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=-formula_anonymous&page=4353",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=4351",
"results": [
{
"id": "jvasp-98097",
"created_at": "2022-09-04T14:35:52.306447Z",
"updated_at": "2022-09-04T14:35:52.306479Z",
"structure_string": "Zr6 Al6 C10\n1.0\n3.353611 -0.000000 0.000000\n-1.676806 2.904313 -0.000000\n0.000000 -0.000000 27.728306\nZr Al C\n6 6 10\ndirect\n0.333332 0.666666 0.904508 Zr\n0.666666 0.333333 0.095062 Zr\n0.000000 0.000000 0.999784 Zr\n0.333332 0.666666 0.595062 Zr\n0.000000 0.000000 0.499784 Zr\n0.666666 0.333333 0.404508 Zr\n0.000000 0.000000 0.749787 Al\n0.333332 0.666666 0.322822 Al\n0.666666 0.333333 0.676754 Al\n0.666666 0.333333 0.822822 Al\n0.000000 0.000000 0.249787 Al\n0.333332 0.666666 0.176754 Al\n0.333332 0.666666 0.249788 C\n0.666666 0.333333 0.949821 C\n0.666666 0.333333 0.549747 C\n0.000000 0.000000 0.347683 C\n0.000000 0.000000 0.651894 C\n0.666666 0.333333 0.749789 C\n0.333332 0.666666 0.049747 C\n0.333332 0.666666 0.449821 C\n0.000000 0.000000 0.151894 C\n0.000000 0.000000 0.847683 C\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Zr",
"Al",
"C"
],
"chemical_system": "Al-C-Zr",
"density": 5.099204022864857,
"density_atomic": 0.0814597810481735,
"volume": 270.07192650063337,
"volume_molar": 7.392777985050857,
"formula_full": "Zr6 Al6 C10",
"formula_reduced": "Zr3Al3C5",
"formula_anonymous": "A3B3C5",
"energy_above_hull": 5.2359929,
"spacegroup": 194
},
{
"id": "jvasp-119229",
"created_at": "2022-09-04T14:38:44.126783Z",
"updated_at": "2022-09-04T14:38:44.126808Z",
"structure_string": "Ca6 Co6 N10\n1.0\n5.351411 0.003036 -1.394483\n-1.180982 6.241620 -2.170040\n-0.050933 0.010609 8.249708\nCa Co N\n6 6 10\ndirect\n0.813686 0.409470 0.610337 Ca\n0.186315 0.590531 0.389664 Ca\n0.658865 0.869401 0.872381 Ca\n0.341136 0.130600 0.127620 Ca\n0.659467 0.666362 0.199811 Ca\n0.340534 0.333639 0.800190 Ca\n0.896321 0.119304 0.288797 Co\n0.313674 0.054003 0.438766 Co\n0.103680 0.880697 0.711204 Co\n0.088035 0.679388 0.026299 Co\n0.911966 0.320613 0.973702 Co\n0.686327 0.945998 0.561235 Co\n0.231465 0.766505 0.882460 N\n0.935519 0.111885 0.777215 N\n0.064482 0.888116 0.222786 N\n0.822778 0.696564 0.511275 N\n0.177223 0.303437 0.488726 N\n0.747475 0.534592 0.903011 N\n0.252526 0.465409 0.096990 N\n0.373480 0.949359 0.625719 N\n0.626521 0.050642 0.374282 N\n0.768536 0.233496 0.117541 N\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Ca",
"Co",
"N"
],
"chemical_system": "Ca-Co-N",
"density": 4.428436082782996,
"density_atomic": 0.07991872109981794,
"volume": 275.27968037078756,
"volume_molar": 7.535331743457689,
"formula_full": "Ca6 Co6 N10",
"formula_reduced": "Ca3Co3N5",
"formula_anonymous": "A3B3C5",
"energy_above_hull": 3.721544564545455,
