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=848",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=846",
"results": [
{
"id": "jvasp-68831",
"created_at": "2022-09-04T14:36:06.923994Z",
"updated_at": "2022-09-04T14:36:06.924011Z",
"structure_string": "Be1 Zn1 Ga1\n1.0\n1.428753 -2.474671 -0.000000\n1.428753 2.474671 0.000000\n0.000000 0.000000 5.903555\nBe Zn Ga\n1 1 1\ndirect\n0.000000 0.000000 0.995096 Be\n0.333332 0.666666 0.691100 Zn\n0.666666 0.333332 0.313802 Ga\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Zn",
"Ga"
],
"chemical_system": "Be-Ga-Zn",
"density": 5.733607793470112,
"density_atomic": 0.0718626157388212,
"volume": 41.746323441707915,
"volume_molar": 8.38007453261509,
"formula_full": "Be1 Zn1 Ga1",
"formula_reduced": "BeZnGa",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2855480708333335,
"spacegroup": 156
},
{
"id": "jvasp-117637",
"created_at": "2022-09-04T14:38:52.696335Z",
"updated_at": "2022-09-04T14:38:52.696362Z",
"structure_string": "Be1 Zn1 Br1\n1.0\n4.796897 -0.000000 -0.000000\n-2.398449 4.154235 0.000000\n0.000000 0.000000 3.170008\nBe Zn Br\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.666666 0.333333 0.000000 Zn\n0.333332 0.666666 0.000000 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Zn",
"Br"
],
"chemical_system": "Be-Br-Zn",
"density": 4.056711127696991,
"density_atomic": 0.047490795330004144,
"volume": 63.170136005379426,
"volume_molar": 12.680648361757969,
"formula_full": "Be1 Zn1 Br1",
"formula_reduced": "BeZnBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2859302016666665,
"spacegroup": 187
},
{
"id": "jvasp-85693",
"created_at": "2022-09-04T14:35:59.397096Z",
"updated_at": "2022-09-04T14:35:59.397113Z",
"structure_string": "Ca10 Ge6 H2\n1.0\n-3.854260 3.854260 7.193156\n3.854260 -3.854260 7.193156\n3.854260 3.854260 -7.193156\nCa Ge H\n10 6 2\ndirect\n0.500000 0.500000 0.000000 Ca\n0.315804 0.482696 0.500000 Ca\n0.815804 0.315804 0.833108 Ca\n0.482697 0.982697 0.166892 Ca\n0.684197 0.517304 0.500000 Ca\n0.982697 0.815804 0.500000 Ca\n0.184197 0.684197 0.166892 Ca\n0.517304 0.017304 0.833108 Ca\n0.000000 0.000000 0.000000 Ca\n0.017304 0.184196 0.500000 Ca\n0.250000 0.250000 0.000000 Ge\n0.750000 0.750000 0.000000 Ge\n0.881480 0.381480 0.262960 Ge\n0.118520 0.618520 0.737040 Ge\n0.381480 0.118520 0.500000 Ge\n0.618521 0.881480 0.500000 Ge\n0.250000 0.750000 0.500000 H\n0.750000 0.250000 0.500000 H\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ca",
"Ge",
"H"
],
"chemical_system": "Ca-Ge-H",
"density": 3.258074798334129,
"density_atomic": 0.04211249951304605,
"volume": 427.4265410065193,
"volume_molar": 14.300126636117618,
"formula_full": "Ca10 Ge6 H2",
"formula_reduced": "Ca5Ge3H",
"formula_anonymous": "AB3C5",
"energy_above_hull": 0.2859322166666665,
"spacegroup": 140
},
{
"id": "jvasp-47737",
"created_at": "2022-09-04T14:38:34.229470Z",
"updated_at": "2022-09-04T14:38:34.229496Z",
"structure_string": "Bi4 O4 F4\n1.0\n0.000000 5.798048 0.015803\n5.850257 0.000000 0.000000\n0.000000 -0.682755 -6.026717\nBi O F\n4 4 4\ndirect\n0.756526 0.542363 0.302008 Bi\n0.756526 0.957638 0.802009 Bi\n0.243474 0.042362 0.197992 Bi\n0.243474 0.457638 0.697993 Bi\n0.928349 0.822369 0.124236 O\n0.928348 0.677631 0.624236 O\n0.071651 0.322369 0.375765 O\n0.071651 0.177631 0.875765 O\n0.560339 0.244799 0.022758 F\n0.560338 0.255202 0.522758 F\n0.439661 0.744799 0.477243 F\n0.439661 0.755202 0.977243 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Bi",
