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&page=4609",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=4607",
"results": [
{
"id": "jvasp-12562",
"created_at": "2022-09-04T14:36:44.401080Z",
"updated_at": "2022-09-04T14:36:44.401097Z",
"structure_string": "Be2 Al2 H10\n1.0\n0.000000 4.668372 0.095578\n4.317052 0.000000 0.000000\n0.000000 -0.191792 -6.248914\nBe Al H\n2 2 10\ndirect\n-0.002693 0.230334 0.381185 Be\n0.002694 0.730334 0.618814 Be\n0.244215 0.990123 0.001025 Al\n0.755785 0.490123 -0.001026 Al\n0.124943 0.466218 0.516543 H\n0.875057 -0.033781 0.483456 H\n0.748180 0.338969 0.255942 H\n0.251820 0.838968 0.744057 H\n0.237901 0.144290 0.256934 H\n0.762099 0.644290 0.743065 H\n0.056688 0.681564 0.088779 H\n0.943312 0.181564 0.911220 H\n0.552841 0.796501 0.080504 H\n0.447159 0.296501 0.919496 H\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Be",
"Al",
"H"
],
"chemical_system": "Al-Be-H",
"density": 1.0827607818239051,
"density_atomic": 0.11123558360774814,
"volume": 125.85900613753626,
"volume_molar": 5.413861791956767,
"formula_full": "Be2 Al2 H10",
"formula_reduced": "BeAlH5",
"formula_anonymous": "ABC5",
"energy_above_hull": 2.655551271428572,
"spacegroup": 4
},
{
"id": "jvasp-101570",
"created_at": "2022-09-04T14:36:45.388936Z",
"updated_at": "2022-09-04T14:36:45.388968Z",
"structure_string": "K3 Ca1\n1.0\n6.227331 -0.000000 0.000000\n0.000000 6.227331 0.000000\n0.000000 0.000000 6.227331\nK Ca\n3 1\ndirect\n-0.000000 0.500000 0.500000 K\n0.500000 0.000000 0.500000 K\n0.500000 0.500000 -0.000000 K\n0.000000 0.000000 0.000000 Ca\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Ca"
],
"chemical_system": "Ca-K",
"density": 1.082114445107023,
"density_atomic": 0.01656357736081828,
"volume": 241.49372523004234,
"volume_molar": 36.35773014980196,
"formula_full": "K3 Ca1",
"formula_reduced": "K3Ca",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0006025,
"spacegroup": 221
},
{
"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-96867",
"created_at": "2022-09-04T14:36:21.721251Z",
"updated_at": "2022-09-04T14:36:21.721276Z",
"structure_string": "H32 C8 N4 Cl4\n1.0\n-7.119100 3.579325 4.915135\n7.119100 -3.579325 4.915135\n7.119100 3.579325 -4.915135\nH C N Cl\n32 8 4 4\ndirect\n0.927775 0.858791 0.786565 H\n0.112275 0.402091 0.769870 H\n0.632221 0.342405 0.230130 H\n0.867781 0.097909 0.710185 H\n0.387725 0.157595 0.289816 H\n0.887726 0.597910 0.230130 H\n0.367780 0.657595 0.769870 H\n0.132221 0.902091 0.289815 H\n0.612276 0.842405 0.710185 H\n0.819514 0.258144 0.332883 H\n0.680488 0.013369 0.438631 H\n0.574739 0.241856 0.561370 H\n0.074738 0.513369 0.332882 H\n0.180487 0.741856 0.667118 H\n0.319514 0.986632 0.561369 H\n0.425262 0.758144 0.438631 H\n0.925263 0.486632 0.667119 H\n0.516473 0.144561 0.091680 H\n0.052881 