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=-nelements&page=4155",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=4153",
"results": [
{
"id": "jvasp-59701",
"created_at": "2022-09-04T14:38:33.512585Z",
"updated_at": "2022-09-04T14:38:33.512601Z",
"structure_string": "Si4 P8\n1.0\n5.783281 -0.000000 -0.000000\n0.000000 5.783281 0.000000\n0.000000 0.000000 5.783281\nSi P\n4 8\ndirect\n0.000000 0.500000 0.500000 Si\n0.500000 0.500000 0.000000 Si\n0.500000 0.000000 0.500000 Si\n0.000000 0.000000 0.000000 Si\n0.608707 0.608707 0.608707 P\n0.891293 0.391293 0.108707 P\n0.108707 0.891293 0.391293 P\n0.391293 0.108707 0.891293 P\n0.608707 0.891293 0.108707 P\n0.891293 0.108707 0.608707 P\n0.108707 0.608707 0.891293 P\n0.391293 0.391293 0.391293 P\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Si",
"P"
],
"chemical_system": "P-Si",
"density": 3.0916337719565865,
"density_atomic": 0.06203808202485692,
"volume": 193.42957758094352,
"volume_molar": 9.707167861164852,
"formula_full": "Si4 P8",
"formula_reduced": "SiP2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.6517832,
"spacegroup": 205
},
{
"id": "jvasp-115482",
"created_at": "2022-09-04T14:38:42.296452Z",
"updated_at": "2022-09-04T14:38:42.296477Z",
"structure_string": "B1 I2\n1.0\n5.570565 -0.000000 0.000000\n-2.785283 4.824251 -0.000000\n0.000000 0.000000 4.193766\nB I\n1 2\ndirect\n0.000000 0.000000 0.000000 B\n0.333335 0.666667 0.000000 I\n0.666668 0.333334 0.000000 I\n",
"nsites": 3,
"nelements": 2,
"elements": [
"B",
"I"
],
"chemical_system": "B-I",
"density": 3.8988661686096457,
"density_atomic": 0.026618766008203922,
"volume": 112.70244454890951,
"volume_molar": 22.62366616898759,
"formula_full": "B1 I2",
"formula_reduced": "BI2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.659238377777778,
"spacegroup": 191
},
{
"id": "jvasp-21685",
"created_at": "2022-09-04T14:38:33.512962Z",
"updated_at": "2022-09-04T14:38:33.512975Z",
"structure_string": "Er10 Ga6\n1.0\n4.220279 -7.309739 -0.000000\n4.220279 7.309739 0.000000\n0.000000 0.000000 6.423136\nEr Ga\n10 6\ndirect\n0.242230 -0.000000 0.250000 Er\n0.757770 -0.000000 0.750001 Er\n0.242230 0.242230 0.750001 Er\n-0.000000 0.242230 0.250000 Er\n0.757770 0.757770 0.250000 Er\n-0.000000 0.757770 0.750001 Er\n0.333333 0.666667 0.500000 Er\n0.666667 0.333333 0.000000 Er\n0.666667 0.333333 0.500000 Er\n0.333333 0.666667 0.000000 Er\n-0.000000 0.598943 0.250000 Ga\n0.598943 0.598943 0.750001 Ga\n0.401057 -0.000000 0.750001 Ga\n0.598943 -0.000000 0.250000 Ga\n0.401057 0.401057 0.250000 Ga\n-0.000000 0.401057 0.750001 Ga\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Er",
"Ga"
],
"chemical_system": "Er-Ga",
"density": 8.761289465591071,
"density_atomic": 0.040373819409661504,
"volume": 396.2964176773224,
"volume_molar": 14.915955062103674,
"formula_full": "Er10 Ga6",
"formula_reduced": "Er5Ga3",
"formula_anonymous": "A3B5",
"energy_above_hull": 0.8490849999999998,
"spacegroup": 193
},
{
"id": "jvasp-115897",
