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=created_at&page=413",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=created_at&page=411",
"results": [
{
"id": "jvasp-94356",
"created_at": "2022-09-04T14:35:54.300162Z",
"updated_at": "2022-09-04T14:35:54.300185Z",
"structure_string": "Mg1 Sn5\n1.0\n5.800138 0.000000 -0.000000\n-2.900069 5.023067 -0.000000\n-0.000000 0.000000 5.534509\nMg Sn\n1 5\ndirect\n0.000000 0.000000 0.500000 Mg\n0.674500 0.000000 0.000000 Sn\n0.325500 0.325500 0.000000 Sn\n0.000000 0.674501 0.000000 Sn\n0.666667 0.333333 0.500000 Sn\n0.333333 0.666667 0.500000 Sn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Sn"
],
"chemical_system": "Mg-Sn",
"density": 6.3628145767015205,
"density_atomic": 0.03721044422129935,
"volume": 161.24505163971102,
"volume_molar": 16.18400663046348,
"formula_full": "Mg1 Sn5",
"formula_reduced": "MgSn5",
"formula_anonymous": "AB5",
"energy_above_hull": 0.3874804238095238,
"spacegroup": 189
},
{
"id": "jvasp-98784",
"created_at": "2022-09-04T14:35:54.300910Z",
"updated_at": "2022-09-04T14:35:54.300930Z",
"structure_string": "Pr6 Si4 Cl6 O14\n1.0\n5.328621 -0.085728 0.000000\n-2.687042 7.502149 0.000000\n0.000000 0.000000 12.144017\nPr Si Cl O\n6 4 6 14\ndirect\n0.325499 0.530769 0.895847 Pr\n0.610651 0.081594 0.877086 Pr\n0.389349 0.918406 0.377086 Pr\n0.144089 0.202719 0.620049 Pr\n0.855911 0.797281 0.120049 Pr\n0.674501 0.469231 0.395847 Pr\n0.930870 0.818641 0.822855 Si\n0.276708 0.563662 0.210507 Si\n0.069130 0.181358 0.322855 Si\n0.723293 0.436338 0.710508 Si\n0.127167 0.168139 0.993436 Cl\n0.787413 0.442771 0.996652 Cl\n0.481569 0.992311 0.619032 Cl\n0.872833 0.831861 0.493436 Cl\n0.212587 0.557228 0.496652 Cl\n0.518431 0.007689 0.119031 Cl\n0.219020 0.807720 0.859990 O\n0.724404 0.804704 0.927114 O\n0.750990 0.639990 0.750447 O\n0.022032 0.619124 0.248593 O\n0.249010 0.360009 0.250446 O\n0.457758 0.306445 0.780132 O\n0.542243 0.693555 0.280132 O\n0.780980 0.192279 0.359990 O\n0.977968 0.380875 0.748594 O\n0.275596 0.195296 0.427114 O\n0.370443 0.599417 0.083846 O\n0.941796 0.001983 0.762437 O\n0.058204 -0.001983 0.262437 O\n0.629557 0.400582 0.583846 O\n",
"nsites": 30,
"nelements": 4,
"elements": [
"Pr",
"Si",
"Cl",
"O"
],
"chemical_system": "Cl-O-Pr-Si",
"density": 4.797486166080255,
"density_atomic": 0.06215386616958193,
"volume": 482.6731118889268,
"volume_molar": 9.689084736207823,
"formula_full": "Pr6 Si4 Cl6 O14",
"formula_reduced": "Pr3Si2Cl3O7",
"formula_anonymous": "A2B3C3D7",
"energy_above_hull": 2.152468896833333,
"spacegroup": 4
},
{
"id": "jvasp-13764",
"created_at": "2022-09-04T14:35:54.307575Z",
"updated_at": "2022-09-04T14:35:54.307597Z",
"structure_string": "Li1 Si3 Pd1\n1.0\n3.226920 -0.000000 -1.181128\n-0.432321 3.197829 -1.181128\n0.779890 0.892419 7.129352\nLi Si Pd\n1 3 1\ndirect\n0.603763 0.603763 0.207525 Li\n0.760783 0.260783 0.521566 Si\n0.260784 0.760784 0.521566 Si\n0.413150 0.413151 0.826300 Si\n0.982521 0.982522 0.965041 Pd\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Li",
"Si",
"Pd"
],
"chemical_system": "Li-Pd-Si",
"density": 4.082933945618958,
"density_atomic": 0.06221109705060695,
"volume": 80.37151307479184,
"volume_molar": 9.680171296611535,
"formula_full": "Li1 Si3 Pd1",
"formula_reduced": "LiSi3Pd",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.5289063,
"spacegroup": 107
},
{
"id": "jvasp-93270",
"created_at": "2022-09-04T14:35:54.311084Z",