"O",
"F"
],
"chemical_system": "Bi-F-O",
"density": 7.929698725546424,
"density_atomic": 0.058718887138032486,
"volume": 204.36354612428522,
"volume_molar": 10.255883674776651,
"formula_full": "Bi4 O4 F4",
"formula_reduced": "BiOF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2860626941666668,
"spacegroup": 14
},
{
"id": "jvasp-37740",
"created_at": "2022-09-04T14:38:12.221899Z",
"updated_at": "2022-09-04T14:38:12.221919Z",
"structure_string": "Ho1 Tm1 Tl2\n1.0\n0.000000 3.744020 3.744020\n3.744020 -0.000000 3.744020\n3.744020 3.744020 0.000000\nHo Tm Tl\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Ho\n0.750001 0.750001 0.750001 Tm\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ho",
"Tm",
"Tl"
],
"chemical_system": "Ho-Tl-Tm",
"density": 11.748374231119305,
"density_atomic": 0.038107943762285885,
"volume": 104.9649916813056,
"volume_molar": 15.802848869426287,
"formula_full": "Ho1 Tm1 Tl2",
"formula_reduced": "HoTmTl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2862012541666666,
"spacegroup": 225
},
{
"id": "jvasp-114635",
"created_at": "2022-09-04T14:38:42.663760Z",
"updated_at": "2022-09-04T14:38:42.663791Z",
"structure_string": "Ba1 Ag1 S1\n1.0\n5.399617 0.000000 -0.000000\n-2.699809 4.676206 0.000000\n0.000000 -0.000000 4.411864\nBa Ag S\n1 1 1\ndirect\n0.333334 0.666668 0.000000 Ba\n0.000000 0.000000 0.000000 Ag\n0.666667 0.333334 0.000000 S\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Ag",
"S"
],
"chemical_system": "Ag-Ba-S",
"density": 4.13292878936771,
"density_atomic": 0.026930384089634794,
"volume": 111.39833691249382,
"volume_molar": 22.361882177231386,
"formula_full": "Ba1 Ag1 S1",
"formula_reduced": "BaAgS",
"formula_anonymous": "ABC",
"energy_above_hull": 0.28623441,
"spacegroup": 187
},
{
"id": "jvasp-103746",
"created_at": "2022-09-04T14:36:53.240568Z",
"updated_at": "2022-09-04T14:36:53.240590Z",
"structure_string": "Al1 Fe1 F5\n1.0\n4.984451 -0.009568 -1.443887\n-0.918467 3.229785 -3.956584\n-0.009683 0.009568 5.189361\nAl Fe F\n1 1 5\ndirect\n0.499999 0.499999 -0.000001 Al\n0.000000 0.000000 0.000000 Fe\n0.793901 0.499999 0.293900 F\n0.206099 0.500000 0.706099 F\n0.258266 0.258266 -0.000000 F\n0.741733 0.741732 -0.000001 F\n0.500000 0.000000 0.500000 F\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Al",
"Fe",
"F"
],
"chemical_system": "Al-F-Fe",
"density": 3.5297874225874266,
"density_atomic": 0.08367975848641562,
"volume": 83.65224908167444,
"volume_molar": 7.19665169800606,
"formula_full": "Al1 Fe1 F5",
"formula_reduced": "AlFeF5",
"formula_anonymous": "ABC5",
"energy_above_hull": 0.2862699589285712,
"spacegroup": 71
},
{
"id": "jvasp-119967",
"created_at": "2022-09-04T14:38:54.053044Z",
"updated_at": "2022-09-04T14:38:54.053066Z",
"structure_string": "Ba2 Se1\n1.0\n4.604289 0.576321 0.454824\n-3.715804 -8.460516 0.544500\n0.120741 2.255434 -4.080668\nBa Se\n2 1\ndirect\n0.522301 0.603729 0.521611 Ba\n0.522388 0.103692 0.521861 Ba\n0.022455 0.103730 0.021891 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ba",
"Se"
],