"created_at": "2022-09-04T14:38:40.044772Z",
"updated_at": "2022-09-04T14:38:40.044793Z",
"structure_string": "P1 Cl5\n1.0\n6.144242 0.000000 0.000000\n0.000000 7.021669 0.000000\n0.000000 0.000000 7.670663\nP Cl\n1 5\ndirect\n0.824728 0.000000 0.500000 P\n0.822851 0.000000 0.219933 Cl\n0.658146 0.746264 0.500000 Cl\n0.658146 0.253736 0.500000 Cl\n0.157504 0.000000 0.500000 Cl\n0.822851 0.000000 0.780068 Cl\n",
"nsites": 6,
"nelements": 2,
"elements": [
"P",
"Cl"
],
"chemical_system": "Cl-P",
"density": 1.0448864609377722,
"density_atomic": 0.01813049584349731,
"volume": 330.93413725648116,
"volume_molar": 33.215532614128165,
"formula_full": "P1 Cl5",
"formula_reduced": "PCl5",
"formula_anonymous": "AB5",
"energy_above_hull": 0.5718709729166667,
"spacegroup": 25
},
{
"id": "jvasp-114578",
"created_at": "2022-09-04T14:38:42.446843Z",
"updated_at": "2022-09-04T14:38:42.446868Z",
"structure_string": "Ba1 O3\n1.0\n4.264211 -0.930223 0.401143\n0.819642 -3.787508 -0.452435\n-0.563454 2.574482 -3.724310\nBa O\n1 3\ndirect\n0.324432 0.326054 0.600258 Ba\n0.015515 0.119562 0.901314 O\n0.625831 0.506261 0.291101 O\n0.838944 0.542467 0.117308 O\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ba",
"O"
],
"chemical_system": "Ba-O",
"density": 4.961072269077491,
"density_atomic": 0.06448400009333183,
"volume": 62.030891294127905,
"volume_molar": 9.33896897103742,
"formula_full": "Ba1 O3",
"formula_reduced": "BaO3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.70793425,
"spacegroup": 8
},
{
"id": "jvasp-16715",
"created_at": "2022-09-04T14:38:32.995651Z",
"updated_at": "2022-09-04T14:38:32.995677Z",
"structure_string": "Ti6 As2\n1.0\n5.015099 -0.000000 -0.000000\n0.000000 5.015099 0.000000\n-0.000000 0.000000 5.015099\nTi As\n6 2\ndirect\n0.500000 0.250000 0.000000 Ti\n0.500000 0.750000 0.000000 Ti\n0.250000 0.000000 0.500000 Ti\n0.750000 0.000000 0.500000 Ti\n0.000000 0.500000 0.250000 Ti\n0.000000 0.500000 0.750000 Ti\n0.500000 0.500000 0.500000 As\n0.000000 0.000000 0.000000 As\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ti",
"As"
],
"chemical_system": "As-Ti",
"density": 5.753563631400348,
"density_atomic": 0.06342368262483336,
"volume": 126.13584813928202,
"volume_molar": 9.495097904709256,
"formula_full": "Ti6 As2",
"formula_reduced": "Ti3As",
"formula_anonymous": "AB3",
"energy_above_hull": 3.3230941875000006,
"spacegroup": 223
},
{
"id": "jvasp-115190",
"created_at": "2022-09-04T14:38:43.130030Z",
"updated_at": "2022-09-04T14:38:43.130056Z",
"structure_string": "Li1 I2\n1.0\n4.212433 -0.444537 0.315498\n0.846062 -9.743180 -0.941057\n-0.866989 2.307847 -2.167794\nLi I\n1 2\ndirect\n0.031383 0.930224 -0.165650 Li\n0.691865 0.183915 0.663858 I\n0.370821 0.676493 0.004243 I\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"I"
],
"chemical_system": "I-Li",
"density": 4.562869531633247,
"density_atomic": 0.03161447622788321,
"volume": 94.8932374642371,
"volume_molar": 19.048681106058044,
"formula_full": "Li1 I2",
