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=updated_at&page=281",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=updated_at&page=279",
"results": [
{
"id": "jvasp-5173",
"created_at": "2022-09-04T14:35:49.916157Z",
"updated_at": "2022-09-04T14:35:49.916175Z",
"structure_string": "Pb1 I2\n1.0\n2.294241 -3.973743 0.000000\n2.294241 3.973743 0.000000\n0.000000 -0.000000 7.030431\nPb I\n1 2\ndirect\n0.000000 0.000000 0.000000 Pb\n0.333333 0.666667 0.269404 I\n0.666667 0.333333 0.730596 I\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Pb",
"I"
],
"chemical_system": "I-Pb",
"density": 5.97183344087873,
"density_atomic": 0.023402944152455033,
"volume": 128.1889996599121,
"volume_molar": 25.732406661186097,
"formula_full": "Pb1 I2",
"formula_reduced": "PbI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 164
},
{
"id": "jvasp-70910",
"created_at": "2022-09-04T14:35:49.916701Z",
"updated_at": "2022-09-04T14:35:49.916717Z",
"structure_string": "Sc2 Be1 In1\n1.0\n3.129155 0.000000 0.000000\n0.000000 3.129155 0.000000\n0.000000 -0.000000 7.993622\nSc Be In\n2 1 1\ndirect\n0.000000 0.000000 0.994589 Sc\n0.500001 0.500001 0.292929 Sc\n0.000000 0.000000 0.504976 Be\n0.500001 0.500001 0.707506 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Be",
"In"
],
"chemical_system": "Be-In-Sc",
"density": 4.534623336161347,
"density_atomic": 0.051104863371370324,
"volume": 78.27043721715255,
"volume_molar": 11.783889756710884,
"formula_full": "Sc2 Be1 In1",
"formula_reduced": "Sc2BeIn",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6345741425,
"spacegroup": 99
},
{
"id": "jvasp-3342",
"created_at": "2022-09-04T14:35:49.919347Z",
"updated_at": "2022-09-04T14:35:49.919371Z",
"structure_string": "Ga2 Hg1 Te4\n1.0\n5.655916 -0.000000 -2.530076\n-1.131785 5.541520 -2.530076\n-0.075971 -0.093056 7.417031\nGa Hg Te\n2 1 4\ndirect\n0.500000 0.500000 -0.000001 Ga\n0.249999 0.750000 0.499999 Ga\n0.000000 0.000000 0.000000 Hg\n0.420656 0.388300 0.280227 Te\n0.611700 0.140428 0.719772 Te\n0.108072 0.579344 0.719772 Te\n0.859572 0.891927 0.280226 Te\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Ga",
"Hg",
"Te"
],
"chemical_system": "Ga-Hg-Te",
"density": 6.145156545155476,
"density_atomic": 0.030460726502600174,
"volume": 229.80410527642763,
"volume_molar": 19.77018098857866,
"formula_full": "Ga2 Hg1 Te4",
"formula_reduced": "Ga2HgTe4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.1436686166666665,
"spacegroup": 82
},
{
"id": "jvasp-105820",
"created_at": "2022-09-04T14:35:49.928222Z",
"updated_at": "2022-09-04T14:35:49.928248Z",
"structure_string": "Mg1 Pa1 Au2\n1.0\n4.273089 0.000000 2.467069\n1.424363 4.028707 2.467069\n-0.000000 -0.000000 4.934138\nMg Pa Au\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Pa\n0.750000 0.750001 0.750000 Au\n0.250000 0.250000 0.250000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Pa",
"Au"
],
"chemical_system": "Au-Mg-Pa",
"density": 12.692822538598707,
"density_atomic": 0.047091343178039986,
"volume": 84.94130194751617,
"volume_molar": 12.788211916640112,
"formula_full": "Mg1 Pa1 Au2",
"formula_reduced": "MgPaAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0702018225,
"spacegroup": 225
},
{
"id": "jvasp-74663",
