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=377",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=375",
"results": [
{
"id": "jvasp-102534",
"created_at": "2022-09-04T14:36:58.007148Z",
"updated_at": "2022-09-04T14:36:58.007169Z",
"structure_string": "Mn6 Co2\n1.0\n4.957607 -0.000000 0.000000\n-2.478803 4.293414 0.000000\n-0.000000 -0.000000 3.932702\nMn Co\n6 2\ndirect\n0.162166 0.324331 0.250000 Mn\n0.675670 0.837834 0.250000 Mn\n0.162166 0.837834 0.250000 Mn\n0.837835 0.675668 0.750000 Mn\n0.324331 0.162165 0.750000 Mn\n0.837835 0.162165 0.750000 Mn\n0.333334 0.666666 0.750000 Co\n0.666667 0.333333 0.250000 Co\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mn",
"Co"
],
"chemical_system": "Co-Mn",
"density": 8.87709875210237,
"density_atomic": 0.09557054959101438,
"volume": 83.70779528040055,
"volume_molar": 6.301251573597947,
"formula_full": "Mn6 Co2",
"formula_reduced": "Mn3Co",
"formula_anonymous": "AB3",
"energy_above_hull": 3.9809106560344825,
"spacegroup": 194
},
{
"id": "jvasp-22461",
"created_at": "2022-09-04T14:38:28.485508Z",
"updated_at": "2022-09-04T14:38:28.485519Z",
"structure_string": "Hf10 Zn2 Sb6\n1.0\n4.297084 -7.442767 -0.000000\n4.297084 7.442767 -0.000000\n-0.000000 0.000000 5.772578\nHf Zn Sb\n10 2 6\ndirect\n-0.000000 0.269611 0.750000 Hf\n0.666667 0.333333 0.000000 Hf\n0.333333 0.666667 0.000000 Hf\n0.666667 0.333333 0.500000 Hf\n0.269611 -0.000000 0.750000 Hf\n0.333333 0.666667 0.500000 Hf\n0.269611 0.269611 0.250000 Hf\n0.730388 0.730388 0.750000 Hf\n0.730388 -0.000000 0.250000 Hf\n-0.000000 0.730388 0.250000 Hf\n0.000000 0.000000 0.000000 Zn\n0.000000 0.000000 0.500000 Zn\n-0.000000 0.384909 0.250000 Sb\n0.384909 -0.000000 0.250000 Sb\n-0.000000 0.615091 0.750000 Sb\n0.384908 0.384908 0.750000 Sb\n0.615091 0.615091 0.250000 Sb\n0.615091 -0.000000 0.750000 Sb\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Hf",
"Zn",
"Sb"
],
"chemical_system": "Hf-Sb-Zn",
"density": 11.90080917236325,
"density_atomic": 0.048748856482027876,
"volume": 369.23943039845494,
"volume_molar": 12.353399022231772,
"formula_full": "Hf10 Zn2 Sb6",
"formula_reduced": "Hf5ZnSb3",
"formula_anonymous": "AB3C5",
"energy_above_hull": 3.980497077777778,
"spacegroup": 193
},
{
"id": "jvasp-86049",
"created_at": "2022-09-04T14:35:55.416327Z",
"updated_at": "2022-09-04T14:35:55.416350Z",
"structure_string": "Rh4 N8\n1.0\n4.648226 0.000000 -1.541843\n0.000000 4.890577 0.000000\n0.009783 0.000000 4.917031\nRh N\n4 8\ndirect\n0.239405 0.999472 0.231032 Rh\n0.239405 0.500529 0.731032 Rh\n0.760595 0.499472 0.268968 Rh\n0.760595 0.000529 0.768968 Rh\n0.190019 0.587934 0.302218 N\n0.316286 0.084610 0.672041 N\n0.683714 0.915391 0.327960 N\n0.190018 0.912067 0.802218 N\n0.809982 0.087934 0.197783 N\n0.809981 0.412067 0.697783 N\n0.683714 0.584610 0.827960 N\n0.316286 0.415391 0.172041 N\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Rh",
