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=energy_above_hull&page=173",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=171",
"results": [
{
"id": "jvasp-21726",
"created_at": "2022-09-04T14:38:34.210007Z",
"updated_at": "2022-09-04T14:38:34.210031Z",
"structure_string": "Ca4 Ga4 Au4\n1.0\n4.561345 0.000000 0.000000\n-0.000000 7.257510 0.000000\n0.000000 0.000000 7.775772\nCa Ga Au\n4 4 4\ndirect\n0.750001 0.494267 0.796715 Ca\n0.250000 0.005733 0.296715 Ca\n0.750001 0.994267 0.703284 Ca\n0.250000 0.505733 0.203285 Ca\n0.250000 0.185285 0.919474 Ga\n0.750001 0.314715 0.419474 Ga\n0.250000 0.685285 0.580525 Ga\n0.750001 0.814715 0.080525 Ga\n0.250000 0.790383 0.908381 Au\n0.750001 0.209617 0.091619 Au\n0.250000 0.290383 0.591618 Au\n0.750001 0.709617 0.408381 Au\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ca",
"Ga",
"Au"
],
"chemical_system": "Au-Ca-Ga",
"density": 7.91579340962199,
"density_atomic": 0.04661837851213441,
"volume": 257.4092103370024,
"volume_molar": 12.917954146415628,
"formula_full": "Ca4 Ga4 Au4",
"formula_reduced": "CaGaAu",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-39920",
"created_at": "2022-09-04T14:37:38.573013Z",
"updated_at": "2022-09-04T14:37:38.573040Z",
"structure_string": "Dy2 Tl1 Cd1\n1.0\n-0.000000 3.738406 3.738406\n3.738406 -0.000000 3.738406\n3.738406 3.738406 0.000000\nDy Tl Cd\n2 1 1\ndirect\n0.500001 0.500001 0.500001 Dy\n0.000000 0.000000 0.000000 Dy\n0.750001 0.750001 0.750001 Tl\n0.250000 0.250000 0.250000 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Dy",
"Tl",
"Cd"
],
"chemical_system": "Cd-Dy-Tl",
"density": 10.198952340204409,
"density_atomic": 0.03827988289610402,
"volume": 104.49352760185964,
"volume_molar": 15.731868293183602,
"formula_full": "Dy2 Tl1 Cd1",
"formula_reduced": "Dy2TlCd",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-109619",
"created_at": "2022-09-04T14:38:27.943744Z",
"updated_at": "2022-09-04T14:38:27.943769Z",
"structure_string": "Yb2 Zn1 In1\n1.0\n4.518307 -0.000000 2.608646\n1.506102 4.259901 2.608646\n-0.000000 -0.000000 5.217292\nYb Zn In\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Yb\n0.750000 0.750000 0.750001 Yb\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500001 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Zn",
"In"
],
"chemical_system": "In-Yb-Zn",
"density": 8.702977436282385,
"density_atomic": 0.03983268713546157,
"volume": 100.42003911001395,
"volume_molar": 15.118590266130228,
"formula_full": "Yb2 Zn1 In1",
"formula_reduced": "Yb2ZnIn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-2676",
"created_at": "2022-09-04T14:36:51.977787Z",
"updated_at": "2022-09-04T14:36:51.977806Z",
"structure_string": "Mg1 Pd1 F6\n1.0\n4.420844 0.027285 3.069558\n1.620109 4.113375 3.069558\n0.039808 0.027286 5.381865\nMg Pd F\n1 1 6\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Pd\n0.392889 0.096589 0.757547 F\n0.096589 0.757549 0.392888 F\n0.242452 0.607113 0.903410 F\n0.903411 0.242452 0.607111 F\n0.607111 0.903412 0.242452 F\n0.757547 0.392888 0.096590 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Pd",
"F"
],
