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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=elements&page=3439",
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"results": [
{
"id": "jvasp-111839",
"created_at": "2022-09-04T14:38:39.099634Z",
"updated_at": "2022-09-04T14:38:39.099656Z",
"structure_string": "Tb4 Mg2 Se8\n1.0\n7.138753 -0.000000 4.121561\n2.379585 6.730481 4.121561\n0.000000 0.000000 8.243123\nTb Mg Se\n4 2 8\ndirect\n0.625000 0.125000 0.625000 Tb\n0.624999 0.625000 0.125000 Tb\n0.125000 0.625000 0.625000 Tb\n0.624999 0.625000 0.625000 Tb\n0.000000 0.000000 0.000000 Mg\n0.250000 0.250000 0.250000 Mg\n0.378957 0.378958 0.378958 Se\n0.863127 0.378958 0.378958 Se\n0.378957 0.863127 0.378958 Se\n0.378957 0.378958 0.863127 Se\n0.871041 0.871042 0.386873 Se\n0.871041 0.386873 0.871042 Se\n0.386872 0.871042 0.871042 Se\n0.871041 0.871042 0.871042 Se\n",
"nsites": 14,
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"elements": [
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"Mg",
"Se"
],
"chemical_system": "Mg-Se-Tb",
"density": 5.517494515555809,
"density_atomic": 0.03534824017646525,
"volume": 396.0593209197769,
"volume_molar": 17.036606999206494,
"formula_full": "Tb4 Mg2 Se8",
"formula_reduced": "Tb2MgSe4",
"formula_anonymous": "AB2C4",
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"spacegroup": 227
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{
"id": "jvasp-110073",
"created_at": "2022-09-04T14:38:26.820430Z",
"updated_at": "2022-09-04T14:38:26.820455Z",
"structure_string": "Tb4 Mg2 Si4\n1.0\n7.173953 -0.000000 0.000000\n0.000000 7.173953 0.000000\n-0.000000 -0.000000 4.231718\nTb Mg Si\n4 2 4\ndirect\n0.678817 0.178817 0.500000 Tb\n0.321183 0.821183 0.500000 Tb\n0.178817 0.321183 0.500000 Tb\n0.821183 0.678817 0.500000 Tb\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 -0.000000 Mg\n0.118322 0.618322 -0.000000 Si\n0.881677 0.381678 -0.000000 Si\n0.618322 0.881677 -0.000000 Si\n0.381678 0.118322 -0.000000 Si\n",
"nsites": 10,
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"elements": [
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"Mg",
"Si"
],
"chemical_system": "Mg-Si-Tb",
"density": 6.074139174321471,
"density_atomic": 0.04591623046639242,
"volume": 217.78791286709227,
"volume_molar": 13.11549467112245,
"formula_full": "Tb4 Mg2 Si4",
"formula_reduced": "Tb2MgSi2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.6182466099999997,
"spacegroup": 127
},
{
"id": "jvasp-76201",
"created_at": "2022-09-04T14:35:48.991800Z",
"updated_at": "2022-09-04T14:35:48.991817Z",
"structure_string": "Tb2 Mg2 Sn2\n1.0\n4.393716 -0.000000 0.000000\n-0.000000 4.393716 0.000000\n-2.196859 -2.196859 7.934907\nTb Mg Sn\n2 2 2\ndirect\n0.666275 0.666275 0.332549 Tb\n0.333725 0.333725 0.667452 Tb\n0.500000 -0.000000 -0.000000 Mg\n-0.000000 0.500000 -0.000000 Mg\n0.863448 0.863448 0.726897 Sn\n0.136552 0.136552 0.273104 Sn\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tb",
"Mg",
"Sn"
],
"chemical_system": "Mg-Sn-Tb",
"density": 6.5462779759721395,
"density_atomic": 0.03916926714731807,
"volume": 153.18131884963853,
"volume_molar": 15.374657731916075,
