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=-volume_molar&page=1113",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume_molar&page=1111",
"results": [
{
"id": "jvasp-100995",
"created_at": "2022-09-04T14:36:34.776981Z",
"updated_at": "2022-09-04T14:36:34.777013Z",
"structure_string": "Li1 Sm2 Ga1\n1.0\n4.470446 0.000000 2.581013\n1.490149 4.214777 2.581013\n-0.000000 -0.000000 5.162026\nLi Sm Ga\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.250000 0.250000 0.250000 Sm\n0.750001 0.750001 0.749999 Sm\n0.500001 0.500000 0.499999 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Sm",
"Ga"
],
"chemical_system": "Ga-Li-Sm",
"density": 6.442982303150389,
"density_atomic": 0.041125799034584694,
"volume": 97.26254793581529,
"volume_molar": 14.643218858643179,
"formula_full": "Li1 Sm2 Ga1",
"formula_reduced": "LiSm2Ga",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7458725187499998,
"spacegroup": 225
},
{
"id": "jvasp-92199",
"created_at": "2022-09-04T14:37:41.280447Z",
"updated_at": "2022-09-04T14:37:41.280465Z",
"structure_string": "K1 Mg6 Ti1\n1.0\n6.600542 0.000992 0.000000\n-3.299413 5.716733 0.000000\n0.000000 0.000000 5.154630\nK Mg Ti\n1 6 1\ndirect\n0.416654 0.083345 0.750000 K\n0.064629 0.907242 0.250000 Mg\n0.592757 0.435371 0.250000 Mg\n0.592668 0.907331 0.250000 Mg\n0.397148 0.573576 0.750000 Mg\n0.926424 0.102852 0.750000 Mg\n0.926389 0.573610 0.750000 Mg\n0.083332 0.416668 0.250000 Ti\n",
"nsites": 8,
"nelements": 3,
"elements": [
"K",
"Mg",
"Ti"
],
"chemical_system": "K-Mg-Ti",
"density": 1.9872871819112805,
"density_atomic": 0.041127026685329984,
"volume": 194.51928925495605,
"volume_molar": 14.64278175535626,
"formula_full": "K1 Mg6 Ti1",
"formula_reduced": "KMg6Ti",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 187
},
{
"id": "jvasp-40836",
"created_at": "2022-09-04T14:37:53.915913Z",
"updated_at": "2022-09-04T14:37:53.915943Z",
"structure_string": "Zr1 Bi1 Rh1\n1.0\n4.061605 0.000000 2.344968\n1.353868 3.829319 2.344968\n0.000000 0.000000 4.689938\nZr Bi Rh\n1 1 1\ndirect\n0.250000 0.250000 0.250000 Zr\n0.000000 0.000000 0.000000 Bi\n0.500001 0.500000 0.500000 Rh\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Zr",
"Bi",
"Rh"
],
"chemical_system": "Bi-Rh-Zr",
"density": 9.176693540796439,
"density_atomic": 0.04112774722215216,
"volume": 72.94345551667233,
"volume_molar": 14.642525221406643,
"formula_full": "Zr1 Bi1 Rh1",
"formula_reduced": "ZrBiRh",
"formula_anonymous": "ABC",
"energy_above_hull": 2.3908006000000004,
"spacegroup": 216
},
{
"id": "jvasp-68645",
"created_at": "2022-09-04T14:35:53.377542Z",
"updated_at": "2022-09-04T14:35:53.377567Z",
"structure_string": "Be1 Sn1 Pb1\n1.0\n2.130297 -3.689784 -0.000000\n2.130297 3.689784 0.000000\n0.000000 0.000000 4.639885\nBe Sn Pb\n1 1 1\ndirect\n0.000000 0.000000 0.166559 Be\n0.666667 0.333334 0.166709 Sn\n0.333334 0.666667 0.666732 Pb\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Sn",
"Pb"
],
"chemical_system": "Be-Pb-Sn",
"density": 7.624558449000272,
"density_atomic": 0.041128506885752855,
"volume": 72.9421082154387,
"volume_molar": 14.642254766817473,
"formula_full": "Be1 Sn1 Pb1",
"formula_reduced": "BeSnPb",
"formula_anonymous": "ABC",