"chemical_system": "Ba-Se",
"density": 4.156843546540877,
"density_atomic": 0.021237646385508784,
"volume": 141.25859078466476,
"volume_molar": 28.355970575483003,
"formula_full": "Ba2 Se1",
"formula_reduced": "Ba2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 0.2863919899999999,
"spacegroup": 123
},
{
"id": "jvasp-100236",
"created_at": "2022-09-04T14:36:43.621495Z",
"updated_at": "2022-09-04T14:36:43.621506Z",
"structure_string": "Tb1 Ga1 Au2\n1.0\n4.210240 0.000000 2.430783\n1.403414 3.969452 2.430783\n-0.000000 -0.000000 4.861567\nTb Ga Au\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Tb\n0.500000 0.500000 0.500000 Ga\n0.749999 0.750000 0.750000 Au\n0.250000 0.250000 0.250000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tb",
"Ga",
"Au"
],
"chemical_system": "Au-Ga-Tb",
"density": 12.724233129238366,
"density_atomic": 0.0492318672949745,
"volume": 81.24818780554993,
"volume_molar": 12.232200586498431,
"formula_full": "Tb1 Ga1 Au2",
"formula_reduced": "TbGaAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.28641896625,
"spacegroup": 225
},
{
"id": "jvasp-68424",
"created_at": "2022-09-04T14:36:02.040437Z",
"updated_at": "2022-09-04T14:36:02.040464Z",
"structure_string": "Sr1 Be1 Cl1\n1.0\n2.074248 -3.592704 -0.000000\n2.074248 3.592704 0.000000\n-0.000000 0.000000 6.544101\nSr Be Cl\n1 1 1\ndirect\n0.666667 0.333334 0.355821 Sr\n0.000000 -0.000000 0.040452 Be\n0.333334 0.666667 0.603726 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Be",
"Cl"
],
"chemical_system": "Be-Cl-Sr",
"density": 2.2487495514040594,
"density_atomic": 0.030758074748813286,
"volume": 97.53536346145158,
"volume_molar": 19.579056261420742,
"formula_full": "Sr1 Be1 Cl1",
"formula_reduced": "SrBeCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2864854924999998,
"spacegroup": 156
},
{
"id": "jvasp-17753",
"created_at": "2022-09-04T14:38:16.651065Z",
"updated_at": "2022-09-04T14:38:16.651091Z",
"structure_string": "Ce2 S2\n1.0\n4.036876 -0.000000 -0.000000\n0.000000 4.036876 -0.000000\n0.000000 0.000000 5.687693\nCe S\n2 2\ndirect\n0.000000 0.500000 0.250035 Ce\n0.500000 0.000000 0.749964 Ce\n0.500000 0.000000 0.249961 S\n0.000000 0.500000 0.750039 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ce",
"S"
],
"chemical_system": "Ce-S",
"density": 6.169320791279241,
"density_atomic": 0.04315518926190147,
"volume": 92.68873728544402,
"volume_molar": 13.954615569990105,
"formula_full": "Ce2 S2",
"formula_reduced": "CeS",
"formula_anonymous": "AB",
"energy_above_hull": 0.28651275,
"spacegroup": 225
},
{
"id": "jvasp-13886",
"created_at": "2022-09-04T14:37:57.049767Z",
"updated_at": "2022-09-04T14:37:57.049786Z",
"structure_string": "Ce2 S2\n1.0\n4.036876 -0.000000 -0.000000\n0.000000 4.036876 -0.000000\n0.000000 0.000000 5.687693\nCe S\n2 2\ndirect\n0.000000 0.500000 0.250035 Ce\n0.500000 0.000000 0.749964 Ce\n0.500000 0.000000 0.249961 S\n0.000000 0.500000 0.750039 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ce",
"S"
],
"chemical_system": "Ce-S",
"density": 6.169320791279241,
"density_atomic": 0.04315518926190147,
"volume": 92.68873728544402,
"volume_molar": 13.954615569990105,
"formula_full": "Ce2 S2",
"formula_reduced": "CeS",
"formula_anonymous": "AB",
"energy_above_hull": 0.28651275,
"spacegroup": 225
}
]
}