"spacegroup": 2
},
{
"id": "jvasp-98060",
"created_at": "2022-09-04T14:36:16.312575Z",
"updated_at": "2022-09-04T14:36:16.312597Z",
"structure_string": "H20 N12 O12\n1.0\n5.540675 0.000000 0.000000\n0.000000 7.883562 -0.182753\n0.000000 0.138639 8.107022\nH N O\n20 12 12\ndirect\n0.572513 0.524081 0.187966 H\n0.481313 0.679627 0.739435 H\n0.427488 0.475919 0.812034 H\n0.701316 0.451773 0.365065 H\n0.981314 0.820373 0.760565 H\n0.792906 0.325999 0.038307 H\n0.298685 0.548227 0.634935 H\n0.972203 0.455309 0.146218 H\n0.518688 0.320373 0.260565 H\n0.798686 0.951773 0.865065 H\n0.072512 0.975918 0.312034 H\n0.527799 0.955309 0.646219 H\n0.292905 0.174001 0.461693 H\n0.207095 0.674001 0.961693 H\n0.027798 0.544691 0.853782 H\n0.707095 0.825999 0.538307 H\n0.201315 0.048227 0.134935 H\n0.018687 0.179627 0.239435 H\n0.472202 0.044691 0.353782 H\n0.927488 0.024081 0.687966 H\n0.646806 0.419120 0.245401 N\n0.844156 0.332957 0.631643 N\n0.655845 0.832957 0.131643 N\n0.646565 0.855291 0.654637 N\n0.146565 0.644708 0.845364 N\n0.146805 0.080880 0.254600 N\n0.155845 0.667043 0.368357 N\n0.853436 0.355291 0.154637 N\n0.344155 0.167043 0.868357 N\n0.853195 0.919120 0.745401 N\n0.353436 0.144708 0.345363 N\n0.353195 0.580880 0.754600 N\n0.372283 0.290865 0.967932 O\n0.234446 0.525490 0.420315 O\n0.895206 0.315800 0.783280 O\n0.627718 0.709135 0.032068 O\n0.765555 0.474510 0.579685 O\n0.104795 0.684199 0.216720 O\n0.265555 0.025490 0.920315 O\n0.395206 0.184200 0.716720 O\n0.604795 0.815800 0.283280 O\n0.127718 0.790864 0.467933 O\n0.872283 0.209135 0.532067 O\n0.734446 0.974510 0.079685 O\n",
"nsites": 44,
"nelements": 3,
"elements": [
"H",
"N",
"O"
],
"chemical_system": "H-N-O",
"density": 1.7822930469247957,
"density_atomic": 0.12420355539402825,
"volume": 354.25716969544607,
"volume_molar": 4.84860577532996,
"formula_full": "H20 N12 O12",
"formula_reduced": "H5(NO)3",
"formula_anonymous": "A3B3C5",
"energy_above_hull": 3.880674568181818,
"spacegroup": 14
},
{
"id": "jvasp-54838",
"created_at": "2022-09-04T14:37:43.846302Z",
"updated_at": "2022-09-04T14:37:43.846321Z",
"structure_string": "Sr6 Ga6 N10\n1.0\n5.992450 0.017825 -0.006112\n-0.667785 7.193823 0.006614\n-2.083257 -2.952078 7.952091\nSr Ga N\n6 6 10\ndirect\n0.668093 0.862946 0.873061 Sr\n0.331907 0.137054 0.126938 Sr\n0.183157 0.591191 0.392169 Sr\n0.655501 0.653893 0.201394 Sr\n0.344499 0.346107 0.798605 Sr\n0.816844 0.408809 0.607831 Sr\n0.124726 0.876828 0.716951 Ga\n0.875275 0.123172 0.283049 Ga\n0.908041 0.315486 0.972715 Ga\n0.289840 0.046712 0.432874 Ga\n0.710160 0.953288 0.567125 Ga\n0.091959 0.684514 0.027285 Ga\n0.234994 0.472106 0.095515 N\n0.611487 0.052113 0.380019 N\n0.739102 0.225063 0.107859 N\n0.042834 0.891003 0.223241 N\n0.159173 0.289943 0.474832 N\n0.957167 0.108997 0.776758 N\n0.260899 0.774937 0.892141 N\n0.388514 0.947886 0.619981 N\n0.765006 0.527894 0.904485 N\n0.840828 0.710057 0.525168 N\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Sr",
