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=114",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=updated_at&page=112",
"results": [
{
"id": "jvasp-62836",
"created_at": "2022-09-04T14:35:44.442830Z",
"updated_at": "2022-09-04T14:35:44.442855Z",
"structure_string": "Tb4 Fe3 B6\n1.0\n7.346332 -2.644146 -0.073926\n7.346332 2.644146 -0.073926\n6.439807 0.000000 4.415254\nTb Fe B\n4 3 6\ndirect\n0.257910 0.257910 0.257909 Tb\n0.742091 0.742091 0.742088 Tb\n0.409259 0.409259 0.409257 Tb\n0.590742 0.590742 0.590740 Tb\n0.000000 0.000000 0.000000 Fe\n0.108723 0.108723 0.108723 Fe\n0.891278 0.891278 0.891275 Fe\n0.500000 0.832726 0.167273 B\n0.167275 0.500001 0.832724 B\n0.832727 0.167274 0.499999 B\n0.500001 0.167275 0.832724 B\n0.832726 0.500000 0.167273 B\n0.167274 0.832727 0.499999 B\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Tb",
"Fe",
"B"
],
"chemical_system": "B-Fe-Tb",
"density": 8.282290753538257,
"density_atomic": 0.07469194529974507,
"volume": 174.0482182895345,
"volume_molar": 8.062637458206027,
"formula_full": "Tb4 Fe3 B6",
"formula_reduced": "Tb4(FeB2)3",
"formula_anonymous": "A3B4C6",
"energy_above_hull": 4.025848123076924,
"spacegroup": 166
},
{
"id": "jvasp-5059",
"created_at": "2022-09-04T14:35:44.448628Z",
"updated_at": "2022-09-04T14:35:44.448656Z",
"structure_string": "Dy3 Mn3 Ga2 Si1\n1.0\n3.516819 -6.091309 0.000000\n3.516819 6.091309 0.000000\n0.000000 0.000000 3.941765\nDy Mn Ga Si\n3 3 2 1\ndirect\n0.407886 0.000000 0.000000 Dy\n0.592114 0.592114 0.000000 Dy\n0.000000 0.407886 0.000000 Dy\n0.218326 0.218326 0.500001 Mn\n0.000000 0.781675 0.500001 Mn\n0.781675 0.000000 0.500001 Mn\n0.666667 0.333333 0.500001 Ga\n0.333333 0.666667 0.500001 Ga\n0.000000 0.000000 0.000000 Si\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Dy",
"Mn",
"Ga",
"Si"
],
"chemical_system": "Dy-Ga-Mn-Si",
"density": 8.061202178008505,
"density_atomic": 0.053291891716671674,
"volume": 168.8812258316675,
"volume_molar": 11.300294596440553,
"formula_full": "Dy3 Mn3 Ga2 Si1",
"formula_reduced": "Dy3Mn3Ga2Si",
"formula_anonymous": "AB2C3D3",
"energy_above_hull": 2.488400497126436,
"spacegroup": 189
},
{
"id": "jvasp-69833",
"created_at": "2022-09-04T14:35:44.449463Z",
"updated_at": "2022-09-04T14:35:44.449481Z",
"structure_string": "Ta1 Be1 Pt1\n1.0\n1.434653 -2.484892 0.000000\n1.434653 2.484892 -0.000000\n-0.000000 -0.000000 6.140849\nTa Be Pt\n1 1 1\ndirect\n0.333332 0.666666 0.678995 Ta\n0.000000 0.000000 0.020318 Be\n0.666666 0.333332 0.300687 Pt\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ta",
"Be",
"Pt"
],
"chemical_system": "Be-Pt-Ta",
"density": 14.60315600852353,
"density_atomic": 0.0685185954541167,
"volume": 43.78373462148596,
"volume_molar": 8.789060429635793,
"formula_full": "Ta1 Be1 Pt1",
"formula_reduced": "TaBePt",
"formula_anonymous": "ABC",
"energy_above_hull": 3.269485566666666,
"spacegroup": 156
},
{
"id": "jvasp-72086",
"created_at": "2022-09-04T14:35:44.453886Z",
"updated_at": "2022-09-04T14:35:44.453912Z",
"structure_string": "Be1 Zn1 Os2\n1.0\n-1.956139 1.956139 3.445424\n1.956139 -1.956139 3.445424\n1.956139 1.956139 -3.445424\nBe Zn Os\n1 1 2\ndirect\n0.750000 0.250000 0.500000 Be\n0.499999 0.499999 0.000000 Zn\n0.000000 0.000000 0.000000 Os\n0.250000 0.750000 0.500000 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Zn",
"Os"
],
"chemical_system": "Be-Os-Zn",
"density": 14.32336235151623,
"density_atomic": 0.07585040461587969,
"volume": 52.73538117900268,