"formula_full": "Tb2 Mg2 Sn2",
"formula_reduced": "TbMgSn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0939797166666667,
"spacegroup": 139
},
{
"id": "jvasp-99497",
"created_at": "2022-09-04T14:36:33.423963Z",
"updated_at": "2022-09-04T14:36:33.423992Z",
"structure_string": "Tb3 Mg3 Tl3\n1.0\n7.537607 -0.000000 0.000000\n-3.768803 6.527760 0.000000\n-0.000000 -0.000000 4.633168\nTb Mg Tl\n3 3 3\ndirect\n0.571700 0.000000 -0.000000 Tb\n0.000000 0.571700 -0.000000 Tb\n0.428301 0.428300 -0.000000 Tb\n0.243795 0.000000 0.500000 Mg\n0.000000 0.243795 0.500000 Mg\n0.756206 0.756205 0.500000 Mg\n0.333334 0.666667 0.500000 Tl\n0.666667 0.333333 0.500000 Tl\n0.000000 0.000000 0.000000 Tl\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Tb",
"Mg",
"Tl"
],
"chemical_system": "Mg-Tb-Tl",
"density": 8.470200634546583,
"density_atomic": 0.039479058983842574,
"volume": 227.9689595358236,
"volume_molar": 15.2540129248386,
"formula_full": "Tb3 Mg3 Tl3",
"formula_reduced": "TbMgTl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0208762416666666,
"spacegroup": 189
},
{
"id": "jvasp-103317",
"created_at": "2022-09-04T14:36:53.307145Z",
"updated_at": "2022-09-04T14:36:53.307167Z",
"structure_string": "Tb1 Mg1 Tl2\n1.0\n4.544219 0.000000 2.623605\n1.514740 4.284330 2.623605\n0.000000 0.000000 5.247212\nTb Mg Tl\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Tb\n0.500000 0.500000 0.500001 Mg\n0.250000 0.250000 0.250000 Tl\n0.750000 0.750000 0.750001 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tb",
"Mg",
"Tl"
],
"chemical_system": "Mg-Tb-Tl",
"density": 9.62271863719139,
"density_atomic": 0.039155178854937,
"volume": 102.1576230010158,
"volume_molar": 15.38018963547827,
"formula_full": "Tb1 Mg1 Tl2",
"formula_reduced": "TbMgTl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-110981",
"created_at": "2022-09-04T14:38:48.390584Z",
"updated_at": "2022-09-04T14:38:48.390616Z",
"structure_string": "Tb2 Mn2 Al2\n1.0\n4.688448 -0.019950 2.416802\n-3.126562 4.243209 0.206558\n-0.109789 -0.019950 5.273559\nTb Mn Al\n2 2 2\ndirect\n0.500001 0.762923 0.737078 Tb\n0.000001 0.987078 0.012923 Tb\n0.250001 0.875000 0.375000 Mn\n0.750001 0.375000 0.375000 Mn\n0.750000 0.375000 0.875000 Al\n0.250000 0.375000 0.375000 Al\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tb",
"Mn",
"Al"
],
"chemical_system": "Al-Mn-Tb",
"density": 7.5544474634133625,
"density_atomic": 0.056667929847317264,
"volume": 105.87999272544536,
"volume_molar": 10.6270703310068,
"formula_full": "Tb2 Mn2 Al2",
"formula_reduced": "TbMnAl",
"formula_anonymous": "ABC",
"energy_above_hull": 2.1166661471264367,
"spacegroup": 74
},
{
"id": "jvasp-105389",
"created_at": "2022-09-04T14:36:57.348202Z",
"updated_at": "2022-09-04T14:36:57.348218Z",
"structure_string": "Tb2 Mn3 Al1\n1.0\n4.395947 0.000000 2.538001\n-2.930631 4.410702 0.000000\n-0.000000 0.000000 5.076002\nTb Mn Al\n2 3 1\ndirect\n0.738789 0.358182 0.380605 Tb\n0.261211 0.641818 0.619394 Tb\n0.500000 -0.000000 -0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 -0.000000 Al\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tb",
"Mn",
"Al"
],
"chemical_system": "Al-Mn-Tb",
"density": 8.59876513765479,