"chemical_system": "F-Mg-Pd",
"density": 4.193803042759478,
"density_atomic": 0.08256340310555044,
"volume": 96.89523080550188,
"volume_molar": 7.293958986042757,
"formula_full": "Mg1 Pd1 F6",
"formula_reduced": "MgPdF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 148
},
{
"id": "jvasp-107954",
"created_at": "2022-09-04T14:38:18.063553Z",
"updated_at": "2022-09-04T14:38:18.063563Z",
"structure_string": "Mg5 Pb1\n1.0\n4.988223 0.016592 3.641141\n1.859235 4.628811 3.641141\n0.024457 0.016592 6.175733\nMg Pb\n5 1\ndirect\n0.000001 0.671067 0.328932 Mg\n0.671067 0.328932 0.000000 Mg\n0.328933 -0.000000 0.671067 Mg\n0.830798 0.830796 0.830796 Mg\n0.169203 0.169203 0.169203 Mg\n0.500001 0.499999 0.500000 Pb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Pb"
],
"chemical_system": "Mg-Pb",
"density": 3.849387171784266,
"density_atomic": 0.042311752491415375,
"volume": 141.80457311989946,
"volume_molar": 14.23278499566245,
"formula_full": "Mg5 Pb1",
"formula_reduced": "Mg5Pb",
"formula_anonymous": "AB5",
"energy_above_hull": 0.0,
"spacegroup": 155
},
{
"id": "jvasp-80199",
"created_at": "2022-09-04T14:37:15.102660Z",
"updated_at": "2022-09-04T14:37:15.102677Z",
"structure_string": "K1 Tl2 In1\n1.0\n-13.129267 1.769079 -4.691298\n-8.316533 -0.140972 -0.028631\n-6.872254 3.944068 -2.530197\nK Tl In\n1 2 1\ndirect\n0.000000 0.000000 0.000000 K\n0.659192 0.056014 0.056014 Tl\n0.340808 -0.056014 -0.056014 Tl\n0.500000 -0.000000 0.000000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Tl",
"In"
],
"chemical_system": "In-K-Tl",
"density": 8.09803431982038,
"density_atomic": 0.03466784049781658,
"volume": 115.38070853452567,
"volume_molar": 17.37097169458617,
"formula_full": "K1 Tl2 In1",
"formula_reduced": "KTl2In",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 12
},
{
"id": "jvasp-38355",
"created_at": "2022-09-04T14:37:55.099587Z",
"updated_at": "2022-09-04T14:37:55.099608Z",
"structure_string": "Rb1 Ba3\n1.0\n-3.142458 3.142458 6.560676\n3.142458 -3.142458 6.560676\n3.142458 3.142458 -6.560676\nRb Ba\n1 3\ndirect\n0.000000 0.000000 0.000000 Rb\n0.750000 0.250000 0.500000 Ba\n0.250000 0.750000 0.500000 Ba\n0.500000 0.500000 0.000000 Ba\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"Ba"
],
"chemical_system": "Ba-Rb",
"density": 3.187498134644185,
"density_atomic": 0.01543520655448222,
"volume": 259.1478115878172,
"volume_molar": 39.01561497569485,
"formula_full": "Rb1 Ba3",
"formula_reduced": "RbBa3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-8803",
"created_at": "2022-09-04T14:37:02.272340Z",
"updated_at": "2022-09-04T14:37:02.272363Z",
"structure_string": "Ag1 P1 F6\n1.0\n5.787864 -0.000000 -0.000000\n2.893932 5.012438 -0.000000\n2.893932 1.670813 4.725770\nAg P F\n1 1 6\ndirect\n0.499999 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 P\n0.199931 0.199931 0.800069 F\n0.199930 0.800069 0.199931 F\n0.199930 0.800069 0.800069 F\n0.800068 0.199931 0.199931 F\n0.800068 0.199931 0.800069 F\n0.800068 0.800069 0.199931 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ag",
"P",
"F"
],
"chemical_system": "Ag-F-P",
"density": 3.0622587189373367,
