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=chemical_system&page=486",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=484",
"results": [
{
"id": "jvasp-75525",
"created_at": "2022-09-04T14:35:57.356278Z",
"updated_at": "2022-09-04T14:35:57.356305Z",
"structure_string": "Zn2 As1 Ir1\n1.0\n-0.000000 3.137342 3.137342\n3.137342 0.000000 3.137342\n3.137342 3.137342 -0.000000\nZn As Ir\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Zn\n0.250000 0.250000 0.250000 Zn\n0.500000 0.500000 0.500000 As\n0.749999 0.749999 0.749999 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"As",
"Ir"
],
"chemical_system": "As-Ir-Zn",
"density": 10.699641414555707,
"density_atomic": 0.06476560177893495,
"volume": 61.761180165564404,
"volume_molar": 9.298363011518724,
"formula_full": "Zn2 As1 Ir1",
"formula_reduced": "Zn2AsIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9821659125,
"spacegroup": 216
},
{
"id": "jvasp-78855",
"created_at": "2022-09-04T14:37:10.643085Z",
"updated_at": "2022-09-04T14:37:10.643103Z",
"structure_string": "Zr1 As1 Ir1\n1.0\n3.777494 0.000000 2.180937\n1.259164 3.561455 2.180937\n-0.000000 -0.000000 4.361874\nZr As Ir\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Zr\n0.499999 0.500001 0.500001 As\n0.249999 0.250000 0.250000 Ir\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Zr",
"As",
"Ir"
],
"chemical_system": "As-Ir-Zr",
"density": 10.140687878440843,
"density_atomic": 0.05112306627000184,
"volume": 58.68192616138813,
"volume_molar": 11.779693980393526,
"formula_full": "Zr1 As1 Ir1",
"formula_reduced": "ZrAsIr",
"formula_anonymous": "ABC",
"energy_above_hull": 3.019179116666667,
"spacegroup": 216
},
{
"id": "jvasp-78854",
"created_at": "2022-09-04T14:36:36.708159Z",
"updated_at": "2022-09-04T14:36:36.708183Z",
"structure_string": "Zr1 As1 Ir1\n1.0\n3.746916 -0.000000 2.163283\n1.248972 3.532626 2.163283\n0.000000 -0.000000 4.326566\nZr As Ir\n1 1 1\ndirect\n0.500000 0.500001 0.500000 Zr\n0.250000 0.250000 0.250000 As\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Zr",
"As",
"Ir"
],
"chemical_system": "As-Ir-Zr",
"density": 10.390987567644006,
"density_atomic": 0.052384922245837434,
"volume": 57.2683869973365,
"volume_molar": 11.49594291987047,
"formula_full": "Zr1 As1 Ir1",
"formula_reduced": "ZrAsIr",
"formula_anonymous": "ABC",
"energy_above_hull": 3.196285783333333,
"spacegroup": 216
},
{
"id": "jvasp-115411",
"created_at": "2022-09-04T14:38:46.223672Z",
"updated_at": "2022-09-04T14:38:46.223699Z",
"structure_string": "Zr1 As1 Ir1\n1.0\n-0.000000 3.084440 3.084440\n3.084440 0.000000 3.084440\n3.084440 3.084440 0.000000\nZr As Ir\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Zr\n0.499999 0.499999 0.499999 As\n0.749999 0.749999 0.749999 Ir\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Zr",
"As",
"Ir"
],
"chemical_system": "As-Ir-Zr",
"density": 10.139412715148351,
"density_atomic": 0.051116637686626776,
"volume": 58.68930617838476,
"volume_molar": 11.781175430432357,
"formula_full": "Zr1 As1 Ir1",
"formula_reduced": "ZrAsIr",
"formula_anonymous": "ABC",
"energy_above_hull": 3.014225783333333,
"spacegroup": 216
},
{
"id": "jvasp-118863",
"created_at": "2022-09-04T14:38:50.372911Z",
"updated_at": "2022-09-04T14:38:50.372946Z",
"structure_string": "As1 S1 I1\n1.0\n3.092004 0.000000 0.000000\n-0.000000 3.092004 -0.000000\n0.000000 -0.000000 9.621378\nAs S I\n1 1 1\ndirect\n0.000000 0.000000 0.390350 As\n0.000000 0.000000 0.615938 S\n0.000000 0.000000 0.000985 I\n",
"nsites": 3,
"nelements": 3,
"elements": [
"As",
"S",
"I"
],
"chemical_system": "As-I-S",
"density": 4.222263827769309,
