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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=1206",
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"results": [
{
"id": "jvasp-14014",
"created_at": "2022-09-04T14:35:40.820748Z",
"updated_at": "2022-09-04T14:35:40.820769Z",
"structure_string": "Tb4 Mn4 Si4\n1.0\n4.157436 -0.000000 0.000000\n-0.000000 7.038494 0.000000\n0.000000 0.000000 7.411178\nTb Mn Si\n4 4 4\ndirect\n0.250000 0.501487 0.186388 Tb\n0.750001 0.498513 0.813613 Tb\n0.250000 0.001487 0.313612 Tb\n0.750001 0.998512 0.686388 Tb\n0.750001 0.860885 0.060272 Mn\n0.250000 0.139114 0.939728 Mn\n0.750001 0.360886 0.439728 Mn\n0.250000 0.639114 0.560272 Mn\n0.250000 0.792634 0.891915 Si\n0.750001 0.207365 0.108085 Si\n0.250000 0.292635 0.608086 Si\n0.750001 0.707365 0.391915 Si\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Tb",
"Mn",
"Si"
],
"chemical_system": "Mn-Si-Tb",
"density": 7.4103747375199704,
"density_atomic": 0.055333569226404464,
"volume": 216.86654534972155,
"volume_molar": 10.88334051859122,
"formula_full": "Tb4 Mn4 Si4",
"formula_reduced": "TbMnSi",
"formula_anonymous": "ABC",
"energy_above_hull": 2.451241413793104,
"spacegroup": 62
},
{
"id": "jvasp-17843",
"created_at": "2022-09-04T14:37:26.951025Z",
"updated_at": "2022-09-04T14:37:26.951035Z",
"structure_string": "Tb2 Mn2 Si2\n1.0\n3.956624 -0.000000 0.000000\n0.000000 3.956624 0.000000\n0.000000 -0.000000 7.026727\nTb Mn Si\n2 2 2\ndirect\n0.000000 0.499999 0.669325 Tb\n0.499999 0.000000 0.330676 Tb\n0.000000 0.000000 0.000000 Mn\n0.499999 0.499999 0.000000 Mn\n0.499999 0.000000 0.798208 Si\n0.000000 0.499999 0.201793 Si\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tb",
"Mn",
"Si"
],
"chemical_system": "Mn-Si-Tb",
"density": 7.304661464732375,
"density_atomic": 0.054544203923685655,
"volume": 110.00252214506183,
"volume_molar": 11.040844538542993,
"formula_full": "Tb2 Mn2 Si2",
"formula_reduced": "TbMnSi",
"formula_anonymous": "ABC",
"energy_above_hull": 2.432344747126437,
"spacegroup": 129
},
{
"id": "jvasp-15619",
"created_at": "2022-09-04T14:37:01.115942Z",
"updated_at": "2022-09-04T14:37:01.115964Z",
"structure_string": "Tb1 Mn2 Si2\n1.0\n3.685066 -0.000000 -1.296805\n-0.456356 3.656700 -1.296805\n-0.006834 -0.007739 5.864818\nTb Mn Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Tb\n0.250000 0.750000 0.500001 Mn\n0.750001 0.250000 0.500001 Mn\n0.621155 0.621155 0.242310 Si\n0.378846 0.378845 0.757692 Si\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Tb",
"Mn",
"Si"
],
"chemical_system": "Mn-Si-Tb",
"density": 6.834601056728161,
"density_atomic": 0.0633268002915653,
"volume": 78.95551294206105,
"volume_molar": 9.509624254301867,
"formula_full": "Tb1 Mn2 Si2",
"formula_reduced": "Tb(MnSi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.3313880165517245,
"spacegroup": 139
},
{
"id": "jvasp-46291",
"created_at": "2022-09-04T14:38:05.787407Z",
"updated_at": "2022-09-04T14:38:05.787432Z",
"structure_string": "Tb4 Mn4 O14\n1.0\n-0.000000 4.992667 4.992667\n4.992667 0.000000 4.992667\n4.992667 4.992667 0.000000\nTb Mn O\n4 4 14\ndirect\n0.500000 0.000000 0.500000 Tb\n0.500000 0.500000 0.000000 Tb\n0.000000 0.500000 0.500000 Tb\n0.500000 0.500000 0.500000 Tb\n0.000000 0.000000 0.000000 Mn\n0.500000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.000000 0.500000 0.000000 Mn\n0.922358 0.327643 0.922358 O\n0.625000 0.625000 0.625000 O\n0.327643 0.327643 0.922358 O\n0.922358 0.922358 0.327643 O\n0.327643 0.922358 0.327643 O\n0.077643 0.672357 0.077643 O\n0.077643 0.077643 0.672357 O\n0.375000 0.375000 0.375000 O\n0.672357 0.672357 0.077643 O\n0.077643 0.672357 0.672357 O\n0.922358 0.327643 0.327643 O\n0.672357 0.077643 0.077643 O\n0.672357 0.077643 0.672357 O\n0.327643 0.922358 0.922358 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Tb",
"Mn",
"O"
],
"chemical_system": "Mn-O-Tb",
"density": 7.2014822013386715,
"density_atomic": 0.08838832086552398,
"volume": 248.9016623980368,
"volume_molar": 6.813276574358985,
"formula_full": "Tb4 Mn4 O14",
"formula_reduced": "Tb2Mn2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.84656961661442,
"spacegroup": 227
},
{
"id": "jvasp-98484",
"created_at": "2022-09-04T14:36:01.755751Z",
"updated_at": "2022-09-04T14:36:01.755775Z",