"energy_above_hull": 0.84178954,
"spacegroup": 187
},
{
"id": "jvasp-37163",
"created_at": "2022-09-04T14:38:03.010843Z",
"updated_at": "2022-09-04T14:38:03.010869Z",
"structure_string": "Na1 Nd1 S2\n1.0\n-2.059689 -3.567485 0.000000\n-4.119377 0.000000 -0.000000\n-2.059689 -1.189162 -6.617622\nNa Nd S\n1 1 2\ndirect\n0.500000 0.500001 0.500000 Na\n0.000000 0.000000 0.000000 Nd\n0.745727 0.745727 0.762820 S\n0.254274 0.254274 0.237179 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Nd",
"S"
],
"chemical_system": "Na-Nd-S",
"density": 3.950436107684205,
"density_atomic": 0.04113053316650734,
"volume": 97.25135299868192,
"volume_molar": 14.641533421462768,
"formula_full": "Na1 Nd1 S2",
"formula_reduced": "NaNdS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6924376250000001,
"spacegroup": 166
},
{
"id": "jvasp-70933",
"created_at": "2022-09-04T14:36:08.341857Z",
"updated_at": "2022-09-04T14:36:08.341881Z",
"structure_string": "Y2 Be1 Ge1\n1.0\n4.098105 0.000000 -0.000000\n0.000000 4.098105 0.000000\n-0.000000 0.000000 5.790485\nY Be Ge\n2 1 1\ndirect\n0.000000 0.000000 0.875052 Y\n0.500001 0.500001 0.374937 Y\n0.000000 0.000000 0.375074 Be\n0.500001 0.500001 0.874940 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Be",
"Ge"
],
"chemical_system": "Be-Ge-Y",
"density": 4.430420062369928,
"density_atomic": 0.0411319109928987,
"volume": 97.2480952973614,
"volume_molar": 14.64104296306511,
"formula_full": "Y2 Be1 Ge1",
"formula_reduced": "Y2BeGe",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.0755432375,
"spacegroup": 123
},
{
"id": "jvasp-22735",
"created_at": "2022-09-04T14:36:58.385059Z",
"updated_at": "2022-09-04T14:36:58.385074Z",
"structure_string": "Li1 Ca1 As1\n1.0\n4.061455 -0.000000 2.344882\n1.353819 3.829177 2.344882\n0.000000 0.000000 4.689764\nLi Ca As\n1 1 1\ndirect\n0.499999 0.500000 0.499999 Li\n0.000000 0.000000 0.000000 Ca\n0.250000 0.250000 0.250000 As\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Ca",
"As"
],
"chemical_system": "As-Ca-Li",
"density": 2.7762549708976296,
"density_atomic": 0.04113231743858803,
"volume": 72.93535076109202,
"volume_molar": 14.640898288775643,
"formula_full": "Li1 Ca1 As1",
"formula_reduced": "LiCaAs",
"formula_anonymous": "ABC",
"energy_above_hull": 0.4091640566666666,
"spacegroup": 216
},
{
"id": "jvasp-102573",
"created_at": "2022-09-04T14:36:52.273914Z",
"updated_at": "2022-09-04T14:36:52.273940Z",
"structure_string": "Tm1 Mg3\n1.0\n4.615481 -0.000000 0.000000\n0.000000 4.615481 -0.000000\n0.000000 -0.000000 4.564782\nTm Mg\n1 3\ndirect\n0.500000 0.500000 -0.000000 Tm\n0.000000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n-0.000000 0.500000 0.500000 Mg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Tm",
"Mg"
],
"chemical_system": "Mg-Tm",
"density": 4.129902452070725,
"density_atomic": 0.04113448028221203,
"volume": 97.24202111117319,
"volume_molar": 14.640128472959413,
"formula_full": "Tm1 Mg3",
"formula_reduced": "TmMg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.2369650859374999,
"spacegroup": 221
},
{
"id": "jvasp-16222",
"created_at": "2022-09-04T14:36:00.103754Z",
"updated_at": "2022-09-04T14:36:00.103784Z",