0.424793 0.908321 H\n0.072226 0.141210 0.213436 H\n0.427775 0.641210 0.068984 H\n0.572227 0.358790 0.931017 H\n0.753069 0.779896 0.532965 H\n0.246932 0.220104 0.467036 H\n0.746933 0.279896 0.026828 H\n0.253069 0.720104 0.973173 H\n0.016473 0.924793 0.371912 H\n0.483528 0.855440 0.908321 H\n0.947120 0.575208 0.091680 H\n0.447120 0.355440 0.371912 H\n0.983528 0.075207 0.628089 H\n0.552882 0.644561 0.628088 H\n0.832260 0.022066 0.600250 C\n0.078183 0.477934 0.810193 C\n0.667741 0.267990 0.189807 C\n0.421818 0.232010 0.399751 C\n0.578184 0.767990 0.600250 C\n0.332260 0.732010 0.810193 C\n0.167741 0.977934 0.399750 C\n0.921818 0.522067 0.189807 C\n0.780653 0.852773 0.633425 N\n0.219348 0.147227 0.366576 N\n0.280653 0.647227 0.927880 N\n0.719349 0.352773 0.072121 N\n0.712294 0.637472 0.349764 Cl\n0.212293 0.862529 0.074821 Cl\n0.787708 0.137471 0.925179 Cl\n0.287708 0.362529 0.650237 Cl\n",
"nsites": 48,
"nelements": 4,
"elements": [
"H",
"C",
"N",
"Cl"
],
"chemical_system": "C-Cl-H-N",
"density": 1.0811419843571397,
"density_atomic": 0.09581192549935583,
"volume": 500.98147751265805,
"volume_molar": 6.28537703277917,
"formula_full": "H32 C8 N4 Cl4",
"formula_reduced": "H8C2NCl",
"formula_anonymous": "ABC2D8",
"energy_above_hull": 3.8290106097916654,
"spacegroup": 72
},
{
"id": "jvasp-74930",
"created_at": "2022-09-04T14:35:41.134249Z",
"updated_at": "2022-09-04T14:35:41.134272Z",
"structure_string": "K2 Li1 Be1\n1.0\n-2.953147 2.953147 4.170415\n2.953147 -2.953147 4.170415\n2.953147 2.953147 -4.170415\nK Li Be\n2 1 1\ndirect\n0.000000 0.000000 0.000000 K\n0.499999 0.499999 0.000000 K\n0.250000 0.750000 0.500000 Li\n0.750000 0.250000 0.500000 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Li",
"Be"
],
"chemical_system": "Be-K-Li",
"density": 1.0746301469545338,
"density_atomic": 0.027494801898260906,
"volume": 145.4820447443561,
"volume_molar": 21.902833787578267,
"formula_full": "K2 Li1 Be1",
"formula_reduced": "K2LiBe",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.318105525,
"spacegroup": 225
},
{
"id": "jvasp-118841",
"created_at": "2022-09-04T14:38:48.798903Z",
"updated_at": "2022-09-04T14:38:48.798921Z",
"structure_string": "Ca1 As1 N1\n1.0\n6.477130 0.000000 0.000000\n0.000000 6.477130 0.000000\n0.000000 0.000000 4.762595\nCa As N\n1 1 1\ndirect\n0.337410 0.001557 0.000000 Ca\n-0.014593 -0.080751 0.000000 As\n0.003040 0.286904 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"As",
"N"
],
"chemical_system": "As-Ca-N",
"density": 1.0721391079901987,
"density_atomic": 0.015014551905253628,
"volume": 199.80616264347475,
"volume_molar": 40.10869453848196,
"formula_full": "Ca1 As1 N1",
"formula_reduced": "CaAsN",
"formula_anonymous": "ABC",
"energy_above_hull": 2.727428473333333,
"spacegroup": 6
},
{
"id": "jvasp-38192",