"updated_at": "2022-09-04T14:35:54.311092Z",
"structure_string": "Rb2 Au3\n1.0\n4.655407 0.000000 -1.930729\n-0.972724 4.946268 -2.345447\n-0.058117 -0.083575 6.437829\nRb Au\n2 3\ndirect\n0.803053 0.303053 0.606106 Rb\n0.196948 0.696948 0.393895 Rb\n0.500001 0.253239 0.000000 Au\n0.500001 0.746762 0.000000 Au\n0.000000 0.000000 0.000000 Au\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Rb",
"Au"
],
"chemical_system": "Au-Rb",
"density": 8.628214951279656,
"density_atomic": 0.034102071986340084,
"volume": 146.61865713035849,
"volume_molar": 17.659163825623928,
"formula_full": "Rb2 Au3",
"formula_reduced": "Rb2Au3",
"formula_anonymous": "A2B3",
"energy_above_hull": 0.0965975139999999,
"spacegroup": 71
},
{
"id": "jvasp-66854",
"created_at": "2022-09-04T14:35:54.313375Z",
"updated_at": "2022-09-04T14:35:54.313393Z",
"structure_string": "Be1 In1 Br1\n1.0\n-1.610730 1.610730 6.789410\n1.610730 -1.610730 6.789410\n1.610730 1.610730 -6.789410\nBe In Br\n1 1 1\ndirect\n0.022477 0.022477 0.000000 Be\n0.367284 0.367284 0.000000 In\n0.610238 0.610238 0.000000 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"In",
"Br"
],
"chemical_system": "Be-Br-In",
"density": 4.801483881537652,
"density_atomic": 0.042577850487774384,
"volume": 70.45916986489036,
"volume_molar": 14.143834625303997,
"formula_full": "Be1 In1 Br1",
"formula_reduced": "BeInBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.4542567249999998,
"spacegroup": 107
},
{
"id": "jvasp-72136",
"created_at": "2022-09-04T14:35:54.319514Z",
"updated_at": "2022-09-04T14:35:54.319537Z",
"structure_string": "Sc1 Be1 Ni2\n1.0\n3.969698 0.000000 0.000000\n0.000000 3.969698 -0.000000\n0.000000 0.000000 3.189036\nSc Be Ni\n1 1 2\ndirect\n0.500000 0.500000 0.500001 Sc\n0.000000 0.000000 0.500001 Be\n0.500000 0.000000 0.000000 Ni\n0.000000 0.500000 0.000000 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Be",
"Ni"
],
"chemical_system": "Be-Ni-Sc",
"density": 5.66201807252223,
"density_atomic": 0.07959497166197334,
"volume": 50.254430857609165,
"volume_molar": 7.5659814109552475,
"formula_full": "Sc1 Be1 Ni2",
"formula_reduced": "ScBeNi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.5550165374999998,
"spacegroup": 123
},
{
"id": "jvasp-93290",
"created_at": "2022-09-04T14:35:54.330048Z",
"updated_at": "2022-09-04T14:35:54.330081Z",
"structure_string": "Sm2 Zn4\n1.0\n4.162995 -0.000000 1.799594\n1.996821 5.245801 1.095678\n-0.001735 0.008260 5.718931\nSm Zn\n2 4\ndirect\n0.531623 0.718378 0.218378 Sm\n0.468379 0.281622 0.781621 Sm\n0.834318 0.712641 0.618725 Zn\n0.165684 0.287359 0.381274 Zn\n0.834318 0.118726 0.212640 Zn\n0.165684 0.881274 0.787359 Zn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Sm",
"Zn"
],
"chemical_system": "Sm-Zn",
"density": 7.476506539943159,
"density_atomic": 0.04803851097044342,
"volume": 124.8997914130105,
"volume_molar": 12.536068746396477,
"formula_full": "Sm2 Zn4",
"formula_reduced": "SmZn2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.3639024416666668,
"spacegroup": 74
},
{
"id": "jvasp-67943",
"created_at": "2022-09-04T14:35:54.330840Z",
"updated_at": "2022-09-04T14:35:54.330865Z",
"structure_string": "Be1 Cr1 Cu2\n1.0\n2.480605 0.000000 0.000000\n0.000000 2.480605 0.000000\n0.000000 0.000000 7.025537\nBe Cr Cu\n1 1 2\ndirect\n0.000000 0.000000 0.494178 Be\n0.499999 0.499999 0.726566 Cr\n0.000000 0.000000 0.002736 Cu\n0.499999 0.499999 0.276521 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cr",