"structure_string": "Tb4 Mn4 O12\n1.0\n5.286690 -0.000000 0.000000\n-0.000000 5.647393 0.000000\n0.000000 0.000000 7.587418\nTb Mn O\n4 4 12\ndirect\n0.981541 0.072210 0.250001 Tb\n0.518458 0.572210 0.250001 Tb\n0.018457 0.927789 0.750001 Tb\n0.481541 0.427789 0.750001 Tb\n0.500000 0.000000 0.000000 Mn\n0.000000 0.500000 0.000000 Mn\n0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 0.500000 Mn\n0.395210 0.967506 0.250001 O\n0.895211 0.532494 0.750001 O\n0.696910 0.306513 0.446672 O\n0.696910 0.306513 0.053328 O\n0.196910 0.193487 0.946672 O\n0.803091 0.806513 0.446672 O\n0.303090 0.693486 0.553328 O\n0.303090 0.693486 0.946672 O\n0.803091 0.806513 0.053328 O\n0.196910 0.193487 0.553328 O\n0.104790 0.467506 0.250001 O\n0.604790 0.032494 0.750001 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Tb",
"Mn",
"O"
],
"chemical_system": "Mn-O-Tb",
"density": 7.678122395671563,
"density_atomic": 0.08828849808086917,
"volume": 226.53007395913227,
"volume_molar": 6.820979958775526,
"formula_full": "Tb4 Mn4 O12",
"formula_reduced": "TbMnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.171231228275862,
"spacegroup": 62
},
{
"id": "jvasp-117407",
"created_at": "2022-09-04T14:38:26.496975Z",
"updated_at": "2022-09-04T14:38:26.496999Z",
"structure_string": "Tb4 Mn4 O12\n1.0\n5.287070 -0.000000 0.000000\n0.000000 5.647264 0.000000\n-0.000000 -0.000000 7.587292\nTb Mn O\n4 4 12\ndirect\n0.518449 0.572173 0.250000 Tb\n0.981551 0.072173 0.250000 Tb\n0.481551 0.427827 0.750000 Tb\n0.018449 0.927826 0.750000 Tb\n-0.000000 0.500000 -0.000000 Mn\n0.500000 0.000000 0.500000 Mn\n-0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 -0.000000 Mn\n0.303098 0.693500 0.553326 O\n0.196902 0.193500 0.946673 O\n0.303098 0.693500 0.946673 O\n0.196902 0.193500 0.553326 O\n0.696902 0.306499 0.446674 O\n0.104784 0.467521 0.250000 O\n0.895216 0.532479 0.750000 O\n0.604784 0.032479 0.750000 O\n0.803098 0.806499 0.446674 O\n0.395216 0.967520 0.250000 O\n0.803098 0.806499 0.053326 O\n0.696902 0.306499 0.053326 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Tb",
"Mn",
"O"
],
"chemical_system": "Mn-O-Tb",
"density": 7.677873422741788,
"density_atomic": 0.08828563521350397,
"volume": 226.53741972443606,
"volume_molar": 6.821201144938771,
"formula_full": "Tb4 Mn4 O12",
"formula_reduced": "TbMnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.171231228275862,
"spacegroup": 62
},
{
"id": "jvasp-59705",
"created_at": "2022-09-04T14:38:33.784550Z",
"updated_at": "2022-09-04T14:38:33.784570Z",
"structure_string": "Tb4 Mn4 Ge4\n1.0\n4.133028 0.000000 0.000000\n-0.000000 7.095945 0.000000\n0.000000 0.000000 7.830024\nTb Mn Ge\n4 4 4\ndirect\n0.250000 0.518160 0.184213 Tb\n0.750000 0.481841 0.815787 Tb\n0.250000 0.018160 0.315787 Tb\n0.750000 0.981841 0.684213 Tb\n0.750000 0.366377 0.443704 Mn\n0.250000 0.133624 0.943704 Mn\n0.750000 0.866377 0.056296 Mn\n0.250000 0.633624 0.556295 Mn\n0.250000 0.277244 0.615151 Ge\n0.750000 0.222756 0.115151 Ge\n0.250000 0.777244 0.884848 Ge\n0.750000 0.722757 0.384849 Ge\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Tb",
"Mn",
"Ge"
],
"chemical_system": "Ge-Mn-Tb",
"density": 8.28699696950931,
"density_atomic": 0.052256409295245616,
"volume": 229.63690314427674,
"volume_molar": 11.524214620211009,
"formula_full": "Tb4 Mn4 Ge4",
"formula_reduced": "TbMnGe",
"formula_anonymous": "ABC",
"energy_above_hull": 1.7615971971264364,
"spacegroup": 62
},
{
"id": "jvasp-18226",
"created_at": "2022-09-04T14:38:10.126135Z",
"updated_at": "2022-09-04T14:38:10.126164Z",
"structure_string": "Tb1 Mn2 Ge2\n1.0\n3.719580 -0.000000 -1.285684\n-0.444400 3.692938 -1.285684\n0.023707 0.026730 6.091938\nTb Mn Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Tb\n0.250000 0.750000 0.500001 Mn\n0.750000 0.250000 0.500001 Mn\n0.620083 0.620083 0.240168 Ge\n0.379918 0.379917 0.759835 Ge\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Tb",
"Mn",
"Ge"
],
"chemical_system": "Ge-Mn-Tb",
"density": 8.191975151235686,
"density_atomic": 0.05956947440123385,
"volume": 83.9356071252567,
"volume_molar": 10.109440817687096,
"formula_full": "Tb1 Mn2 Ge2",
"formula_reduced": "Tb(MnGe)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.360770956551724,
"spacegroup": 139
},
{
"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": [
"Tb",
"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
},
{
"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,
"nelements": 3,
"elements": [
"Tb",
"Mn",
"Ga"
],
"chemical_system": "Ga-Mn-Tb",
"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-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-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
}
]
}