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=chemical_system&page=371",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=369",
"results": [
{
"id": "jvasp-41990",
"created_at": "2022-09-04T14:37:36.346666Z",
"updated_at": "2022-09-04T14:37:36.346687Z",
"structure_string": "Al2 Pd1 Ru1\n1.0\n0.000000 3.029735 3.029735\n3.029735 0.000000 3.029735\n3.029735 3.029735 0.000000\nAl Pd Ru\n2 1 1\ndirect\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.250000 0.250000 0.250000 Pd\n0.749998 0.749998 0.749998 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Pd",
"Ru"
],
"chemical_system": "Al-Pd-Ru",
"density": 7.805467638868793,
"density_atomic": 0.07191443350147245,
"volume": 55.621657645653286,
"volume_molar": 8.374036291166359,
"formula_full": "Al2 Pd1 Ru1",
"formula_reduced": "Al2PdRu",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.18555795,
"spacegroup": 225
},
{
"id": "jvasp-17428",
"created_at": "2022-09-04T14:37:58.332369Z",
"updated_at": "2022-09-04T14:37:58.332394Z",
"structure_string": "Sc1 Al1 Pd2\n1.0\n3.905618 0.000000 2.254909\n1.301872 3.682251 2.254909\n0.000000 0.000000 4.509818\nSc Al Pd\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Sc\n0.000000 0.000000 0.000000 Al\n0.250000 0.250000 0.250000 Pd\n0.750000 0.750000 0.750001 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Al",
"Pd"
],
"chemical_system": "Al-Pd-Sc",
"density": 7.291091142270679,
"density_atomic": 0.06167339032694728,
"volume": 64.8577932686191,
"volume_molar": 9.76456901116512,
"formula_full": "Sc1 Al1 Pd2",
"formula_reduced": "ScAlPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6625098625000003,
"spacegroup": 225
},
{
"id": "jvasp-100433",
"created_at": "2022-09-04T14:36:36.114087Z",
"updated_at": "2022-09-04T14:36:36.114102Z",
"structure_string": "Al3 Si1 Pd4\n1.0\n4.894493 -0.001865 -0.052621\n-0.053170 4.894204 -0.052621\n-0.001846 -0.001865 4.894775\nAl Si Pd\n3 1 4\ndirect\n0.341365 0.158427 0.649972 Al\n0.158427 0.649970 0.341367 Al\n0.649971 0.341365 0.158428 Al\n0.843739 0.843738 0.843742 Si\n0.144284 0.144284 0.144284 Pd\n0.655623 0.850264 0.356321 Pd\n0.850265 0.356318 0.655625 Pd\n0.356319 0.655622 0.850267 Pd\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Al",
"Si",
"Pd"
],
"chemical_system": "Al-Pd-Si",
"density": 7.572692866027524,
"density_atomic": 0.06822960110862415,
"volume": 117.25116181265214,
"volume_molar": 8.8262875088666,
"formula_full": "Al3 Si1 Pd4",
"formula_reduced": "Al3SiPd4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 2.065844975,
"spacegroup": 146
},
{
"id": "jvasp-107080",
"created_at": "2022-09-04T14:36:57.565776Z",
"updated_at": "2022-09-04T14:36:57.565800Z",
"structure_string": "Al4 Si1 Pd1\n1.0\n4.052581 -0.013172 6.031388\n1.828352 3.616727 6.031388\n-0.021497 -0.013172 7.266401\nAl Si Pd\n4 1 1\ndirect\n0.630747 0.630749 0.630749 Al\n0.121063 0.121064 0.121064 Al\n0.878934 0.878938 0.878937 Al\n0.369251 0.369252 0.369252 Al\n0.499999 0.500001 0.500000 Si\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Al",
"Si",
"Pd"
],
"chemical_system": "Al-Pd-Si",
"density": 3.7508631914258705,
"density_atomic": 0.05590415040638049,
"volume": 107.3265572660452,
"volume_molar": 10.772260585705416,
"formula_full": "Al4 Si1 Pd1",
"formula_reduced": "Al4SiPd",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.07951425,
"spacegroup": 166
},
{
"id": "jvasp-16603",
"created_at": "2022-09-04T14:37:45.677656Z",
"updated_at": "2022-09-04T14:37:45.677677Z",