"volume_molar": 7.9394972123052225,
"formula_full": "Be1 Zn1 Os2",
"formula_reduced": "BeZnOs2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.101029125,
"spacegroup": 119
},
{
"id": "jvasp-21207",
"created_at": "2022-09-04T14:35:44.454259Z",
"updated_at": "2022-09-04T14:35:44.454279Z",
"structure_string": "Rb1\n1.0\n4.528429 0.000000 -1.601041\n-2.264215 3.921736 -1.601041\n-0.000000 -0.000000 4.803125\nRb\n1\ndirect\n0.000000 0.000000 0.000000 Rb\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Rb"
],
"chemical_system": "Rb",
"density": 1.6638026648009627,
"density_atomic": 0.011723308483144615,
"volume": 85.30015237914851,
"volume_molar": 51.36895244766812,
"formula_full": "Rb1",
"formula_reduced": "Rb",
"formula_anonymous": "A",
"energy_above_hull": 0.0310099999999999,
"spacegroup": 229
},
{
"id": "jvasp-71100",
"created_at": "2022-09-04T14:35:44.454750Z",
"updated_at": "2022-09-04T14:35:44.454768Z",
"structure_string": "Be2 Hg1 Br1\n1.0\n3.146796 0.000000 0.000000\n0.000000 3.146796 0.000000\n-0.000000 0.000000 7.973239\nBe Hg Br\n2 1 1\ndirect\n0.000000 0.000000 0.189218 Be\n0.500001 0.500001 0.079332 Be\n0.500001 0.500001 0.778867 Hg\n0.000000 0.000000 0.452584 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Hg",
"Br"
],
"chemical_system": "Be-Br-Hg",
"density": 6.278388545556581,
"density_atomic": 0.050662664867585167,
"volume": 78.95360440384707,
"volume_molar": 11.886742980733073,
"formula_full": "Be2 Hg1 Br1",
"formula_reduced": "Be2HgBr",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.715625300625,
"spacegroup": 99
},
{
"id": "jvasp-90865",
"created_at": "2022-09-04T14:35:44.456967Z",
"updated_at": "2022-09-04T14:35:44.456985Z",
"structure_string": "Ba1 Mg1 C2 O4\n1.0\n3.517213 2.607048 -0.960767\n-3.517213 2.607048 0.960767\n0.266880 -2.607048 5.952439\nBa Mg C O\n1 1 2 4\ndirect\n0.500000 0.500000 0.500000 Ba\n0.500000 0.000000 -0.000000 Mg\n0.084460 0.230177 0.814636 C\n0.915541 0.769824 0.185364 C\n0.243213 0.895316 0.216620 O\n0.178697 0.526594 0.783381 O\n0.756787 0.104684 0.783380 O\n0.821304 0.473406 0.216619 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Ba",
"Mg",
"C",
"O"
],
"chemical_system": "Ba-C-Mg-O",
"density": 3.751657061644015,
"density_atomic": 0.07239869070430614,
"volume": 110.49923585875256,
"volume_molar": 8.318024402673093,
"formula_full": "Ba1 Mg1 C2 O4",
"formula_reduced": "BaMg(CO2)2",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.7812761274999995,
"spacegroup": 12
},
{
"id": "jvasp-68963",
"created_at": "2022-09-04T14:35:44.457046Z",
"updated_at": "2022-09-04T14:35:44.457071Z",
"structure_string": "Ba1 Li1 Ca2\n1.0\n4.144148 0.000000 0.000000\n0.000000 4.143898 0.000000\n0.000000 0.000000 9.399925\nBa Li Ca\n1 1 2\ndirect\n0.500000 0.500000 0.714840 Ba\n0.000000 0.000000 0.468006 Li\n0.000000 0.000000 0.028077 Ca\n0.500000 0.500000 0.289077 Ca\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Li",
"Ca"
],
"chemical_system": "Ba-Ca-Li",
"density": 2.3086053289242243,
"density_atomic": 0.024779428679414444,
"volume": 161.42422215420194,
"volume_molar": 24.302984697152862,
"formula_full": "Ba1 Li1 Ca2",
"formula_reduced": "BaLiCa2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.250000000000475e-05,
"spacegroup": 99
},
{
"id": "jvasp-14928",
"created_at": "2022-09-04T14:35:44.459277Z",
"updated_at": "2022-09-04T14:35:44.459305Z",