"density_atomic": 0.058351237979325274,
"volume": 137.10077587101958,
"volume_molar": 10.320502132506144,
"formula_full": "Ag1 P1 F6",
"formula_reduced": "AgPF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-41342",
"created_at": "2022-09-04T14:37:40.000198Z",
"updated_at": "2022-09-04T14:37:40.000218Z",
"structure_string": "Na1 Tl2 Bi1\n1.0\n0.000016 3.934076 3.934079\n3.934080 0.000016 3.934079\n3.934086 3.934082 0.000011\nNa Tl Bi\n1 2 1\ndirect\n0.750004 0.749999 0.749999 Na\n0.999998 0.000001 0.000001 Tl\n0.500000 0.500000 0.500002 Tl\n0.249998 0.250001 0.250001 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Tl",
"Bi"
],
"chemical_system": "Bi-Na-Tl",
"density": 8.737183373405589,
"density_atomic": 0.03284752844628461,
"volume": 121.7747632532286,
"volume_molar": 18.333619133165453,
"formula_full": "Na1 Tl2 Bi1",
"formula_reduced": "NaTl2Bi",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-85175",
"created_at": "2022-09-04T14:37:08.347463Z",
"updated_at": "2022-09-04T14:37:08.347487Z",
"structure_string": "Eu2 Sn2 Hg2\n1.0\n5.009537 0.000000 0.000000\n-2.504769 4.338279 0.000000\n0.000000 0.000000 7.133651\nEu Sn Hg\n2 2 2\ndirect\n-0.000004 -0.000008 0.745818 Eu\n0.000004 0.000008 0.245818 Eu\n0.666668 0.333337 0.986430 Sn\n0.333332 0.666663 0.486430 Sn\n0.666668 0.333336 0.537752 Hg\n0.333332 0.666664 0.037752 Hg\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Eu",
"Sn",
"Hg"
],
"chemical_system": "Eu-Hg-Sn",
"density": 10.095234988920929,
"density_atomic": 0.0387011904980446,
"volume": 155.03399049967607,
"volume_molar": 15.560608556225867,
"formula_full": "Eu2 Sn2 Hg2",
"formula_reduced": "EuSnHg",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 186
},
{
"id": "jvasp-17656",
"created_at": "2022-09-04T14:38:28.161207Z",
"updated_at": "2022-09-04T14:38:28.161217Z",
"structure_string": "Ca3 Pb1 O1\n1.0\n4.830304 0.000000 0.000000\n0.000000 4.830304 0.000000\n-0.000000 0.000000 4.830304\nCa Pb O\n3 1 1\ndirect\n0.500000 0.000000 0.500000 Ca\n0.000000 0.500000 0.500000 Ca\n0.500000 0.500000 0.000000 Ca\n0.000000 0.000000 0.000000 Pb\n0.500000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Pb",
"O"
],
"chemical_system": "Ca-O-Pb",
"density": 5.0602064256064,
"density_atomic": 0.04436562573731781,
"volume": 112.69986429593594,
"volume_molar": 13.57388892846049,
"formula_full": "Ca3 Pb1 O1",
"formula_reduced": "Ca3PbO",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-20488",
"created_at": "2022-09-04T14:38:17.480853Z",
"updated_at": "2022-09-04T14:38:17.480876Z",
"structure_string": "Tb1 Tl3\n1.0\n4.751193 0.000000 0.000000\n0.000000 4.751193 0.000000\n0.000000 0.000000 4.751193\nTb Tl\n1 3\ndirect\n0.000000 0.000000 0.000000 Tb\n0.000000 0.500000 0.500000 Tl\n0.500000 0.500000 0.000000 Tl\n0.500000 0.000000 0.500000 Tl\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Tb",
"Tl"
],
"chemical_system": "Tb-Tl",
"density": 11.953654825036322,
"density_atomic": 0.0372951170123373,
"volume": 107.25264647049617,
"volume_molar": 16.14726334819613,
"formula_full": "Tb1 Tl3",
"formula_reduced": "TbTl3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
}
]
}