"Ga",
"N"
],
"chemical_system": "Ga-N-Sr",
"density": 5.249844526961092,
"density_atomic": 0.06415650038960631,
"volume": 342.9114722031209,
"volume_molar": 9.3866416083001,
"formula_full": "Sr6 Ga6 N10",
"formula_reduced": "Sr3Ga3N5",
"formula_anonymous": "A3B3C5",
"energy_above_hull": 2.436551105,
"spacegroup": 2
},
{
"id": "jvasp-51666",
"created_at": "2022-09-04T14:38:33.708423Z",
"updated_at": "2022-09-04T14:38:33.708451Z",
"structure_string": "Hf6 Al6 C10\n1.0\n1.664242 -2.882553 0.000000\n1.664242 2.882553 -0.000000\n0.000000 0.000000 27.524403\nHf Al C\n6 6 10\ndirect\n0.333332 0.666666 0.405939 Hf\n0.333332 0.666666 0.094060 Hf\n0.666666 0.333332 0.905939 Hf\n0.666666 0.333332 0.594060 Hf\n0.000000 0.000000 0.000000 Hf\n0.000000 0.000000 0.500000 Hf\n0.000000 0.000000 0.750000 Al\n0.333332 0.666666 0.823957 Al\n0.666666 0.333332 0.323957 Al\n0.333332 0.666666 0.676042 Al\n0.666666 0.333332 0.176042 Al\n0.000000 0.000000 0.250000 Al\n0.666666 0.333332 0.250000 C\n0.333332 0.666666 0.950552 C\n0.000000 0.000000 0.150423 C\n0.000000 0.000000 0.650423 C\n0.666666 0.333332 0.049448 C\n0.666666 0.333332 0.450552 C\n0.333332 0.666666 0.549448 C\n0.000000 0.000000 0.349577 C\n0.000000 0.000000 0.849576 C\n0.333332 0.666666 0.750000 C\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Hf",
"Al",
"C"
],
"chemical_system": "Al-C-Hf",
"density": 8.507162762856703,
"density_atomic": 0.08330690463008487,
"volume": 264.08375269359215,
"volume_molar": 7.228861505226551,
"formula_full": "Hf6 Al6 C10",
"formula_reduced": "Hf3Al3C5",
"formula_anonymous": "A3B3C5",
"energy_above_hull": 5.620704309090908,
"spacegroup": 194
},
{
"id": "jvasp-21456",
"created_at": "2022-09-04T14:38:31.916180Z",
"updated_at": "2022-09-04T14:38:31.916209Z",
"structure_string": "Li5 Ni3 N3\n1.0\n3.223132 -5.582630 -0.000000\n3.223132 5.582630 0.000000\n-0.000000 -0.000000 3.489092\nLi Ni N\n5 3 3\ndirect\n0.333333 0.666667 0.500000 Li\n0.666667 0.333333 0.500000 Li\n0.737333 0.737333 0.500000 Li\n0.262666 -0.000000 0.500000 Li\n-0.000000 0.262666 0.500000 Li\n0.365907 0.365907 0.000000 Ni\n-0.000000 0.634093 0.000000 Ni\n0.634093 -0.000000 0.000000 Ni\n0.364632 0.364632 0.500000 N\n0.635367 -0.000000 0.500000 N\n-0.000000 0.635367 0.500000 N\n",
"nsites": 11,
"nelements": 3,
"elements": [
"Li",
"Ni",
"N"
],
"chemical_system": "Li-N-Ni",
"density": 3.343304388069352,
"density_atomic": 0.08760589512554066,
"volume": 125.56232641920755,
"volume_molar": 6.874127307723042,
"formula_full": "Li5 Ni3 N3",
"formula_reduced": "Li5(NiN)3",
"formula_anonymous": "A3B3C5",