"density_atomic": 0.0326139862100809,
"volume": 91.98507599395217,
"volume_molar": 18.46490251516256,
"formula_full": "As1 S1 I1",
"formula_reduced": "AsSI",
"formula_anonymous": "ABC",
"energy_above_hull": 1.255472675,
"spacegroup": 99
},
{
"id": "jvasp-118864",
"created_at": "2022-09-04T14:38:29.761103Z",
"updated_at": "2022-09-04T14:38:29.761130Z",
"structure_string": "As1 S1 I1\n1.0\n-0.000000 3.438349 3.438349\n3.438349 -0.000000 3.438349\n3.438349 3.438349 -0.000000\nAs S I\n1 1 1\ndirect\n0.000000 0.000000 0.000000 As\n0.250000 0.250000 0.250000 S\n0.500000 0.500000 0.500000 I\n",
"nsites": 3,
"nelements": 3,
"elements": [
"As",
"S",
"I"
],
"chemical_system": "As-I-S",
"density": 4.777303945362055,
"density_atomic": 0.03690127650732771,
"volume": 81.29800060993206,
"volume_molar": 16.31960010598589,
"formula_full": "As1 S1 I1",
"formula_reduced": "AsSI",
"formula_anonymous": "ABC",
"energy_above_hull": 1.433972675,
"spacegroup": 216
},
{
"id": "jvasp-32329",
"created_at": "2022-09-04T14:37:52.896966Z",
"updated_at": "2022-09-04T14:37:52.896990Z",
"structure_string": "As1 S24 I3\n1.0\n12.589757 -0.035567 -6.975565\n-11.833716 4.297255 -6.975564\n-0.006309 -0.035567 14.393069\nAs S I\n1 24 3\ndirect\n0.294926 0.294926 0.294926 As\n0.176816 0.452707 0.452707 S\n0.638644 0.386436 0.774410 S\n0.386435 0.774410 0.638644 S\n0.386435 0.638644 0.774410 S\n0.638644 0.774410 0.386436 S\n0.774410 0.386436 0.638644 S\n0.637920 0.445476 0.099786 S\n0.445476 0.099785 0.637920 S\n0.099785 0.637920 0.445476 S\n0.099785 0.445476 0.637920 S\n0.445476 0.637920 0.099785 S\n0.637920 0.099785 0.445477 S\n0.761783 0.274505 0.895750 S\n0.274504 0.895750 0.761783 S\n0.274504 0.761783 0.895750 S\n0.761783 0.895750 0.274505 S\n0.895750 0.274505 0.761783 S\n0.010384 0.616522 0.616522 S\n0.616522 0.616522 0.010384 S\n0.616522 0.010384 0.616523 S\n0.774410 0.638644 0.386436 S\n0.452707 0.176816 0.452707 S\n0.452707 0.452707 0.176816 S\n0.895750 0.761783 0.274505 S\n0.954240 0.954240 0.116187 I\n0.116186 0.954240 0.954241 I\n0.954241 0.116187 0.954241 I\n",
"nsites": 28,
"nelements": 3,
"elements": [
"As",
"S",
"I"
],
"chemical_system": "As-I-S",
"density": 2.654677712047997,
"density_atomic": 0.03653553894882007,
"volume": 766.3770894203346,
"volume_molar": 16.48296681331558,
"formula_full": "As1 S24 I3",
"formula_reduced": "As(S8I)3",
"formula_anonymous": "AB3C24",
"energy_above_hull": 2.1441310919642858,
"spacegroup": 160
},
{
"id": "jvasp-59112",
"created_at": "2022-09-04T14:38:13.656412Z",
"updated_at": "2022-09-04T14:38:13.656436Z",
"structure_string": "As1 S24 I3\n1.0\n12.590150 -0.035666 -6.975802\n-11.834119 4.297297 -6.975802\n-0.006327 -0.035666 14.393528\nAs S I\n1 24 3\ndirect\n0.295155 0.295155 0.295155 As\n0.176752 0.452669 0.452669 S\n0.638626 0.386382 0.774386 S\n0.386382 0.774386 0.638627 S\n0.386382 0.638626 0.774386 S\n0.638626 0.774386 0.386382 S\n0.774385 0.386382 0.638626 S\n0.637907 0.445461 0.099742 S\n0.445461 0.099741 0.637907 S\n0.099742 0.637907 0.445462 S\n0.099742 0.445461 0.637907 S\n0.445462 0.637907 0.099742 S\n0.637906 0.099741 0.445461 S\n0.761751 0.274437 0.895715 S\n0.274438 0.895716 0.761753 S\n0.274437 0.761752 0.895716 S\n0.761752 0.895716 0.274438 S\n0.895715 0.274437 0.761752 S\n0.010269 0.616432 0.616432 S\n0.616432 0.616432 0.010269 S\n0.616431 0.010268 0.616431 S\n0.774386 0.638626 0.386382 S\n0.452669 0.176752 0.452669 S\n0.452669 0.452669 0.176753 S\n0.895716 0.761752 0.274438 S\n0.954513 0.954513 0.116467 I\n0.116467 0.954513 0.954513 I\n0.954511 0.116466 0.954512 I\n",
"nsites": 28,
"nelements": 3,
"elements": [
"As",
"S",
"I"
],
