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=-formula_anonymous&page=1116",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=1114",
"results": [
{
"id": "jvasp-101598",
"created_at": "2022-09-04T14:36:46.035764Z",
"updated_at": "2022-09-04T14:36:46.035787Z",
"structure_string": "Pm2 Ag1 Hg1\n1.0\n4.591477 0.000000 2.650890\n1.530492 4.328886 2.650890\n-0.000000 -0.000000 5.301780\nPm Ag Hg\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Pm\n0.750000 0.750001 0.750000 Pm\n0.500000 0.500001 0.500000 Ag\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Ag",
"Hg"
],
"chemical_system": "Ag-Hg-Pm",
"density": 9.430455169664395,
"density_atomic": 0.03795855983406333,
"volume": 105.37807591979482,
"volume_molar": 15.865040155174274,
"formula_full": "Pm2 Ag1 Hg1",
"formula_reduced": "Pm2AgHg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.503175098125,
"spacegroup": 225
},
{
"id": "jvasp-102556",
"created_at": "2022-09-04T14:36:46.070532Z",
"updated_at": "2022-09-04T14:36:46.070540Z",
"structure_string": "Sm1 Er1 Ir2\n1.0\n4.220636 -0.000000 2.436785\n1.406879 3.979254 2.436785\n0.000000 0.000000 4.873571\nSm Er Ir\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.500001 0.500000 0.500001 Er\n0.750001 0.749999 0.750001 Ir\n0.250000 0.250000 0.250000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sm",
"Er",
"Ir"
],
"chemical_system": "Er-Ir-Sm",
"density": 14.242693849408587,
"density_atomic": 0.04886896413368537,
"volume": 81.85154056176935,
"volume_molar": 12.323037467145614,
"formula_full": "Sm1 Er1 Ir2",
"formula_reduced": "SmErIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.81068276875,
"spacegroup": 225
},
{
"id": "jvasp-8733",
"created_at": "2022-09-04T14:37:05.810302Z",
"updated_at": "2022-09-04T14:37:05.810324Z",
"structure_string": "Na2 Cl2 O4\n1.0\n4.315040 0.004390 1.523744\n-0.399912 4.296471 1.523744\n0.054969 0.060385 6.426104\nNa Cl O\n2 2 4\ndirect\n0.371304 0.628697 0.249999 Na\n0.628697 0.371304 0.749998 Na\n0.145735 0.854266 0.749998 Cl\n0.854266 0.145735 0.249999 Cl\n0.153757 0.570161 0.659935 O\n0.429840 0.846244 0.840062 O\n0.846244 0.429840 0.340062 O\n0.570161 0.153757 0.159936 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Na",
"Cl",
"O"
],
"chemical_system": "Cl-Na-O",
"density": 2.5378325048611967,
"density_atomic": 0.06759362844553708,
"volume": 118.35435060933182,
"volume_molar": 8.90933198659735,
"formula_full": "Na2 Cl2 O4",
"formula_reduced": "NaClO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9700088029166664,
"spacegroup": 15
},
{
"id": "jvasp-15281",
"created_at": "2022-09-04T14:36:46.219663Z",
"updated_at": "2022-09-04T14:36:46.219686Z",
"structure_string": "Zr4 Al2 C2\n1.0\n1.666042 -2.885669 -0.000000\n1.666042 2.885669 0.000000\n0.000000 -0.000000 14.600069\nZr Al C\n4 2 2\ndirect\n0.333332 0.666667 0.086839 Zr\n0.666667 0.333332 0.586839 Zr\n0.666667 0.333332 0.913161 Zr\n0.333332 0.666667 0.413161 Zr\n0.333332 0.666667 0.750000 Al\n0.666667 0.333332 0.250000 Al\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Zr",
"Al",
"C"
],
"chemical_system": "Al-C-Zr",
"density": 5.238636570929546,
"density_atomic": 0.056986583885524585,
"volume": 140.3839194163754,