"energy_above_hull": 2.3813079045454546,
"spacegroup": 189
},
{
"id": "jvasp-112822",
"created_at": "2022-09-04T14:38:44.439691Z",
"updated_at": "2022-09-04T14:38:44.439735Z",
"structure_string": "Li3 Fe4 O3 F9\n1.0\n5.398554 0.034157 -0.985384\n-1.048382 5.484273 -0.845413\n0.136343 0.291554 6.660006\nLi Fe O F\n3 4 3 9\ndirect\n0.040885 0.005002 0.032243 Li\n0.820822 0.634150 0.343186 Li\n0.262988 0.590740 0.142613 Li\n0.745740 0.433461 0.840612 Fe\n0.165116 0.353395 0.612685 Fe\n0.596963 0.145836 0.365889 Fe\n0.393159 0.860298 0.661984 Fe\n0.474053 0.584697 0.765779 O\n0.807492 0.355486 0.568805 O\n0.339910 0.121760 0.512609 O\n0.894722 0.669724 0.076438 F\n0.628944 0.095822 0.868230 F\n0.099858 0.333955 0.909118 F\n0.886178 0.147608 0.242414 F\n0.177222 0.612596 0.421868 F\n0.091539 0.853987 0.766227 F\n0.518418 0.406493 0.231613 F\n0.674496 0.867458 0.485797 F\n0.381483 0.927528 0.151905 F\n",
"nsites": 19,
"nelements": 4,
"elements": [
"Li",
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-Li-O",
"density": 3.8497997056586235,
"density_atomic": 0.09510129639778726,
"volume": 199.7869715732085,
"volume_molar": 6.332343499094633,
"formula_full": "Li3 Fe4 O3 F9",
"formula_reduced": "Li3Fe4(OF3)3",
"formula_anonymous": "A3B3C4D9",
"energy_above_hull": 1.324409739078947,
"spacegroup": 1
},
{
"id": "jvasp-42448",
"created_at": "2022-09-04T14:37:29.861853Z",
"updated_at": "2022-09-04T14:37:29.861875Z",
"structure_string": "Li3 V4 O3 F9\n1.0\n5.024679 0.002891 0.004824\n-0.216949 5.407413 -0.022067\n-0.119666 -0.660757 7.547821\nLi V O F\n3 4 3 9\ndirect\n0.979554 0.599230 0.219826 Li\n0.513464 0.051120 0.196376 Li\n0.490915 0.930710 0.802865 Li\n0.991416 0.993431 0.501485 V\n0.514600 0.513051 0.496134 V\n0.501686 0.494962 0.992390 V\n0.005509 0.000886 0.994959 V\n0.705227 0.798738 0.054964 O\n0.318789 0.186633 0.959918 O\n0.800522 0.704693 0.446544 O\n0.196789 0.690766 0.917797 F\n0.848757 0.022981 0.750983 F\n0.817719 0.312863 0.088036 F\n0.676834 0.186379 0.416143 F\n0.631329 0.499179 0.746867 F\n0.348848 0.507972 0.248130 F\n0.321138 0.828163 0.581717 F\n0.186590 0.318495 0.554353 F\n0.148786 0.970458 0.251674 F\n",
"nsites": 19,
"nelements": 4,
"elements": [
"Li",
"V",
"O",
"F"
],
"chemical_system": "F-Li-O-V",
"density": 3.592788363541008,
"density_atomic": 0.09267683706658313,
"volume": 205.0134704786004,
"volume_molar": 6.4979998785170325,
"formula_full": "Li3 V4 O3 F9",
"formula_reduced": "Li3V4(OF3)3",
"formula_anonymous": "A3B3C4D9",
"energy_above_hull": 1.536992623289474,
"spacegroup": 1
},
{
"id": "jvasp-95246",
"created_at": "2022-09-04T14:35:51.436469Z",
"updated_at": "2022-09-04T14:35:51.436493Z",
