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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=698",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=696",
"results": [
{
"id": "jvasp-39655",
"created_at": "2022-09-04T14:37:42.298210Z",
"updated_at": "2022-09-04T14:37:42.298229Z",
"structure_string": "Ti1 Mn2 Si1\n1.0\n0.000000 2.891954 2.891954\n2.891954 -0.000000 2.891954\n2.891954 2.891954 0.000000\nTi Mn Si\n1 2 1\ndirect\n0.749998 0.749998 0.749998 Ti\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Mn\n0.250000 0.250000 0.250000 Si\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Mn",
"Si"
],
"chemical_system": "Mn-Si-Ti",
"density": 6.379071813636646,
"density_atomic": 0.08269054485780472,
"volume": 48.373124241452636,
"volume_molar": 7.2827440795749006,
"formula_full": "Ti1 Mn2 Si1",
"formula_reduced": "TiMn2Si",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.736800354022988,
"spacegroup": 225
},
{
"id": "jvasp-97804",
"created_at": "2022-09-04T14:38:08.186446Z",
"updated_at": "2022-09-04T14:38:08.186473Z",
"structure_string": "Ti12 Mn12 Si24\n1.0\n7.695616 0.000000 0.000000\n0.000000 8.684696 -0.000000\n0.000000 0.000000 9.495653\nTi Mn Si\n12 12 24\ndirect\n0.239634 0.828146 0.453141 Ti\n0.239634 0.171855 0.546859 Ti\n0.760366 0.328146 0.046859 Ti\n0.760366 0.671855 0.953140 Ti\n0.760366 0.171855 0.546859 Ti\n0.760366 0.828146 0.453141 Ti\n0.239634 0.671855 0.953140 Ti\n0.239634 0.328146 0.046859 Ti\n0.000000 0.331107 0.320638 Ti\n0.000000 0.668893 0.679362 Ti\n0.000000 0.831107 0.179362 Ti\n0.000000 0.168893 0.820638 Ti\n0.243692 0.500000 0.500000 Mn\n0.248167 0.584415 0.246861 Mn\n0.248167 0.415586 0.753139 Mn\n0.751833 0.084415 0.253139 Mn\n0.751833 0.915586 0.746861 Mn\n0.751833 0.415586 0.753139 Mn\n0.751833 0.584415 0.246861 Mn\n0.248167 0.915586 0.746861 Mn\n0.243692 0.000000 0.000000 Mn\n0.756309 0.500000 0.500000 Mn\n0.248167 0.084415 0.253139 Mn\n0.756309 0.000000 0.000000 Mn\n0.500000 0.037001 0.377065 Si\n0.654969 0.331777 0.317725 Si\n0.000000 0.462269 0.879224 Si\n0.000000 0.537731 0.120776 Si\n0.000000 0.962270 0.620776 Si\n0.000000 0.037731 0.379224 Si\n0.000000 0.370433 0.602715 Si\n0.000000 0.629567 0.397285 Si\n0.000000 0.870434 0.897285 Si\n0.500000 0.374357 0.595715 Si\n0.500000 0.625644 0.404285 Si\n0.345031 0.168223 0.817724 Si\n0.500000 0.874357 0.904285 Si\n0.500000 0.462999 0.877065 Si\n0.500000 0.537001 0.122935 Si\n0.500000 0.962999 0.622935 Si\n0.000000 0.129567 0.102715 Si\n0.345031 0.331777 0.317725 Si\n0.654969 0.831778 0.182275 Si\n0.345031 0.831778 0.182275 Si\n0.654969 0.168223 0.817724 Si\n0.654969 0.668223 0.682275 Si\n0.500000 0.125643 0.095715 Si\n0.345031 0.668223 0.682275 Si\n",
"nsites": 48,
"nelements": 3,
"elements": [
"Ti",
"Mn",
"Si"
],
"chemical_system": "Mn-Si-Ti",
"density": 4.991593221353005,
"density_atomic": 0.07563423031699588,
"volume": 634.6332844113552,
"volume_molar": 7.962189520221448,
"formula_full": "Ti12 Mn12 Si24",
"formula_reduced": "TiMnSi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.4386831936781608,
"spacegroup": 55
},
{
"id": "jvasp-37047",
"created_at": "2022-09-04T14:38:07.452778Z",
"updated_at": "2022-09-04T14:38:07.452807Z",