"volume_molar": 10.567646539573872,
"formula_full": "Zr4 Al2 C2",
"formula_reduced": "Zr2AlC",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.89902795,
"spacegroup": 194
},
{
"id": "jvasp-15584",
"created_at": "2022-09-04T14:36:52.500100Z",
"updated_at": "2022-09-04T14:36:52.500118Z",
"structure_string": "Pr2 Si4 Ni2\n1.0\n4.102393 0.000000 -0.000000\n-0.000000 4.077081 -1.024619\n-0.000000 -0.022376 8.534866\nPr Si Ni\n2 4 2\ndirect\n0.250000 0.893814 0.787630 Pr\n0.749999 0.106185 0.212370 Pr\n0.250000 0.249707 0.499414 Si\n0.749999 0.750292 0.500586 Si\n0.749999 0.458663 0.917326 Si\n0.250000 0.541337 0.082674 Si\n0.749999 0.317746 0.635494 Ni\n0.250000 0.682253 0.364506 Ni\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Pr",
"Si",
"Ni"
],
"chemical_system": "Ni-Pr-Si",
"density": 5.954360234866761,
"density_atomic": 0.0560780515032914,
"volume": 142.6583090093716,
"volume_molar": 10.73885521797515,
"formula_full": "Pr2 Si4 Ni2",
"formula_reduced": "PrSi2Ni",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.0516973625,
"spacegroup": 63
},
{
"id": "jvasp-102554",
"created_at": "2022-09-04T14:36:45.761089Z",
"updated_at": "2022-09-04T14:36:45.761110Z",
"structure_string": "Sc2 Tl1 Zn1\n1.0\n4.249645 -0.000000 2.453534\n1.416548 4.006604 2.453534\n-0.000000 -0.000000 4.907068\nSc Tl Zn\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Sc\n0.750001 0.749999 0.749999 Sc\n0.500001 0.500000 0.499999 Tl\n0.000000 0.000000 0.000000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Tl",
"Zn"
],
"chemical_system": "Sc-Tl-Zn",
"density": 7.148968208534899,
"density_atomic": 0.04787500613191756,
"volume": 83.55090313676763,
"volume_molar": 12.578882482868504,
"formula_full": "Sc2 Tl1 Zn1",
"formula_reduced": "Sc2TlZn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6608533749999999,
"spacegroup": 225
},
{
"id": "jvasp-71570",
"created_at": "2022-09-04T14:36:09.478020Z",
"updated_at": "2022-09-04T14:36:09.478045Z",
"structure_string": "Be1 Tl2 Se1\n1.0\n3.331203 0.000000 -0.000000\n0.000000 3.331203 0.000000\n-0.000000 -0.000000 8.891638\nBe Tl Se\n1 2 1\ndirect\n0.000000 0.000000 0.644693 Be\n0.000000 0.000000 0.965247 Tl\n0.500000 0.500000 0.264864 Tl\n0.500000 0.500000 0.625196 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Tl",
"Se"
],
"chemical_system": "Be-Se-Tl",
"density": 8.359748161377235,
"density_atomic": 0.04053927898334507,
"volume": 98.66973711208178,
"volume_molar": 14.85507614102881,
"formula_full": "Be1 Tl2 Se1",
"formula_reduced": "BeTl2Se",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4877361666666666,
"spacegroup": 99
},
{
"id": "jvasp-71412",
"created_at": "2022-09-04T14:36:08.605731Z",
"updated_at": "2022-09-04T14:36:08.605759Z",
"structure_string": "Hf1 Mn1 Be2\n1.0\n2.972994 0.000000 0.000000\n0.000000 2.972994 -0.000000\n0.000000 -0.000000 5.421879\nHf Mn Be\n1 1 2\ndirect\n0.499999 0.499999 0.000000 Hf\n0.499999 0.499999 0.500000 Mn\n0.000000 0.000000 0.686958 Be\n0.000000 0.000000 0.313042 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Mn",
"Be"
],
"chemical_system": "Be-Hf-Mn",
"density": 8.712985904854339,
"density_atomic": 0.08346840308387993,
"volume": 47.92232572103097,
"volume_molar": 7.214874775965425,