"structure_string": "H24 C12 N16 O12\n1.0\n3.023778 3.552382 -1.818642\n-3.023778 3.552382 1.818642\n-0.196328 0.000000 24.836727\nH C N O\n24 12 16 12\ndirect\n0.739705 0.093877 0.501373 H\n0.070668 0.545670 0.200446 H\n0.545669 0.070668 0.299554 H\n0.929331 0.454330 0.799554 H\n0.454330 0.929331 0.700446 H\n0.176391 0.689674 0.135464 H\n0.689673 0.176392 0.364536 H\n0.823608 0.310326 0.864536 H\n0.310326 0.823608 0.635464 H\n0.595752 0.163562 0.202233 H\n0.404247 0.836437 0.797767 H\n0.836437 0.404247 0.702233 H\n0.163562 0.595752 0.297767 H\n0.468952 0.651270 0.379807 H\n0.348729 0.531048 0.879807 H\n0.531047 0.348730 0.620193 H\n0.722691 0.014134 0.042336 H\n0.014134 0.722691 0.457664 H\n0.277308 0.985866 0.957664 H\n0.985865 0.277308 0.542336 H\n0.906123 0.260294 0.001373 H\n0.260294 0.906123 0.498627 H\n0.093876 0.739705 0.998627 H\n0.651270 0.468952 0.120193 H\n0.151062 0.666720 0.705449 C\n0.333279 0.848937 0.205449 C\n0.848937 0.333280 0.294551 C\n0.666720 0.151063 0.794551 C\n0.061612 0.546580 0.374335 C\n0.546580 0.061613 0.125665 C\n0.938387 0.453419 0.625665 C\n0.804442 0.376364 0.062532 C\n0.376364 0.804443 0.437468 C\n0.195557 0.623636 0.937468 C\n0.623635 0.195557 0.562532 C\n0.453419 0.938387 0.874335 C\n0.186713 0.680016 0.178134 N\n0.680016 0.186713 0.321867 N\n0.813286 0.319983 0.821867 N\n0.319983 0.813286 0.678134 N\n0.484809 0.043981 0.176651 N\n0.515190 0.956019 0.823349 N\n0.956018 0.515191 0.676651 N\n0.043981 0.484809 0.323349 N\n0.303668 0.673391 0.393853 N\n0.326608 0.696331 0.893853 N\n0.696331 0.326608 0.606147 N\n0.802097 0.205928 0.032122 N\n0.205928 0.802097 0.467878 N\n0.197902 0.794072 0.967879 N\n0.794071 0.197903 0.532122 N\n0.673391 0.303668 0.106147 N\n0.660299 0.155626 0.742926 O\n0.155625 0.660300 0.757074 O\n0.498426 0.882031 0.101162 O\n0.882031 0.498426 0.398838 O\n0.501573 0.117969 0.898838 O\n0.080140 0.398047 0.944815 O\n0.919859 0.601953 0.055185 O\n0.601952 0.919859 0.444815 O\n0.398047 0.080140 0.555185 O\n0.844374 0.339700 0.242926 O\n0.117968 0.501573 0.601162 O\n0.339700 0.844374 0.257074 O\n",
"nsites": 64,
"nelements": 4,
"elements": [
"H",
"C",
"N",
"O"
],
"chemical_system": "C-H-N-O",
"density": 1.8274653658681372,
"density_atomic": 0.1205190596399378,
"volume": 531.036337249943,
"volume_molar": 4.996836830615606,
"formula_full": "H24 C12 N16 O12",
"formula_reduced": "H6C3N4O3",
"formula_anonymous": "A3B3C4D6",
"energy_above_hull": 4.75093646875,
"spacegroup": 15
},
{
"id": "jvasp-86052",
"created_at": "2022-09-04T14:36:01.107850Z",
"updated_at": "2022-09-04T14:36:01.107872Z",
"structure_string": "Y3 Ni4 B4 C3\n1.0\n3.544692 -0.000000 -0.487290\n-0.066987 3.544059 -0.487290\n-0.022881 -0.023318 12.969766\nY Ni B C\n3 4 4 3\ndirect\n0.700765 0.700766 0.401531 Y\n0.299234 0.299234 0.598469 Y\n0.000000 0.000000 0.000000 Y\n0.899491 0.399491 0.798983 Ni\n0.100508 0.600509 0.201017 Ni\n0.600508 0.100508 0.201017 Ni\n0.399491 0.899491 0.798983 Ni\n0.854970 0.854971 0.709942 B\n0.558507 0.558508 0.117015 B\n0.145029 0.145029 0.290059 B\n0.441492 0.441492 0.882985 B\n0.796579 0.796580 0.593159 C\n0.203420 0.203420 0.406841 C\n0.499999 0.500000 -0.000000 C\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Y",