"structure_string": "Nd4 Si4\n1.0\n3.959994 0.000000 0.000000\n-0.000000 5.933520 0.000000\n0.000000 0.000000 8.276506\nNd Si\n4 4\ndirect\n0.250000 0.386346 0.679419 Nd\n0.749999 0.613654 0.320582 Nd\n0.749999 0.886346 0.820582 Nd\n0.250000 0.113654 0.179418 Nd\n0.250000 0.876424 0.535848 Si\n0.749999 0.123576 0.464152 Si\n0.749999 0.376424 0.964153 Si\n0.250000 0.623576 0.035848 Si\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Nd",
"Si"
],
"chemical_system": "Nd-Si",
"density": 5.885856962693529,
"density_atomic": 0.041137321825960096,
"volume": 194.4706083163519,
"volume_molar": 14.639117212048722,
"formula_full": "Nd4 Si4",
"formula_reduced": "NdSi",
"formula_anonymous": "AB",
"energy_above_hull": 1.2146150499999997,
"spacegroup": 62
},
{
"id": "jvasp-39821",
"created_at": "2022-09-04T14:37:41.427017Z",
"updated_at": "2022-09-04T14:37:41.427038Z",
"structure_string": "Li2 Ac1 In1\n1.0\n-0.001298 3.649107 3.649107\n3.649107 -0.001298 3.649107\n3.649107 3.649107 -0.001298\nLi Ac In\n2 1 1\ndirect\n0.500074 0.500074 0.500074 Li\n-0.000073 -0.000073 -0.000073 Li\n0.250000 0.250000 0.250000 Ac\n0.750000 0.750000 0.750000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Ac",
"In"
],
"chemical_system": "Ac-In-Li",
"density": 6.074513682136719,
"density_atomic": 0.04113756137758227,
"volume": 97.23473793903064,
"volume_molar": 14.63903196576387,
"formula_full": "Li2 Ac1 In1",
"formula_reduced": "Li2AcIn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3418774925,
"spacegroup": 225
},
{
"id": "jvasp-18914",
"created_at": "2022-09-04T14:36:20.363178Z",
"updated_at": "2022-09-04T14:36:20.363200Z",
"structure_string": "Np1 Se1\n1.0\n3.547817 -0.000000 2.048334\n1.182606 3.344914 2.048334\n0.000000 0.000000 4.096667\nNp Se\n1 1\ndirect\n0.000000 0.000000 0.000000 Np\n0.500001 0.499999 0.499999 Se\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Np",
"Se"
],
"chemical_system": "Np-Se",
"density": 10.792060529086989,
"density_atomic": 0.04113894646098338,
"volume": 48.61573209943093,
"volume_molar": 14.63853909266117,
"formula_full": "Np1 Se1",
"formula_reduced": "NpSe",
"formula_anonymous": "AB",
"energy_above_hull": 2.2850966833333337,
"spacegroup": 225
},
{
"id": "jvasp-119102",
"created_at": "2022-09-04T14:38:50.991242Z",
"updated_at": "2022-09-04T14:38:50.991270Z",
"structure_string": "Ga5 Cu1 Se8\n1.0\n5.507931 -0.000000 0.000000\n0.000000 5.507931 0.000000\n-0.000000 -0.000000 11.217505\nGa Cu Se\n5 1 8\ndirect\n-0.000000 0.500000 0.255433 Ga\n0.500000 0.000000 0.744567 Ga\n-0.000000 0.500000 0.744567 Ga\n0.500000 0.000000 0.255433 Ga\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.500000 Cu\n0.269756 0.269756 0.114750 Se\n0.730244 0.730244 0.114750 Se\n0.269756 0.730244 0.885250 Se\n0.730244 0.269756 0.885250 Se\n0.235657 0.235657 0.615975 Se\n0.764343 0.764343 0.615975 Se\n0.235657 0.764343 0.384025 Se\n0.764343 0.235657 0.384025 Se\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ga",
"Cu",
"Se"
],
"chemical_system": "Cu-Ga-Se",
"density": 5.093428272837436,
"density_atomic": 0.04113909956480641,
"volume": 340.308858193306,
"volume_molar": 14.63848461367834,
"formula_full": "Ga5 Cu1 Se8",
"formula_reduced": "Ga5CuSe8",
"formula_anonymous": "AB5C8",
"energy_above_hull": 0.7101063577380953,
"spacegroup": 111
}
]
}