"N"
],
"chemical_system": "N-Rh",
"density": 7.77453866996786,
"density_atomic": 0.10728634192035545,
"volume": 111.85021117513969,
"volume_molar": 5.613147631103468,
"formula_full": "Rh4 N8",
"formula_reduced": "RhN2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.980309833333332,
"spacegroup": 14
},
{
"id": "jvasp-86648",
"created_at": "2022-09-04T14:36:04.110217Z",
"updated_at": "2022-09-04T14:36:04.110240Z",
"structure_string": "Rh4 N8\n1.0\n4.648232 0.000000 -1.541853\n0.000000 4.890619 0.000000\n0.009781 0.000000 4.917054\nRh N\n4 8\ndirect\n0.239406 0.999473 0.231033 Rh\n0.239406 0.500528 0.731032 Rh\n0.760594 0.499473 0.268967 Rh\n0.760594 0.000528 0.768967 Rh\n0.190019 0.587935 0.302217 N\n0.316285 0.084608 0.672041 N\n0.683714 0.915392 0.327959 N\n0.190019 0.912065 0.802217 N\n0.809980 0.087935 0.197783 N\n0.809980 0.412065 0.697782 N\n0.683714 0.584609 0.827958 N\n0.316285 0.415392 0.172041 N\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Rh",
"N"
],
"chemical_system": "N-Rh",
"density": 7.774426547635003,
"density_atomic": 0.1072847946652127,
"volume": 111.85182427245698,
"volume_molar": 5.613228583596004,
"formula_full": "Rh4 N8",
"formula_reduced": "RhN2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.980309833333332,
"spacegroup": 14
},
{
"id": "jvasp-99829",
"created_at": "2022-09-04T14:36:34.117938Z",
"updated_at": "2022-09-04T14:36:34.117953Z",
"structure_string": "Pa3 Al1\n1.0\n4.565306 -0.000000 -0.000000\n-0.000000 4.565306 -0.000000\n0.000000 0.000000 4.565306\nPa Al\n3 1\ndirect\n0.000000 0.500000 0.500000 Pa\n0.500000 0.000000 0.500000 Pa\n0.500000 0.500000 0.000000 Pa\n0.000000 0.000000 0.000000 Al\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pa",
"Al"
],
"chemical_system": "Al-Pa",
"density": 12.566828973721908,
"density_atomic": 0.04203880033852951,
"volume": 95.15019381592366,
"volume_molar": 14.325196512519344,
"formula_full": "Pa3 Al1",
"formula_reduced": "Pa3Al",
"formula_anonymous": "AB3",
"energy_above_hull": 3.980035525000001,
"spacegroup": 221
},
{
"id": "jvasp-120849",
"created_at": "2022-09-04T14:38:54.774429Z",
"updated_at": "2022-09-04T14:38:54.774462Z",
"structure_string": "Ba1 C1 N1\n1.0\n4.519046 0.000000 -0.000000\n-2.259523 3.913608 0.000000\n0.000000 -0.000000 4.170133\nBa C N\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.333335 0.666666 0.000000 C\n0.666668 0.333333 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"C",
"N"
],
"chemical_system": "Ba-C-N",
"density": 3.6777258798999926,
"density_atomic": 0.040676845241905596,
"volume": 73.75203219814543,
"volume_molar": 14.804837307776134,
"formula_full": "Ba1 C1 N1",
"formula_reduced": "BaCN",
"formula_anonymous": "ABC",
"energy_above_hull": 3.9798564066666655,
"spacegroup": 187
},
{
"id": "jvasp-38378",
"created_at": "2022-09-04T14:37:55.341278Z",
"updated_at": "2022-09-04T14:37:55.341307Z",