"structure_string": "Sm1 Al3 Pd2\n1.0\n2.725155 -4.720105 -0.000000\n2.725155 4.720105 -0.000000\n0.000000 0.000000 4.226140\nSm Al Pd\n1 3 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.500000 -0.000001 0.500000 Al\n0.499999 0.499999 0.500000 Al\n-0.000001 0.500000 0.500000 Al\n0.333332 0.666666 0.000000 Pd\n0.666666 0.333332 0.000000 Pd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sm",
"Al",
"Pd"
],
"chemical_system": "Al-Pd-Sm",
"density": 6.783545697084384,
"density_atomic": 0.05518671027489945,
"volume": 108.72182759422385,
"volume_molar": 10.912302490947802,
"formula_full": "Sm1 Al3 Pd2",
"formula_reduced": "SmAl3Pd2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.6918631125000003,
"spacegroup": 191
},
{
"id": "jvasp-15161",
"created_at": "2022-09-04T14:36:42.043317Z",
"updated_at": "2022-09-04T14:36:42.043338Z",
"structure_string": "Tb3 Al3 Pd3\n1.0\n3.583318 -6.206488 0.000000\n3.583318 6.206488 0.000000\n-0.000000 0.000000 4.063445\nTb Al Pd\n3 3 3\ndirect\n0.000000 0.416346 0.500001 Tb\n0.416346 0.000000 0.500001 Tb\n0.583655 0.583655 0.500001 Tb\n0.762021 0.000000 0.000000 Al\n0.237979 0.237979 0.000000 Al\n0.000000 0.762021 0.000000 Al\n0.333333 0.666667 0.000000 Pd\n0.666667 0.333333 0.000000 Pd\n0.000000 0.000000 0.500001 Pd\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Tb",
"Al",
"Pd"
],
"chemical_system": "Al-Pd-Tb",
"density": 8.057187377160203,
"density_atomic": 0.04979512842362796,
"volume": 180.74057211848597,
"volume_molar": 12.093835181560598,
"formula_full": "Tb3 Al3 Pd3",
"formula_reduced": "TbAlPd",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1154056333333335,
"spacegroup": 189
},
{
"id": "jvasp-21818",
"created_at": "2022-09-04T14:37:29.506559Z",
"updated_at": "2022-09-04T14:37:29.506584Z",
"structure_string": "Tb4 Al4 Pd4\n1.0\n4.438949 0.000000 0.000000\n-0.000000 6.940754 0.000000\n0.000000 0.000000 7.802867\nTb Al Pd\n4 4 4\ndirect\n0.250000 0.532523 0.819675 Tb\n0.750000 0.467476 0.180325 Tb\n0.250000 0.032523 0.680326 Tb\n0.750000 0.967476 0.319675 Tb\n0.250000 0.644844 0.435995 Al\n0.750000 0.355155 0.564006 Al\n0.250000 0.144844 0.064006 Al\n0.750000 0.855155 0.935995 Al\n0.750000 0.727514 0.615837 Pd\n0.250000 0.272486 0.384163 Pd\n0.750000 0.227514 0.884164 Pd\n0.250000 0.772485 0.115837 Pd\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Tb",
"Al",
"Pd"
],
"chemical_system": "Al-Pd-Tb",
"density": 8.076753733806761,
"density_atomic": 0.04991605266137868,
"volume": 240.4036248900888,
"volume_molar": 12.064537235852953,
"formula_full": "Tb4 Al4 Pd4",
"formula_reduced": "TbAlPd",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1136123000000002,
"spacegroup": 62
},
{
"id": "jvasp-101388",
"created_at": "2022-09-04T14:36:39.941111Z",
"updated_at": "2022-09-04T14:36:39.941131Z",
"structure_string": "Al2 Tc1 Pd1\n1.0\n3.731747 0.000000 2.154525\n1.243916 3.518324 2.154525\n0.000000 0.000000 4.309049\nAl Tc Pd\n2 1 1\ndirect\n0.750002 0.749999 0.750001 Al\n0.250001 0.250000 0.250000 Al\n0.000000 0.000000 0.000000 Tc\n0.500001 0.499999 0.500001 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Tc",
"Pd"
],
"chemical_system": "Al-Pd-Tc",
"density": 7.583744757752038,
"density_atomic": 0.07070181055166655,
"volume": 56.57563743826521,
"volume_molar": 8.517661305998972,
"formula_full": "Al2 Tc1 Pd1",
"formula_reduced": "Al2TcPd",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.4655682,
"spacegroup": 225