"formula_reduced": "LiI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1034087583333334,
"spacegroup": 12
},
{
"id": "jvasp-107456",
"created_at": "2022-09-04T14:38:48.105134Z",
"updated_at": "2022-09-04T14:38:48.105155Z",
"structure_string": "La1 Pu3\n1.0\n4.295857 -0.009002 -3.852757\n-0.861963 4.208502 -3.852757\n0.007361 0.009002 5.770447\nLa Pu\n1 3\ndirect\n0.000000 0.000000 0.000000 La\n0.500001 0.500000 -0.000000 Pu\n0.250001 0.750000 0.500000 Pu\n0.750001 0.250000 0.500000 Pu\n",
"nsites": 4,
"nelements": 2,
"elements": [
"La",
"Pu"
],
"chemical_system": "La-Pu",
"density": 13.828605028861178,
"density_atomic": 0.03824883820147548,
"volume": 104.57833984211568,
"volume_molar": 15.744637074408423,
"formula_full": "La1 Pu3",
"formula_reduced": "LaPu3",
"formula_anonymous": "AB3",
"energy_above_hull": 6.422118749999999,
"spacegroup": 139
},
{
"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-20326",
"created_at": "2022-09-04T14:38:32.980581Z",
"updated_at": "2022-09-04T14:38:32.980611Z",
"structure_string": "Na1 F1\n1.0\n2.836480 0.000000 1.637643\n0.945493 2.674259 1.637643\n0.000000 0.000000 3.275285\nNa F\n1 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.499999 0.500000 0.500000 F\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Na",
"F"
],
"chemical_system": "F-Na",
"density": 2.806362587376898,
"density_atomic": 0.08050033870215188,
"volume": 24.84461596366597,
"volume_molar": 7.480888723066976,
"formula_full": "Na1 F1",
"formula_reduced": "NaF",
"formula_anonymous": "AB",
"energy_above_hull": 0.01069,
"spacegroup": 225
},
{
"id": "jvasp-118390",
"created_at": "2022-09-04T14:38:33.166137Z",
"updated_at": "2022-09-04T14:38:33.166172Z",
"structure_string": "Ge1 P2\n1.0\n3.986927 0.000000 0.000000\n0.000000 2.575772 0.000000\n0.000000 0.000000 5.564552\nGe P\n1 2\ndirect\n0.466657 0.000000 0.000000 Ge\n-0.033328 0.000000 0.697700 P\n-0.033328 0.000000 0.302298 P\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ge",
"P"
],
"chemical_system": "Ge-P",
"density": 3.9109115505390304,
"density_atomic": 0.052498312990871994,
"volume": 57.14469340227404,
"volume_molar": 11.47111291185125,
"formula_full": "Ge1 P2",
"formula_reduced": "GeP2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.0573423166666664,
"spacegroup": 47
},
{
"id": "jvasp-113488",
"created_at": "2022-09-04T14:38:47.211303Z",
"updated_at": "2022-09-04T14:38:47.211321Z",
"structure_string": "Rb1 Cl1\n1.0\n7.668979 0.000000 0.000000\n0.000000 7.668979 0.000000\n0.000000 -0.000000 6.041758\nRb Cl\n1 1\ndirect\n0.000000 0.000000 0.750016 Rb\n0.000000 0.000000 0.249984 Cl\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Rb",
"Cl"
],
"chemical_system": "Cl-Rb",
"density": 0.5650822768117604,
"density_atomic": 0.005628485774354306,
"volume": 355.33535664473413,
"volume_molar": 106.99397673596953,
"formula_full": "Rb1 Cl1",
"formula_reduced": "RbCl",
"formula_anonymous": "AB",
"energy_above_hull": 0.314635,
"spacegroup": 123
}
]
}