"Ni",
"B",
"C"
],
"chemical_system": "B-C-Ni-Y",
"density": 5.921808943963063,
"density_atomic": 0.08596688920970517,
"volume": 162.85339772908148,
"volume_molar": 7.00518631691995,
"formula_full": "Y3 Ni4 B4 C3",
"formula_reduced": "Y3Ni4B4C3",
"formula_anonymous": "A3B3C4D4",
"energy_above_hull": 4.273060448809524,
"spacegroup": 139
},
{
"id": "jvasp-86651",
"created_at": "2022-09-04T14:36:09.247247Z",
"updated_at": "2022-09-04T14:36:09.247283Z",
"structure_string": "Y3 Ni4 B4 C3\n1.0\n3.544692 -0.000000 -0.487290\n-0.066987 3.544059 -0.487290\n-0.022881 -0.023318 12.969766\nY Ni B C\n3 4 4 3\ndirect\n0.700765 0.700766 0.401531 Y\n0.299234 0.299234 0.598469 Y\n0.000000 0.000000 0.000000 Y\n0.899491 0.399491 0.798983 Ni\n0.100508 0.600509 0.201017 Ni\n0.600508 0.100508 0.201017 Ni\n0.399491 0.899491 0.798983 Ni\n0.854970 0.854971 0.709942 B\n0.558507 0.558508 0.117015 B\n0.145029 0.145029 0.290059 B\n0.441492 0.441492 0.882985 B\n0.796579 0.796580 0.593159 C\n0.203420 0.203420 0.406841 C\n0.499999 0.500000 -0.000000 C\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Y",
"Ni",
"B",
"C"
],
"chemical_system": "B-C-Ni-Y",
"density": 5.921808943963063,
"density_atomic": 0.08596688920970517,
"volume": 162.85339772908148,
"volume_molar": 7.00518631691995,
"formula_full": "Y3 Ni4 B4 C3",
"formula_reduced": "Y3Ni4B4C3",
"formula_anonymous": "A3B3C4D4",
"energy_above_hull": 4.273060448809524,
"spacegroup": 139
},
{
"id": "jvasp-42423",
"created_at": "2022-09-04T14:36:12.636673Z",
"updated_at": "2022-09-04T14:36:12.636695Z",
"structure_string": "Li3 Fe3 O4 F4\n1.0\n0.000000 4.799137 -0.027131\n2.839401 0.000000 0.000000\n0.000000 -0.035897 -9.427323\nLi Fe O F\n3 3 4 4\ndirect\n0.019381 0.000000 0.141339 Li\n0.522477 0.000000 0.064232 Li\n0.060940 0.500000 0.525661 Li\n0.506859 0.000000 0.640801 Fe\n0.489614 0.500000 0.370112 Fe\n-0.004280 0.500000 0.840360 Fe\n0.783766 0.000000 0.778880 O\n0.686092 0.500000 0.537884 O\n0.271029 0.500000 0.704717 O\n0.288893 0.000000 0.450957 O\n0.778269 0.500000 0.030017 F\n0.728646 0.000000 0.279864 F\n0.212262 0.000000 0.946386 F\n0.281887 0.500000 0.188787 F\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-Li-O",
"density": 4.244215843273041,
"density_atomic": 0.10897839839737579,
"volume": 128.46582630945622,
"volume_molar": 5.525994920608976,
"formula_full": "Li3 Fe3 O4 F4",
"formula_reduced": "Li3Fe3(OF)4",
"formula_anonymous": "A3B3C4D4",
"energy_above_hull": 1.741590116428571,
"spacegroup": 6
}
]
}