"structure_string": "Pu1 Ir1 O3\n1.0\n4.195027 0.000000 0.000000\n0.000000 4.195027 0.000000\n0.000000 -0.000000 4.195027\nPu Ir O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Pu\n0.000000 0.000000 0.000000 Ir\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Pu",
"Ir",
"O"
],
"chemical_system": "Ir-O-Pu",
"density": 10.89138811942043,
"density_atomic": 0.06772760577281325,
"volume": 73.82514032419947,
"volume_molar": 8.891707733181624,
"formula_full": "Pu1 Ir1 O3",
"formula_reduced": "PuIrO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.97924832,
"spacegroup": 221
},
{
"id": "jvasp-52504",
"created_at": "2022-09-04T14:37:45.891976Z",
"updated_at": "2022-09-04T14:37:45.891991Z",
"structure_string": "Y2 Ta6 O18\n1.0\n0.000000 5.284980 -0.008941\n7.492368 0.000000 0.000000\n0.000000 -0.364092 -8.263391\nY Ta O\n2 6 18\ndirect\n0.966495 0.250000 0.564947 Y\n0.033505 0.750000 0.435053 Y\n0.000000 0.000000 0.000000 Ta\n0.000000 0.500000 0.000000 Ta\n0.528205 0.492260 0.302217 Ta\n0.528205 0.007740 0.302217 Ta\n0.471795 0.992260 0.697783 Ta\n0.471795 0.507740 0.697783 Ta\n0.145682 0.065374 0.783648 O\n0.258362 0.456097 0.466469 O\n0.258362 0.043903 0.466469 O\n0.332051 0.750000 0.654084 O\n0.326987 0.442333 0.118445 O\n0.326987 0.057667 0.118445 O\n0.421958 0.750000 0.311674 O\n0.578043 0.250000 0.688325 O\n0.741638 0.543903 0.533531 O\n0.673013 0.942334 0.881554 O\n0.667950 0.250000 0.345916 O\n0.145682 0.434626 0.783648 O\n0.741638 0.956097 0.533531 O\n0.854319 0.565374 0.216352 O\n0.854319 0.934626 0.216352 O\n0.897610 0.250000 0.021843 O\n0.673013 0.557667 0.881554 O\n0.102391 0.750000 0.978157 O\n",
"nsites": 26,
"nelements": 3,
"elements": [
"Y",
"Ta",
"O"
],
"chemical_system": "O-Ta-Y",
"density": 7.873076038396717,
"density_atomic": 0.07945481579360913,
"volume": 327.2300079020671,
"volume_molar": 7.579327571085232,
"formula_full": "Y2 Ta6 O18",
"formula_reduced": "YTa3O9",
"formula_anonymous": "AB3C9",
"energy_above_hull": 3.9784741961538463,
"spacegroup": 11
},
{
"id": "jvasp-105819",
"created_at": "2022-09-04T14:35:47.061727Z",
"updated_at": "2022-09-04T14:35:47.061752Z",
"structure_string": "Mg1 Nb3\n1.0\n3.965218 -0.287338 -2.543236\n-1.336199 3.744341 -2.543236\n0.218518 0.287338 4.705662\nMg Nb\n1 3\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 -0.000001 Nb\n0.750001 0.250000 0.499999 Nb\n0.250000 0.750000 0.499999 Nb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mg",
"Nb"
],
"chemical_system": "Mg-Nb",
"density": 6.783865369512413,
"density_atomic": 0.053927574438407753,
"volume": 74.17355669442385,
"volume_molar": 11.16708997709152,
"formula_full": "Mg1 Nb3",
"formula_reduced": "MgNb3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.978350285714286,
"spacegroup": 225
},
{
"id": "jvasp-112630",
"created_at": "2022-09-04T14:38:42.308513Z",
"updated_at": "2022-09-04T14:38:42.308537Z",