"structure_string": "Ti2 Mn1 Si1\n1.0\n3.006863 3.006863 -0.000000\n3.006863 0.000000 -3.006863\n0.000000 3.006863 -3.006863\nTi Mn Si\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.749999 0.749999 0.749999 Ti\n0.500000 0.500000 0.500000 Mn\n0.250000 0.250000 0.250000 Si\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Mn",
"Si"
],
"chemical_system": "Mn-Si-Ti",
"density": 5.459370393999089,
"density_atomic": 0.07356802082955614,
"volume": 54.37145046034716,
"volume_molar": 8.185813199939435,
"formula_full": "Ti2 Mn1 Si1",
"formula_reduced": "Ti2MnSi",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.669318127011494,
"spacegroup": 216
},
{
"id": "jvasp-99924",
"created_at": "2022-09-04T14:36:48.616181Z",
"updated_at": "2022-09-04T14:36:48.616191Z",
"structure_string": "Th1 U1 Mn4 Si4\n1.0\n3.959733 0.000000 -0.000000\n0.000000 3.959733 -0.000000\n-0.000000 0.000000 10.153455\nTh U Mn Si\n1 1 4 4\ndirect\n0.000000 0.000000 0.000000 Th\n0.500000 0.500000 0.500000 U\n0.000000 0.500000 0.259137 Mn\n0.500000 0.000000 0.740863 Mn\n0.500000 0.000000 0.259137 Mn\n0.000000 0.500000 0.740863 Mn\n0.500000 0.500000 0.130389 Si\n0.000000 0.000000 0.617236 Si\n0.000000 0.000000 0.382763 Si\n0.500000 0.500000 0.869610 Si\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Th",
"U",
"Mn",
"Si"
],
"chemical_system": "Mn-Si-Th-U",
"density": 8.366909427221476,
"density_atomic": 0.06281369562002756,
"volume": 159.20094974974842,
"volume_molar": 9.587305285186718,
"formula_full": "Th1 U1 Mn4 Si4",
"formula_reduced": "ThU(MnSi)4",
"formula_anonymous": "ABC4D4",
"energy_above_hull": 4.609429496551724,
"spacegroup": 123
},
{
"id": "jvasp-15387",
"created_at": "2022-09-04T14:36:59.092107Z",
"updated_at": "2022-09-04T14:36:59.092128Z",
"structure_string": "Th1 Mn2 Si2\n1.0\n3.768033 -0.000000 -1.350943\n-0.484350 3.736774 -1.350943\n-0.000251 -0.000286 5.929646\nTh Mn Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Th\n0.250000 0.749999 0.500000 Mn\n0.750000 0.249999 0.500000 Mn\n0.374485 0.374484 0.748971 Si\n0.625514 0.625514 0.251030 Si\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Th",
"Mn",
"Si"
],
"chemical_system": "Mn-Si-Th",
"density": 7.9177159139382685,
"density_atomic": 0.059888694350826756,
"volume": 83.48821182692849,
"volume_molar": 10.055555268449202,
"formula_full": "Th1 Mn2 Si2",
"formula_reduced": "Th(MnSi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.750737456551724,
"spacegroup": 139
},
{
"id": "jvasp-53553",
"created_at": "2022-09-04T14:38:09.493112Z",
"updated_at": "2022-09-04T14:38:09.493122Z",
"structure_string": "Mn6 Si4 Te12\n1.0\n3.508863 -6.077529 0.000000\n3.508863 6.077529 -0.000000\n-0.000000 -0.000000 11.650173\nMn Si Te\n6 4 12\ndirect\n0.333333 0.666667 0.505036 Mn\n0.333333 0.666667 0.250000 Mn\n0.666667 0.333333 0.005037 Mn\n0.333333 0.666667 0.994963 Mn\n0.666667 0.333333 0.750000 Mn\n0.666667 0.333333 0.494963 Mn\n0.000000 0.000000 0.147623 Si\n0.000000 0.000000 0.352377 Si\n0.000000 0.000000 0.647623 Si\n0.000000 0.000000 0.852377 Si\n0.986066 0.361915 0.881510 Te\n0.624151 0.638084 0.381510 Te\n0.013933 0.375849 0.381510 Te\n0.638084 0.624151 0.881510 Te\n0.361915 0.375848 0.118490 Te\n0.375849 0.013933 0.881510 Te\n0.375848 0.361915 0.618490 Te\n0.013933 0.638084 0.118490 Te\n0.361915 0.986066 0.381510 Te\n0.638084 0.013933 0.618490 Te\n0.986066 0.624151 0.618490 Te\n0.624151 0.986066 0.118490 Te\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Mn",