"created_at": "2022-09-04T14:37:58.626341Z",
"updated_at": "2022-09-04T14:37:58.626356Z",
"structure_string": "K4 Be4 H12\n1.0\n0.000000 6.739348 0.019420\n5.426285 0.000000 0.000000\n0.000000 -2.457220 -8.676073\nK Be H\n4 4 12\ndirect\n0.230248 0.249972 0.201101 K\n0.769753 0.749972 0.298899 K\n0.230248 0.250027 0.701100 K\n0.769752 0.750027 0.798899 K\n0.752623 0.250045 0.000493 Be\n0.247377 0.750045 0.499506 Be\n0.752623 0.249955 0.500493 Be\n0.247377 0.749954 0.999506 Be\n0.626225 0.249874 0.847847 H\n0.373775 0.749873 0.652152 H\n0.826336 0.026425 0.572358 H\n0.826539 0.473301 0.572515 H\n0.173461 0.526698 0.427485 H\n0.826336 0.473574 0.072358 H\n0.626225 0.250126 0.347847 H\n0.373775 0.750126 0.152153 H\n0.173664 0.526425 0.927642 H\n0.826539 0.026698 0.072515 H\n0.173665 0.973574 0.427642 H\n0.173461 0.973301 0.927485 H\n",
"nsites": 20,
"nelements": 3,
"elements": [
"K",
"Be",
"H"
],
"chemical_system": "Be-H-K",
"density": 1.0713523344547633,
"density_atomic": 0.06308714807401494,
"volume": 317.02178035589196,
"volume_molar": 9.545748926444922,
"formula_full": "K4 Be4 H12",
"formula_reduced": "KBeH3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.79438082,
"spacegroup": 11
},
{
"id": "jvasp-101990",
"created_at": "2022-09-04T14:36:48.230662Z",
"updated_at": "2022-09-04T14:36:48.230691Z",
"structure_string": "H32 C16\n1.0\n5.742161 0.000000 -1.236242\n0.000000 5.293734 0.000000\n-0.041115 0.000000 11.453833\nH C\n32 16\ndirect\n0.665134 0.910934 0.433948 H\n0.456287 0.168848 0.918707 H\n0.543714 0.831151 0.081293 H\n0.543714 0.668847 0.581293 H\n0.456287 0.331152 0.418707 H\n0.693112 0.027141 0.868608 H\n0.306889 0.972859 0.131392 H\n0.306889 0.527140 0.631392 H\n0.693112 0.472859 0.368608 H\n0.480712 0.739399 0.220735 H\n0.480712 0.760600 0.720734 H\n0.519288 0.239399 0.279266 H\n0.891200 0.516037 0.777081 H\n0.108801 0.483963 0.222919 H\n0.108801 0.016037 0.722919 H\n0.891199 0.983962 0.277081 H\n0.519289 0.260600 0.779265 H\n0.942777 0.720818 0.134324 H\n0.057224 0.279181 0.865676 H\n0.334867 0.089065 0.566052 H\n0.334867 0.410935 0.066052 H\n0.665134 0.589065 0.933948 H\n0.952864 0.343134 0.569633 H\n0.047137 0.843133 0.930367 H\n0.952863 0.156866 0.069633 H\n0.047137 0.656866 0.430367 H\n0.278713 0.816913 0.385643 H\n0.278714 0.683086 0.885643 H\n0.721287 0.316914 0.114357 H\n0.057224 0.220818 0.365676 H\n0.942777 0.779181 0.634324 H\n0.721287 0.183086 0.614357 H\n0.401559 0.706331 0.628055 C\n0.963424 0.040847 0.370339 C\n0.598442 0.293668 0.371945 C\n0.963424 0.459152 0.870339 C\n0.036577 0.540847 0.129661 C\n0.036577 0.959152 0.629661 C\n0.864061 0.342214 0.066453 C\n0.764339 0.089621 0.435178 C\n0.135939 0.842214 0.433547 C\n0.864062 0.157785 0.566453 C\n0.764339 0.410379 0.935178 C\n0.235661 0.589621 0.064822 C\n0.235662 0.910378 0.564822 C\n0.401558 0.793668 0.128056 C\n0.135940 0.657785 0.933547 C\n0.598442 0.206331 0.871944 C\n",