"Cu"
],
"chemical_system": "Be-Cr-Cu",
"density": 7.225098783920093,
"density_atomic": 0.09252630869890552,
"volume": 43.230947567751784,
"volume_molar": 6.508571286029522,
"formula_full": "Be1 Cr1 Cu2",
"formula_reduced": "BeCrCu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4616186,
"spacegroup": 99
},
{
"id": "jvasp-68479",
"created_at": "2022-09-04T14:35:54.330907Z",
"updated_at": "2022-09-04T14:35:54.330944Z",
"structure_string": "Be1 Cd1 Tc1\n1.0\n1.398339 -2.421995 0.000000\n1.398339 2.421995 -0.000000\n0.000000 0.000000 6.597812\nBe Cd Tc\n1 1 1\ndirect\n0.000000 0.000000 0.975197 Be\n0.666668 0.333333 0.322421 Cd\n0.333333 0.666668 0.702381 Tc\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Cd",
"Tc"
],
"chemical_system": "Be-Cd-Tc",
"density": 8.152972199596512,
"density_atomic": 0.06712829396755036,
"volume": 44.69054436941585,
"volume_molar": 8.971091627788256,
"formula_full": "Be1 Cd1 Tc1",
"formula_reduced": "BeCdTc",
"formula_anonymous": "ABC",
"energy_above_hull": 1.7326591166666665,
"spacegroup": 156
},
{
"id": "jvasp-64134",
"created_at": "2022-09-04T14:35:54.331199Z",
"updated_at": "2022-09-04T14:35:54.331229Z",
"structure_string": "Ba4 W1 Cl1\n1.0\n0.000000 4.957281 4.957281\n4.957281 -0.000000 4.957281\n4.957281 4.957281 0.000000\nBa W Cl\n4 1 1\ndirect\n0.123410 0.625530 0.625530 Ba\n0.625530 0.625530 0.625530 Ba\n0.625530 0.123410 0.625530 Ba\n0.625530 0.625530 0.123410 Ba\n0.000000 0.000000 0.000000 W\n0.250000 0.250000 0.250000 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"W",
"Cl"
],
"chemical_system": "Ba-Cl-W",
"density": 5.238288759445347,
"density_atomic": 0.024625816720358563,
"volume": 243.64674147191644,
"volume_molar": 24.454582880986838,
"formula_full": "Ba4 W1 Cl1",
"formula_reduced": "Ba4WCl",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.4518063245833333,
"spacegroup": 216
},
{
"id": "jvasp-66968",
"created_at": "2022-09-04T14:35:54.331552Z",
"updated_at": "2022-09-04T14:35:54.331582Z",
"structure_string": "Mn1 Be2 Cu1\n1.0\n2.561254 0.000000 0.000000\n0.000000 2.561254 0.000000\n-0.000000 -0.000000 6.000970\nMn Be Cu\n1 2 1\ndirect\n0.499999 0.499999 0.780981 Mn\n0.000000 0.000000 0.023681 Be\n0.499999 0.499999 0.228549 Be\n0.000000 0.000000 0.466788 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Be",
"Cu"
],
"chemical_system": "Be-Cu-Mn",
"density": 5.758133737198282,
"density_atomic": 0.10160924780039386,
"volume": 39.36649553648694,
"volume_molar": 5.926764433715902,
"formula_full": "Mn1 Be2 Cu1",
"formula_reduced": "MnBe2Cu",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8813249728448271,
"spacegroup": 99
},
{
"id": "jvasp-74485",
"created_at": "2022-09-04T14:35:54.339595Z",
"updated_at": "2022-09-04T14:35:54.339605Z",
"structure_string": "Sr1 Be2 Zn1\n1.0\n-2.341518 2.341518 3.311727\n2.341518 -2.341518 3.311727\n2.341518 2.341518 -3.311727\nSr Be Zn\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Sr\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500000 Be\n0.750001 0.250000 0.500000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Be",
"Zn"
],
"chemical_system": "Be-Sr-Zn",
"density": 3.9108503292689036,
"density_atomic": 0.05507448817502039,
"volume": 72.62890918365795,
"volume_molar": 10.934537858731122,
"formula_full": "Sr1 Be2 Zn1",
"formula_reduced": "SrBe2Zn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5979660874999999,
"spacegroup": 216
}
]
}