"density_atomic": 0.060963417053184345,
"volume": 98.41968003147878,
"volume_molar": 9.878286111728773,
"formula_full": "Tb2 Mn3 Al1",
"formula_reduced": "Tb2Mn3Al",
"formula_anonymous": "AB2C3",
"energy_above_hull": 3.1842552206896557,
"spacegroup": 166
},
{
"id": "jvasp-119036",
"created_at": "2022-09-04T14:38:50.040421Z",
"updated_at": "2022-09-04T14:38:50.040448Z",
"structure_string": "Tb6 Mn2 B14\n1.0\n8.084872 0.003709 0.000000\n-7.345936 3.376745 0.000000\n0.000000 0.000000 9.323465\nTb Mn B\n6 2 14\ndirect\n0.896034 0.103966 0.439121 Tb\n0.103964 0.896033 0.560879 Tb\n0.896034 0.103966 0.060879 Tb\n0.103964 0.896033 0.939122 Tb\n0.240908 0.759090 0.250000 Tb\n0.759090 0.240909 0.750000 Tb\n0.054257 0.945741 0.250000 Mn\n0.945742 0.054258 0.750000 Mn\n0.477793 0.522206 0.599053 B\n0.522206 0.477793 0.400947 B\n0.477793 0.522206 0.900947 B\n0.522206 0.477793 0.099053 B\n0.370028 0.629970 0.653043 B\n0.629970 0.370029 0.346958 B\n0.727151 0.272848 0.032744 B\n0.629970 0.370029 0.153044 B\n0.272847 0.727151 0.967257 B\n0.461280 0.538719 0.250000 B\n0.272847 0.727151 0.532744 B\n0.727151 0.272848 0.467256 B\n0.370028 0.629970 0.846958 B\n0.538719 0.461280 0.750000 B\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Tb",
"Mn",
"B"
],
"chemical_system": "B-Mn-Tb",
"density": 7.917089288826832,
"density_atomic": 0.0863456991176466,
"volume": 254.78976051864322,
"volume_molar": 6.974453645681637,
"formula_full": "Tb6 Mn2 B14",
"formula_reduced": "Tb3MnB7",
"formula_anonymous": "AB3C7",
"energy_above_hull": 4.330409138610241,
"spacegroup": 63
},
{
"id": "jvasp-62694",
"created_at": "2022-09-04T14:36:14.136238Z",
"updated_at": "2022-09-04T14:36:14.136258Z",
"structure_string": "Tb4 Mn4 B16\n1.0\n3.440373 0.000000 0.000000\n0.000000 5.913978 -0.000000\n0.000000 0.000000 11.434781\nTb Mn B\n4 4 16\ndirect\n0.000000 0.125394 0.849463 Tb\n0.000000 0.874607 0.150537 Tb\n0.000000 0.374606 0.349463 Tb\n0.000000 0.625394 0.650537 Tb\n0.000000 0.126805 0.583394 Mn\n0.000000 0.873195 0.416606 Mn\n0.000000 0.373195 0.083394 Mn\n0.000000 0.626805 0.916606 Mn\n0.500000 0.525062 0.190428 B\n0.500000 0.474938 0.809572 B\n0.500000 0.888107 0.546115 B\n0.500000 0.111894 0.453885 B\n0.500000 0.611894 0.046115 B\n0.500000 0.388107 0.953885 B\n0.500000 0.861053 0.967781 B\n0.500000 0.780087 0.816665 B\n0.500000 0.638947 0.467782 B\n0.500000 0.361053 0.532218 B\n0.500000 0.025062 0.309572 B\n0.500000 0.219913 0.183334 B\n0.500000 0.719913 0.316666 B\n0.500000 0.280087 0.683334 B\n0.500000 0.138947 0.032218 B\n0.500000 0.974938 0.690428 B\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Tb",
"Mn",
"B"
],
"chemical_system": "B-Mn-Tb",
"density": 7.340245243082025,
"density_atomic": 0.10315686971672594,
"volume": 232.65537298587319,
"volume_molar": 5.837847519546791,
"formula_full": "Tb4 Mn4 B16",
"formula_reduced": "TbMnB4",
"formula_anonymous": "ABC4",
"energy_above_hull": 4.250742662452108,
"spacegroup": 55
},
{
"id": "jvasp-24831",
"created_at": "2022-09-04T14:37:37.058319Z",
"updated_at": "2022-09-04T14:37:37.058332Z",