"created_at": "2022-09-04T14:35:49.931342Z",
"updated_at": "2022-09-04T14:35:49.931364Z",
"structure_string": "Be2 Cu1 Os1\n1.0\n-1.632076 1.632076 4.030541\n1.632076 -1.632076 4.030541\n1.632076 1.632076 -4.030541\nBe Cu Os\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500001 Be\n0.500000 0.500000 0.000000 Cu\n0.750001 0.250000 0.500001 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cu",
"Os"
],
"chemical_system": "Be-Cu-Os",
"density": 10.509814239495029,
"density_atomic": 0.09314421776648339,
"volume": 42.94415795114812,
"volume_molar": 6.46539410003718,
"formula_full": "Be2 Cu1 Os1",
"formula_reduced": "Be2CuOs",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.3035394125,
"spacegroup": 119
},
{
"id": "jvasp-90229",
"created_at": "2022-09-04T14:35:49.937107Z",
"updated_at": "2022-09-04T14:35:49.937126Z",
"structure_string": "Mn3 As3 Pd3\n1.0\n0.000000 0.000000 -3.730185\n-3.342227 -5.788908 0.000000\n-3.342017 5.788786 0.000000\nMn As Pd\n3 3 3\ndirect\n0.500001 0.595604 0.000000 Mn\n0.500001 0.404368 0.404389 Mn\n0.500001 0.999980 0.595612 Mn\n0.000000 0.333302 0.666633 As\n0.000000 0.666669 0.333368 As\n0.500001 0.000021 0.000000 As\n0.000000 0.264476 0.000000 Pd\n0.000000 0.735532 0.735582 Pd\n0.000000 0.999951 0.264420 Pd\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Mn",
"As",
"Pd"
],
"chemical_system": "As-Mn-Pd",
"density": 8.154961677544112,
"density_atomic": 0.0623544958325308,
"volume": 144.3360238878659,
"volume_molar": 9.657909473238345,
"formula_full": "Mn3 As3 Pd3",
"formula_reduced": "MnAsPd",
"formula_anonymous": "ABC",
"energy_above_hull": 2.38776823045977,
"spacegroup": 189
},
{
"id": "jvasp-71649",
"created_at": "2022-09-04T14:35:49.938260Z",
"updated_at": "2022-09-04T14:35:49.938283Z",
"structure_string": "Be1 Ga2 Se1\n1.0\n-1.819344 1.819344 5.575517\n1.819344 -1.819344 5.575517\n1.819344 1.819344 -5.575517\nBe Ga Se\n1 2 1\ndirect\n0.749999 0.250000 0.499999 Be\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.000000 Ga\n0.250000 0.749999 0.499999 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Ga",
"Se"
],
"chemical_system": "Be-Ga-Se",
"density": 5.115634404748538,
"density_atomic": 0.05418576509901178,
"volume": 73.82012587052961,
"volume_molar": 11.11387972283117,
"formula_full": "Be1 Ga2 Se1",
"formula_reduced": "BeGa2Se",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6342835291666666,
"spacegroup": 139
},
{
"id": "jvasp-91278",
"created_at": "2022-09-04T14:35:49.941979Z",
"updated_at": "2022-09-04T14:35:49.941994Z",
"structure_string": "Mg1 Pb1 F6\n1.0\n4.638572 0.070780 3.203243\n1.718157 4.309211 3.203243\n0.102724 0.070780 5.636184\nMg Pb F\n1 1 6\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Pb\n0.388870 0.095904 0.759042 F\n0.095904 0.759041 0.388870 F\n0.240958 0.611129 0.904095 F\n0.904095 0.240958 0.611129 F\n0.611129 0.904096 0.240958 F\n0.759042 0.388871 0.095904 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Pb",
"F"
],
"chemical_system": "F-Mg-Pb",
"density": 5.219465028315315,
"density_atomic": 0.07278210096343773,
"volume": 109.917134763928,
"volume_molar": 8.274205718553299,
"formula_full": "Mg1 Pb1 F6",
"formula_reduced": "MgPbF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 148
