical_system": "B-Mn",
"density": 4.415219514294651,
"density_atomic": 0.1354070054793106,
"volume": 36.92571135666959,
"volume_molar": 4.447436629059896,
"formula_full": "Mn1 B4",
"formula_reduced": "MnB4",
"formula_anonymous": "AB4",
"energy_above_hull": 4.666387514942529,
"spacegroup": 71
}
]
}