"structure_string": "Tb6 Mn4 C12\n1.0\n4.049667 -7.014229 0.000000\n4.049667 7.014229 -0.000000\n0.000000 0.000000 4.991176\nTb Mn C\n6 4 12\ndirect\n0.619569 0.684537 0.750001 Tb\n0.935033 0.619569 0.250000 Tb\n0.684537 0.064968 0.250000 Tb\n0.315464 0.935033 0.750001 Tb\n0.064968 0.380431 0.750001 Tb\n0.380432 0.315464 0.250000 Tb\n0.000000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.666667 0.333333 0.750001 Mn\n0.333333 0.666667 0.250000 Mn\n0.421281 0.286236 0.750001 C\n0.578720 0.713764 0.250000 C\n0.286237 0.864956 0.250000 C\n0.864956 0.578720 0.750001 C\n0.035828 0.227501 0.250000 C\n0.964173 0.772500 0.750001 C\n0.227501 0.191674 0.750001 C\n0.772500 0.808327 0.250000 C\n0.191674 0.964173 0.250000 C\n0.135045 0.421281 0.250000 C\n0.808326 0.035828 0.750001 C\n0.713764 0.135045 0.750001 C\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Tb",
"Mn",
"C"
],
"chemical_system": "C-Mn-Tb",
"density": 7.715168154115603,
"density_atomic": 0.07758728360971084,
"volume": 283.5516205293012,
"volume_molar": 7.761762597970716,
"formula_full": "Tb6 Mn4 C12",
"formula_reduced": "Tb3(MnC3)2",
"formula_anonymous": "A2B3C6",
"energy_above_hull": 5.353012698432602,
"spacegroup": 176
},
{
"id": "jvasp-101660",
"created_at": "2022-09-04T14:36:59.220972Z",
"updated_at": "2022-09-04T14:36:59.220984Z",
"structure_string": "Tb3 Mn3 Ga3\n1.0\n7.082969 -0.000000 0.000000\n-3.541484 6.134031 0.000000\n-0.000000 -0.000000 3.950496\nTb Mn Ga\n3 3 3\ndirect\n0.589054 0.000000 -0.000000 Tb\n0.000000 0.589053 -0.000000 Tb\n0.410947 0.410946 -0.000000 Tb\n0.333334 0.666667 0.500000 Mn\n0.666667 0.333333 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.251221 0.000000 0.500000 Ga\n0.000000 0.251221 0.500000 Ga\n0.748779 0.748779 0.500000 Ga\n",
"nsites": 9,
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"elements": [
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"Mn",
"Ga"
],
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"density": 8.230814426319931,
"density_atomic": 0.05243600250484507,
"volume": 171.6377978883574,
"volume_molar": 11.484744206890213,
"formula_full": "Tb3 Mn3 Ga3",
"formula_reduced": "TbMnGa",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4821826554597703,
"spacegroup": 189
},
{
"id": "jvasp-54450",
"created_at": "2022-09-04T14:37:44.316772Z",
"updated_at": "2022-09-04T14:37:44.316799Z",
"structure_string": "Tb3 Mn4 Ge4\n1.0\n4.116251 0.015992 -0.025940\n-0.027687 7.048815 -0.017765\n-2.001048 -3.514833 6.861443\nTb Mn Ge\n3 4 4\ndirect\n0.879561 0.877846 0.751899 Tb\n0.003636 0.501919 0.000062 Tb\n0.127720 0.125973 0.248203 Tb\n0.325645 0.134423 0.644024 Mn\n0.681637 0.490464 0.356099 Mn\n0.325680 0.513324 0.644021 Mn\n0.681643 0.869356 0.356071 Mn\n0.224104 0.722374 0.441003 Ge\n0.503635 0.203033 0.000057 Ge\n0.503626 0.800785 0.000037 Ge\n0.783211 0.281403 0.559113 Ge\n",
"nsites": 11,
"nelements": 3,
"elements": [
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"Mn",
"Ge"
],
"chemical_system": "Ge-Mn-Tb",
"density": 8.259053314258656,
"density_atomic": 0.055426554708283844,
"volume": 198.46082907180917,
"volume_molar": 10.865082254697592,
"formula_full": "Tb3 Mn4 Ge4",
"formula_reduced": "Tb3(MnGe)4",
"formula_anonymous": "A3B4C4",
"energy_above_hull": 2.649398905956113,
"spacegroup": 71
}
]
}