"nsites": 48,
"nelements": 2,
"elements": [
"H",
"C"
],
"chemical_system": "C-H",
"density": 1.0711944327109981,
"density_atomic": 0.13797127291206981,
"volume": 347.89850805095335,
"volume_molar": 4.364778720160072,
"formula_full": "H32 C16",
"formula_reduced": "H2C",
"formula_anonymous": "AB2",
"energy_above_hull": 3.260626666666667,
"spacegroup": 14
},
{
"id": "jvasp-51438",
"created_at": "2022-09-04T14:37:18.475931Z",
"updated_at": "2022-09-04T14:37:18.475958Z",
"structure_string": "K2 N6\n1.0\n6.311878 -0.916426 -3.409923\n-3.870248 6.100744 -0.330636\n-0.581372 0.916427 7.150482\nK N\n2 6\ndirect\n-0.000000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 K\n0.500000 0.942055 0.557943 N\n0.500000 0.057944 0.442056 N\n0.384112 0.442056 0.942056 N\n-0.000000 0.750000 0.749999 N\n-0.000000 0.250000 0.250000 N\n0.615888 0.557943 0.057944 N\n",
"nsites": 8,
"nelements": 2,
"elements": [
"K",
"N"
],
"chemical_system": "K-N",
"density": 1.0702399790069288,
"density_atomic": 0.03178137538603557,
"volume": 251.71975419022053,
"volume_molar": 18.948647397576345,
"formula_full": "K2 N6",
"formula_reduced": "KN3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.840654437500001,
"spacegroup": 140
},
{
"id": "jvasp-101982",
"created_at": "2022-09-04T14:37:05.482751Z",
"updated_at": "2022-09-04T14:37:05.482772Z",
"structure_string": "H40 C20\n1.0\n8.553841 0.000000 -3.731294\n0.000000 5.200534 0.000000\n-0.028544 0.000000 9.817612\nH C\n40 20\ndirect\n0.480242 0.120644 0.176019 H\n0.919910 0.698751 0.308897 H\n0.080090 0.301249 0.691104 H\n0.031357 0.774126 0.067384 H\n0.968643 0.225874 0.932616 H\n0.968643 0.274126 0.432616 H\n0.031358 0.725873 0.567384 H\n0.199850 0.644290 0.210828 H\n0.800150 0.144290 0.289172 H\n0.199850 0.855709 0.710828 H\n0.185930 0.965683 0.949509 H\n0.814071 0.034317 0.050492 H\n0.814071 0.465683 0.550492 H\n0.185929 0.534316 0.449509 H\n0.332491 0.747971 0.058226 H\n0.667510 0.252029 0.941774 H\n0.667509 0.247971 0.441774 H\n0.332491 0.752028 0.558226 H\n0.919911 0.801248 0.808897 H\n0.080090 0.198751 0.191104 H\n0.800151 0.355709 0.789172 H\n0.870756 0.484077 0.155865 H\n0.129244 0.515922 0.844135 H\n0.519758 0.879355 0.823981 H\n0.519758 0.620644 0.323981 H\n0.480243 0.379355 0.676019 H\n0.311899 0.317293 0.097457 H\n0.688102 0.682707 0.902543 H\n0.311899 0.182707 0.597457 H\n0.353272 0.321957 0.358797 H\n0.646728 0.678042 0.641203 H\n0.688102 0.817292 0.402543 H\n0.870757 0.015922 0.655865 H\n0.353272 0.178043 0.858797 H\n0.409234 0.992998 0.381332 H\n0.590766 0.007001 0.618668 H\n0.590766 0.492999 0.118668 H\n0.409235 0.507001 0.881332 H\n0.129244 0.984077 0.344135 H\n0.646728 0.821956 0.141203 H\n0.160618 0.457743 