"structure_string": "Mn3 Nb3 Si3\n1.0\n3.223518 -5.583297 -0.000000\n3.223518 5.583297 0.000000\n0.000000 0.000000 3.494995\nMn Nb Si\n3 3 3\ndirect\n0.245335 -0.000000 0.000000 Mn\n-0.000000 0.245335 0.000000 Mn\n0.754666 0.754666 0.000000 Mn\n0.410928 0.410928 0.499999 Nb\n-0.000000 0.589072 0.499999 Nb\n0.589072 -0.000000 0.499999 Nb\n0.000000 0.000000 0.499999 Si\n0.333333 0.666667 0.000000 Si\n0.666667 0.333333 0.000000 Si\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Mn",
"Nb",
"Si"
],
"chemical_system": "Mn-Nb-Si",
"density": 6.9664686195776895,
"density_atomic": 0.07153937223877829,
"volume": 125.80485008954975,
"volume_molar": 8.41793906144408,
"formula_full": "Mn3 Nb3 Si3",
"formula_reduced": "MnNbSi",
"formula_anonymous": "ABC",
"energy_above_hull": 3.6488284137931024,
"spacegroup": 189
},
{
"id": "jvasp-69369",
"created_at": "2022-09-04T14:35:44.459937Z",
"updated_at": "2022-09-04T14:35:44.459965Z",
"structure_string": "K2 Ba1 Zn1\n1.0\n4.230659 -0.000000 0.000000\n-0.000000 4.230659 -0.000000\n0.000000 -0.000000 11.013340\nK Ba Zn\n2 1 1\ndirect\n0.000000 0.000000 0.989886 K\n0.500000 0.500000 0.318564 K\n0.500000 0.500000 0.671703 Ba\n0.000000 0.000000 0.519847 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Ba",
"Zn"
],
"chemical_system": "Ba-K-Zn",
"density": 2.3665525132939855,
"density_atomic": 0.020292002218202144,
"volume": 197.1219969812519,
"volume_molar": 29.677410317834852,
"formula_full": "K2 Ba1 Zn1",
"formula_reduced": "K2BaZn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-52544",
"created_at": "2022-09-04T14:35:44.472641Z",
"updated_at": "2022-09-04T14:35:44.472675Z",
"structure_string": "Ba4 Y2 Br14\n1.0\n8.706621 4.279726 -0.477934\n-8.706621 4.279726 0.477934\n-6.415061 0.000000 8.799743\nBa Y Br\n4 2 14\ndirect\n0.306472 0.683647 0.721771 Ba\n0.316353 0.693528 0.221771 Ba\n0.683647 0.306472 0.778229 Ba\n0.693528 0.316353 0.278229 Ba\n0.963054 0.963054 0.750000 Y\n0.036947 0.036947 0.250000 Y\n0.927546 0.752694 0.063169 Br\n0.892754 0.641440 0.450771 Br\n0.399483 0.399483 0.250000 Br\n0.247307 0.072455 0.563169 Br\n0.641440 0.892754 0.049229 Br\n0.358561 0.107247 0.950770 Br\n0.107247 0.358561 0.549229 Br\n0.600518 0.600518 0.750000 Br\n0.688099 0.069408 0.652277 Br\n0.072455 0.247307 0.936831 Br\n0.311901 0.930593 0.347722 Br\n0.069408 0.688099 0.847722 Br\n0.752694 0.927546 0.436831 Br\n0.930593 0.311901 0.152278 Br\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Ba",
"Y",
"Br"
],
"chemical_system": "Ba-Br-Y",
"density": 4.868543783008239,
"density_atomic": 0.0317688178120782,
"volume": 629.548134850526,
"volume_molar": 18.956137416326648,
"formula_full": "Ba4 Y2 Br14",
"formula_reduced": "Ba2YBr7",
"formula_anonymous": "AB2C7",
"energy_above_hull": 0.0061366125,
"spacegroup": 15
},
{
"id": "jvasp-14876",
"created_at": "2022-09-04T14:35:44.473057Z",
"updated_at": "2022-09-04T14:35:44.473073Z",
"structure_string": "Hf2 Al2\n1.0\n3.109393 0.000000 -0.933880\n0.000000 4.295131 0.000000\n0.013489 0.000000 5.688279\nHf Al\n2 2\ndirect\n0.835348 0.250000 0.670698 Hf\n0.164651 0.750000 0.329302 Hf\n0.570375 0.250000 0.140753 Al\n0.429624 0.750000 0.859247 Al\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Hf",
"Al"
],
"chemical_system": "Al-Hf",
"density": 8.976119847162035,
"density_atomic": 0.05261600471309254,
"volume": 76.02249585105181,
"volume_molar": 11.44545427353875,
"formula_full": "Hf2 Al2",
"formula_reduced": "HfAl",
"formula_anonymous": "AB",
"energy_above_hull": 2.1888679000000004,
"spacegroup": 63
}
]
}