"Si",
"Te"
],
"chemical_system": "Mn-Si-Te",
"density": 6.594135071223341,
"density_atomic": 0.044275845047463715,
"volume": 496.8849262259364,
"volume_molar": 13.60141348752184,
"formula_full": "Mn6 Si4 Te12",
"formula_reduced": "Mn3(SiTe3)2",
"formula_anonymous": "A2B3C6",
"energy_above_hull": 2.702819593103448,
"spacegroup": 163
},
{
"id": "jvasp-41212",
"created_at": "2022-09-04T14:37:39.103403Z",
"updated_at": "2022-09-04T14:37:39.103428Z",
"structure_string": "Mn1 Si1 Tc2\n1.0\n-0.000000 2.978712 2.978712\n2.978712 0.000000 2.978712\n2.978712 2.978712 -0.000000\nMn Si Tc\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Mn\n0.749999 0.749999 0.749999 Si\n0.000000 0.000000 0.000000 Tc\n0.500000 0.500000 0.500000 Tc\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Si",
"Tc"
],
"chemical_system": "Mn-Si-Tc",
"density": 8.765453877605877,
"density_atomic": 0.07567360968691354,
"volume": 52.858585926445265,
"volume_molar": 7.958046120590209,
"formula_full": "Mn1 Si1 Tc2",
"formula_reduced": "MnSiTc2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.501399710344827,
"spacegroup": 225
},
{
"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-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-77316",
"created_at": "2022-09-04T14:38:01.532963Z",
"updated_at": "2022-09-04T14:38:01.532983Z",
"structure_string": "Ta1 Mn2 Si1\n1.0\n-9.618968 3.316724 -0.137300\n-6.829977 1.086861 1.985345\n-5.630876 4.478398 -0.091549\nTa Mn Si\n1 2 1\ndirect\n0.500001 0.000000 -0.000001 Ta\n0.749964 0.000025 0.000024 Mn\n0.250037 -0.000025 -0.000026 Mn\n0.000000 0.000000 0.000000 Si\n",
"nsites": 4,
"nelements": 3,
"elements": [
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"Mn",
"Si"
],
"chemical_system": "Mn-Si-Ta",
"density": 10.447475041051218,
"density_atomic": 0.07891413861813472,
"volume": 50.68800179592643,
"volume_molar": 7.6312570414550445,
"formula_full": "Ta1 Mn2 Si1",
"formula_reduced": "TaMn2Si",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.488893070689654,
"spacegroup": 225
},
{
"id": "jvasp-89931",
"created_at": "2022-09-04T14:36:11.395641Z",
"updated_at": "2022-09-04T14:36:11.395667Z",
"structure_string": "Ta3 Mn3 Si3\n1.0\n0.000000 0.000000 -3.480288\n-3.208387 -5.557090 0.000000\n-3.208342 5.557064 0.000000\nTa Mn Si\n3 3 3\ndirect\n0.500000 0.589101 0.000000 Ta\n0.500000 0.410896 0.410913 Ta\n0.500000 0.999983 0.589087 Ta\n0.000000 0.246923 0.000000 Mn\n0.000000 0.753050 0.753063 Mn\n0.000000 0.999986 0.246937 Mn\n0.000000 0.333319 0.666673 Si\n0.000000 0.666645 0.333326 Si\n0.500000 -0.000001 -0.000000 Si\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ta",
"Mn",
"Si"
],
"chemical_system": "Mn-Si-Ta",
"density": 10.596244543753947,
"density_atomic": 0.07252157258148718,
"volume": 124.1010044271635,
"volume_molar": 8.303930190197354,
"formula_full": "Ta3 Mn3 Si3",
"formula_reduced": "TaMnSi",
"formula_anonymous": "ABC",
"energy_above_hull": 4.0137516804597695,
"spacegroup": 189
}
]
}