0.751826 C\n0.151844 0.819921 0.145179 C\n0.848156 0.180078 0.854822 C\n0.742867 0.093742 0.935193 C\n0.151844 0.680077 0.645178 C\n0.257133 0.906257 0.064808 C\n0.839382 0.542257 0.248175 C\n0.848156 0.319922 0.354822 C\n0.839382 0.957742 0.748175 C\n0.355961 0.134965 0.157119 C\n0.330456 0.366007 0.802416 C\n0.669544 0.633993 0.197584 C\n0.669544 0.866006 0.697584 C\n0.330456 0.133993 0.302416 C\n0.355961 0.365035 0.657119 C\n0.644039 0.634964 0.342882 C\n0.644039 0.865035 0.842882 C\n0.742867 0.406258 0.435193 C\n0.160618 0.042257 0.251826 C\n0.257133 0.593742 0.564807 C\n",
"nsites": 60,
"nelements": 2,
"elements": [
"H",
"C"
],
"chemical_system": "C-H",
"density": 1.067989677257328,
"density_atomic": 0.13755849613148502,
"volume": 436.1780746908509,
"volume_molar": 4.377876270356829,
"formula_full": "H40 C20",
"formula_reduced": "H2C",
"formula_anonymous": "AB2",
"energy_above_hull": 3.26792,
"spacegroup": 14
},
{
"id": "jvasp-61729",
"created_at": "2022-09-04T14:35:53.417002Z",
"updated_at": "2022-09-04T14:35:53.417021Z",
"structure_string": "Al4 H12\n1.0\n0.000000 4.535996 4.535996\n4.535996 0.000000 4.535996\n4.535996 4.535996 -0.000000\nAl H\n4 12\ndirect\n0.500000 0.500000 0.500000 Al\n0.000000 0.500000 0.500000 Al\n0.500000 0.000000 0.500000 Al\n0.500000 0.500000 0.000000 Al\n0.569409 0.569409 0.180592 H\n0.180592 0.180592 0.569409 H\n0.569409 0.180592 0.569409 H\n0.180592 0.569409 0.180592 H\n0.180592 0.569409 0.569409 H\n0.569409 0.180592 0.180592 H\n0.819409 0.430592 0.819409 H\n0.430592 0.819409 0.430592 H\n0.819409 0.819409 0.430592 H\n0.430592 0.430592 0.819409 H\n0.819409 0.430592 0.430592 H\n0.430592 0.819409 0.819409 H\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Al",
"H"
],
"chemical_system": "Al-H",
"density": 1.0677262645308057,
"density_atomic": 0.08571799385694497,
"volume": 186.65859150533143,
"volume_molar": 7.025526950677789,
"formula_full": "Al4 H12",
"formula_reduced": "AlH3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.3284532,
"spacegroup": 227
},
{
"id": "jvasp-81775",
"created_at": "2022-09-04T14:37:09.971193Z",
"updated_at": "2022-09-04T14:37:09.971208Z",
"structure_string": "Hf2 Cu1 Mo1\n1.0\n-8.677511 0.001460 -5.007579\n-8.949974 -0.036282 5.479241\n-5.859488 8.704933 0.126361\nHf Cu Mo\n2 1 1\ndirect\n0.729971 0.000009 0.000009 Hf\n0.270029 0.999990 0.999990 Hf\n0.000000 0.000000 0.000000 Cu\n0.500000 -0.000000 0.000000 Mo\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Cu",
"Mo"
],
"chemical_system": "Cu-Hf-Mo",
"density": 1.065249968804135,
"density_atomic": 0.004968447300647885,
"volume": 805.0804925471184,
"volume_molar": 121.20770123122195,
"formula_full": "Hf2 Cu1 Mo1",
"formula_reduced": "Hf2CuMo",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.0304205875,
"spacegroup": 71
}
]
}