"chemical_system": "As-I-S",
"density": 2.654602681857701,
"density_atomic": 0.036534506330650474,
"volume": 766.3987504467665,
"volume_molar": 16.48343269099479,
"formula_full": "As1 S24 I3",
"formula_reduced": "As(S8I)3",
"formula_anonymous": "AB3C24",
"energy_above_hull": 2.1441307348214287,
"spacegroup": 160
},
{
"id": "jvasp-118862",
"created_at": "2022-09-04T14:38:29.740247Z",
"updated_at": "2022-09-04T14:38:29.740273Z",
"structure_string": "As1 S1 I2\n1.0\n4.323125 0.000000 0.000000\n0.000000 4.323125 0.000000\n0.000000 0.000000 6.089878\nAs S I\n1 1 2\ndirect\n0.499999 0.499999 0.502516 As\n0.000000 0.000000 0.002491 S\n0.000000 0.000000 0.502493 I\n0.499999 0.499999 0.002500 I\n",
"nsites": 4,
"nelements": 3,
"elements": [
"As",
"S",
"I"
],
"chemical_system": "As-I-S",
"density": 5.2638812023987835,
"density_atomic": 0.03514437407482178,
"volume": 113.81622536466485,
"volume_molar": 17.13543324794735,
"formula_full": "As1 S1 I2",
"formula_reduced": "AsSI2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.009653575,
"spacegroup": 123
},
{
"id": "jvasp-118866",
"created_at": "2022-09-04T14:38:52.396690Z",
"updated_at": "2022-09-04T14:38:52.396711Z",
"structure_string": "As1 Se1 I1\n1.0\n5.267987 0.000000 0.000000\n0.000000 5.267987 0.000000\n0.000000 -0.000000 10.736192\nAs Se I\n1 1 1\ndirect\n0.000000 0.000000 0.243526 As\n0.000000 0.000000 0.750266 Se\n0.000000 0.000000 -0.001839 I\n",
"nsites": 3,
"nelements": 3,
"elements": [
"As",
"Se",
"I"
],
"chemical_system": "As-I-Se",
"density": 1.5648942582645322,
"density_atomic": 0.01006888999269965,
"volume": 297.9474403012766,
"volume_molar": 59.80938081919949,
"formula_full": "As1 Se1 I1",
"formula_reduced": "AsSeI",
"formula_anonymous": "ABC",
"energy_above_hull": 1.5150371305555554,
"spacegroup": 99
},
{
"id": "jvasp-26828",
"created_at": "2022-09-04T14:38:28.289133Z",
"updated_at": "2022-09-04T14:38:28.289161Z",
"structure_string": "As4 Se4 I4\n1.0\n0.000000 8.952437 0.340480\n4.005038 0.000000 0.000000\n0.000000 -8.901638 -10.451747\nAs Se I\n4 4 4\ndirect\n0.498736 0.894179 0.137300 As\n0.501265 0.105821 0.862701 As\n0.498736 0.605821 0.637300 As\n0.501265 0.394179 0.362701 As\n0.281658 0.941125 0.187468 Se\n0.281658 0.558876 0.687468 Se\n0.718342 0.441124 0.312532 Se\n0.718342 0.058876 0.812532 Se\n0.798700 0.535256 0.079710 I\n0.798700 0.964744 0.579710 I\n0.201300 0.035256 0.420290 I\n0.201300 0.464744 0.920290 I\n",
"nsites": 12,
"nelements": 3,
"elements": [
"As",
"Se",
"I"
],
"chemical_system": "As-I-Se",
"density": 5.143374884668826,
"density_atomic": 0.03309365832959067,
"volume": 362.6072367245723,
"volume_molar": 18.1972651679168,
"formula_full": "As4 Se4 I4",
"formula_reduced": "AsSeI",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9439604638888888,
"spacegroup": 14
},
{
"id": "jvasp-118867",
"created_at": "2022-09-04T14:38:50.422201Z",
"updated_at": "2022-09-04T14:38:50.422226Z",
"structure_string": "As2 Se2 I2\n1.0\n6.631845 -1.977438 -0.063746\n6.631845 1.977438 -0.063746\n-5.623192 0.000000 6.875036\nAs Se I\n2 2 2\ndirect\n0.137321 0.137321 0.775159 As\n0.862679 0.862679 0.224840 As\n0.188072 0.188072 0.096009 Se\n0.811928 0.811928 0.903990 Se\n0.421789 0.421789 0.641996 I\n0.578210 0.578210 0.358004 I\n",
"nsites": 6,
"nelements": 3,
"elements": [
"As",
"Se",
"I"
],
"chemical_system": "As-I-Se",
"density": 5.212430778439932,
"density_atomic": 0.03353797985103323,
"volume": 178.90165199724015,
"volume_molar": 17.956182175398588,
"formula_full": "As2 Se2 I2",
"formula_reduced": "AsSeI",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9393271305555556,
"spacegroup": 12
}
]
}