"formula_full": "Hf1 Mn1 Be2",
"formula_reduced": "HfMnBe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.3386981103448274,
"spacegroup": 123
},
{
"id": "jvasp-69069",
"created_at": "2022-09-04T14:36:08.609462Z",
"updated_at": "2022-09-04T14:36:08.609478Z",
"structure_string": "Ba2 Sr1 Si1\n1.0\n0.000000 4.226266 4.226266\n4.226266 0.000000 4.226266\n4.226266 4.226266 -0.000000\nBa Sr Si\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750001 0.750001 0.750001 Ba\n0.500001 0.500001 0.500001 Sr\n0.000000 0.000000 0.000000 Si\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Sr",
"Si"
],
"chemical_system": "Ba-Si-Sr",
"density": 4.293518821011134,
"density_atomic": 0.026494730836343048,
"volume": 150.97341523142276,
"volume_molar": 22.729578938538896,
"formula_full": "Ba2 Sr1 Si1",
"formula_reduced": "Ba2SrSi",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5212567124999998,
"spacegroup": 225
},
{
"id": "jvasp-70787",
"created_at": "2022-09-04T14:36:08.641886Z",
"updated_at": "2022-09-04T14:36:08.641901Z",
"structure_string": "Be1 Ga2 Br1\n1.0\n3.423760 0.000000 0.000000\n0.000000 3.423760 0.000000\n0.000000 0.000000 7.027264\nBe Ga Br\n1 2 1\ndirect\n0.000000 0.000000 0.464410 Be\n0.000000 0.000000 0.087829 Ga\n0.500000 0.500000 0.273236 Ga\n0.500000 0.500000 0.674523 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Ga",
"Br"
],
"chemical_system": "Be-Br-Ga",
"density": 4.603417714791273,
"density_atomic": 0.048558704812394646,
"volume": 82.37451998470513,
"volume_molar": 12.401773859633185,
"formula_full": "Be1 Ga2 Br1",
"formula_reduced": "BeGa2Br",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.27291621375,
"spacegroup": 99
},
{
"id": "jvasp-74636",
"created_at": "2022-09-04T14:36:08.677991Z",
"updated_at": "2022-09-04T14:36:08.678018Z",
"structure_string": "Sc1 Be2 Bi1\n1.0\n-1.947792 1.947792 4.572819\n1.947792 -1.947792 4.572819\n1.947792 1.947792 -4.572819\nSc Be Bi\n1 2 1\ndirect\n0.750000 0.250000 0.499999 Sc\n0.000000 0.000000 0.000000 Be\n0.250000 0.750000 0.499999 Be\n0.500000 0.500000 0.000000 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Be",
"Bi"
],
"chemical_system": "Be-Bi-Sc",
"density": 6.507677926922108,
"density_atomic": 0.05764091057078151,
"volume": 69.3951563289082,
"volume_molar": 10.44768498687225,
"formula_full": "Sc1 Be2 Bi1",
"formula_reduced": "ScBe2Bi",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8487129375,
"spacegroup": 119
},
{
"id": "jvasp-74677",
"created_at": "2022-09-04T14:36:08.707112Z",
"updated_at": "2022-09-04T14:36:08.707140Z",
"structure_string": "Be2 Si1 Mo1\n1.0\n3.171262 0.000000 0.000000\n-0.000000 3.171262 0.000000\n-0.000000 0.000000 4.848476\nBe Si Mo\n2 1 1\ndirect\n0.000000 0.000000 0.768985 Be\n0.000000 0.000000 0.231016 Be\n0.500000 0.500000 0.500000 Si\n0.500000 0.500000 0.000000 Mo\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Si",
"Mo"
],
"chemical_system": "Be-Mo-Si",
"density": 4.837493810396372,
"density_atomic": 0.08203335882645582,
"volume": 48.76065124265029,
"volume_molar": 7.341087633312724,
"formula_full": "Be2 Si1 Mo1",
"formula_reduced": "Be2SiMo",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.230369175,
"spacegroup": 123
}
]
}