"structure_string": "Ta1 Nb3 V4 O20\n1.0\n5.614566 -0.000000 0.000000\n0.000000 7.044665 0.012002\n-0.000000 0.005626 12.035649\nTa Nb V O\n1 3 4 20\ndirect\n0.500000 0.838600 0.558825 Ta\n0.500000 0.656871 0.059355 Nb\n-0.000000 0.154738 0.442751 Nb\n-0.000000 0.341915 0.940648 Nb\n0.500000 0.029141 0.844017 V\n0.500000 0.471638 0.346304 V\n-0.000000 0.970712 0.155154 V\n-0.000000 0.529328 0.654101 V\n0.249973 0.500018 0.999465 O\n0.251113 0.656576 0.621633 O\n0.750361 0.842648 0.124739 O\n0.749826 0.157861 0.874169 O\n0.250175 0.157861 0.874169 O\n0.250408 0.345283 0.378529 O\n0.749057 0.999449 0.500744 O\n0.749593 0.345283 0.378529 O\n0.750028 0.500018 0.999465 O\n0.500000 0.523639 0.204001 O\n-0.000000 0.477986 0.795458 O\n-0.000000 0.028243 0.296119 O\n0.748888 0.656576 0.621633 O\n0.500000 0.970209 0.703214 O\n-0.000000 0.319849 0.580738 O\n-0.000000 0.178083 0.077407 O\n0.500000 0.682419 0.421040 O\n0.500000 0.822975 0.922314 O\n0.250944 0.999449 0.500744 O\n0.249640 0.842648 0.124739 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Ta",
"Nb",
"V",
"O"
],
"chemical_system": "Nb-O-Ta-V",
"density": 3.430385116343126,
"density_atomic": 0.05881828080972455,
"volume": 476.0424754776359,
"volume_molar": 10.23855283951847,
"formula_full": "Ta1 Nb3 V4 O20",
"formula_reduced": "TaNb3V4O20",
"formula_anonymous": "AB3C4D20",
"energy_above_hull": 3.978253007142857,
"spacegroup": 6
},
{
"id": "jvasp-35021",
"created_at": "2022-09-04T14:37:34.592664Z",
"updated_at": "2022-09-04T14:37:34.592691Z",
"structure_string": "Os3 N3\n1.0\n4.074676 0.000000 0.000000\n0.000000 4.074676 -0.000000\n0.000000 0.000000 4.074676\nOs N\n3 3\ndirect\n0.500001 0.500001 0.000000 Os\n0.500001 0.000000 0.500001 Os\n0.000000 0.500001 0.500001 Os\n0.000000 0.000000 0.500001 N\n0.000000 0.500001 0.000000 N\n0.500001 0.000000 0.000000 N\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Os",
"N"
],
"chemical_system": "N-Os",
"density": 15.039205473836397,
"density_atomic": 0.0886894591552877,
"volume": 67.65178249079759,
"volume_molar": 6.790142613741442,
"formula_full": "Os3 N3",
"formula_reduced": "OsN",
"formula_anonymous": "AB",
"energy_above_hull": 3.978164125,
"spacegroup": 221
},
{
"id": "jvasp-42080",
"created_at": "2022-09-04T14:37:33.476385Z",
"updated_at": "2022-09-04T14:37:33.476404Z",
"structure_string": "Pa3 Al1\n1.0\n-2.272745 2.272745 4.559634\n2.272745 -2.272745 4.559634\n2.272745 2.272745 -4.559634\nPa Al\n3 1\ndirect\n0.750001 0.250000 0.500001 Pa\n0.250000 0.750001 0.500001 Pa\n0.500000 0.500000 0.000000 Pa\n0.000000 0.000000 0.000000 Al\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pa",
"Al"
],
"chemical_system": "Al-Pa",
"density": 12.692406861373389,
"density_atomic": 0.04245888592710193,
"volume": 94.20878368941753,
"volume_molar": 14.183463905151612,
"formula_full": "Pa3 Al1",
"formula_reduced": "Pa3Al",
"formula_anonymous": "AB3",
"energy_above_hull": 3.9778230250000006,
"spacegroup": 139
}
]
}