},
{
"id": "jvasp-65151",
"created_at": "2022-09-04T14:35:49.942279Z",
"updated_at": "2022-09-04T14:35:49.942298Z",
"structure_string": "Be1 Nb4 W1\n1.0\n0.000000 3.771336 3.771336\n3.771336 -0.000000 3.771336\n3.771336 3.771336 -0.000000\nBe Nb W\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.126925 0.624359 0.624359 Nb\n0.624359 0.624359 0.624359 Nb\n0.624359 0.126925 0.624359 Nb\n0.624359 0.624359 0.126925 Nb\n0.250000 0.250000 0.250000 W\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Nb",
"W"
],
"chemical_system": "Be-Nb-W",
"density": 8.737359648839954,
"density_atomic": 0.055928809419198526,
"volume": 107.27923698551675,
"volume_molar": 10.767511095869665,
"formula_full": "Be1 Nb4 W1",
"formula_reduced": "BeNb4W",
"formula_anonymous": "ABC4",
"energy_above_hull": 5.972975616666667,
"spacegroup": 216
},
{
"id": "jvasp-92272",
"created_at": "2022-09-04T14:35:49.945766Z",
"updated_at": "2022-09-04T14:35:49.945795Z",
"structure_string": "Mg3 Bi3\n1.0\n3.949127 -0.000000 0.000000\n-1.974564 3.420045 0.000000\n0.000000 0.000000 12.411376\nMg Bi\n3 3\ndirect\n0.333334 0.666666 0.166667 Mg\n-0.000000 -0.000000 0.500000 Mg\n0.666668 0.333333 0.833333 Mg\n0.000000 0.000000 0.000000 Bi\n0.666668 0.333333 0.333333 Bi\n0.333334 0.666666 0.666667 Bi\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Bi"
],
"chemical_system": "Bi-Mg",
"density": 6.932742318154854,
"density_atomic": 0.03579302443030307,
"volume": 167.63042786963493,
"volume_molar": 16.82490053816614,
"formula_full": "Mg3 Bi3",
"formula_reduced": "MgBi",
"formula_anonymous": "AB",
"energy_above_hull": 0.3714389857142857,
"spacegroup": 166
},
{
"id": "jvasp-105885",
"created_at": "2022-09-04T14:35:49.948484Z",
"updated_at": "2022-09-04T14:35:49.948514Z",
"structure_string": "Zn6 Ag2\n1.0\n5.688374 -0.000000 -0.000000\n-2.844187 4.926277 0.000000\n0.000000 0.000000 4.429373\nZn Ag\n6 2\ndirect\n0.164383 0.328768 0.250000 Zn\n0.671232 0.835617 0.250000 Zn\n0.164383 0.835617 0.250000 Zn\n0.835616 0.671233 0.749999 Zn\n0.328767 0.164383 0.749999 Zn\n0.835616 0.164383 0.749999 Zn\n0.333333 0.666667 0.749999 Ag\n0.666666 0.333333 0.250000 Ag\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Zn",
"Ag"
],
"chemical_system": "Ag-Zn",
"density": 8.136533807879172,
"density_atomic": 0.06445264760046233,
"volume": 124.12213148467487,
"volume_molar": 9.343511840399247,
"formula_full": "Zn6 Ag2",
"formula_reduced": "Zn3Ag",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-68817",
"created_at": "2022-09-04T14:35:49.950548Z",
"updated_at": "2022-09-04T14:35:49.950575Z",
"structure_string": "Hf1 Be1 Se2\n1.0\n-1.822801 1.822801 5.652023\n1.822801 -1.822801 5.652023\n1.822801 1.822801 -5.652023\nHf Be Se\n1 1 2\ndirect\n0.750000 0.250000 0.500000 Hf\n0.500000 0.500000 0.000000 Be\n0.000000 0.000000 0.000000 Se\n0.250000 0.750000 0.500000 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Be",
"Se"
],
"chemical_system": "Be-Hf-Se",
"density": 7.635841281508448,
"density_atomic": 0.053249748777458396,
"volume": 75.11772528198807,
"volume_molar": 11.309237880478571,
"formula_full": "Hf1 Be1 Se2",
"formula_reduced": "HfBeSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.479183958333333,
"spacegroup": 119
}
]
}