},
{
"id": "jvasp-77305",
"created_at": "2022-09-04T14:37:51.814873Z",
"updated_at": "2022-09-04T14:37:51.814882Z",
"structure_string": "Al2 Tc1 Pd1\n1.0\n-8.657696 -0.000000 -4.998523\n-5.586817 -1.235467 -0.320395\n-4.165767 2.783872 -2.781727\nAl Tc Pd\n2 1 1\ndirect\n0.743702 0.000001 0.000001 Al\n0.256297 0.000000 0.000000 Al\n0.000000 0.000000 0.000000 Tc\n0.499999 0.000001 0.000000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Tc",
"Pd"
],
"chemical_system": "Al-Pd-Tc",
"density": 6.5016866111582425,
"density_atomic": 0.0606139881723386,
"volume": 65.99136800942944,
"volume_molar": 9.935232677443626,
"formula_full": "Al2 Tc1 Pd1",
"formula_reduced": "Al2TcPd",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.6889407,
"spacegroup": 71
},
{
"id": "jvasp-90158",
"created_at": "2022-09-04T14:36:07.321595Z",
"updated_at": "2022-09-04T14:36:07.321620Z",
"structure_string": "Th3 Al3 Pd3\n1.0\n0.000000 0.000000 -4.227305\n-3.653612 -6.328242 0.000000\n-3.653349 6.328089 0.000000\nTh Al Pd\n3 3 3\ndirect\n0.499999 0.580459 -0.000000 Th\n0.499999 0.419510 0.419521 Th\n0.499999 0.999990 0.580479 Th\n0.000000 0.232077 -0.000000 Al\n0.000000 0.767901 0.767911 Al\n0.000000 -0.000010 0.232089 Al\n0.000000 0.333323 0.666667 Pd\n0.000000 0.666656 0.333333 Pd\n0.499999 -0.000009 0.000000 Pd\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Th",
"Al",
"Pd"
],
"chemical_system": "Al-Pd-Th",
"density": 9.313389286029432,
"density_atomic": 0.046043073712368716,
"volume": 195.46913953275666,
"volume_molar": 13.07936302780379,
"formula_full": "Th3 Al3 Pd3",
"formula_reduced": "ThAlPd",
"formula_anonymous": "ABC",
"energy_above_hull": 1.7165147,
"spacegroup": 189
},
{
"id": "jvasp-62152",
"created_at": "2022-09-04T14:35:56.970066Z",
"updated_at": "2022-09-04T14:35:56.970092Z",
"structure_string": "Ti6 Al16 Pd7\n1.0\n0.000000 6.126596 6.126596\n6.126596 0.000000 6.126596\n6.126596 6.126596 -0.000000\nTi Al Pd\n6 16 7\ndirect\n0.671373 0.328628 0.671373 Ti\n0.671373 0.328628 0.328628 Ti\n0.328628 0.671373 0.671373 Ti\n0.328628 0.328628 0.671373 Ti\n0.671373 0.671373 0.328628 Ti\n0.328628 0.671373 0.328628 Ti\n0.019654 0.660116 0.660116 Al\n0.660116 0.019654 0.660116 Al\n0.660116 0.660116 0.660116 Al\n0.980347 0.339884 0.339884 Al\n0.120355 0.638934 0.120355 Al\n0.339884 0.339884 0.339884 Al\n0.120355 0.120355 0.120355 Al\n0.120355 0.120355 0.638934 Al\n0.638934 0.120355 0.120355 Al\n0.879645 0.879645 0.879645 Al\n0.339884 0.339884 0.980347 Al\n0.660116 0.660116 0.019654 Al\n0.879645 0.361066 0.879645 Al\n0.879645 0.879645 0.361066 Al\n0.361066 0.879645 0.879645 Al\n0.339884 0.980347 0.339884 Al\n0.000000 0.000000 0.500000 Pd\n0.000000 0.000000 0.000000 Pd\n0.500000 0.000000 0.000000 Pd\n0.000000 0.500000 0.000000 Pd\n0.500000 0.000000 0.500000 Pd\n0.500000 0.500000 0.000000 Pd\n0.000000 0.500000 0.500000 Pd\n",
"nsites": 29,
"nelements": 3,
"elements": [
"Ti",
"Al",
"Pd"
],
"chemical_system": "Al-Pd-Ti",
"density": 5.285145479923565,
"density_atomic": 0.06305365601284144,
"volume": 459.92574949331873,
"volume_molar": 9.55081931930091,
"formula_full": "Ti6 Al16 Pd7",
"formula_reduced": "Ti6Al16Pd7",
"formula_anonymous": "A6B7C16",
"energy_above_hull": 2.7100943,
"spacegroup": 225
},
{
"id": "jvasp-104676",
"created_at": "2022-09-04T14:36:47.661163Z",
"updated_at": "2022-09-04T14:36:47.661186Z",
"structure_string": "Ti1 Al1 Pd2\n1.0\n2.904489 0.000000 0.000000\n0.000000 2.904489 0.000000\n-0.000000 -0.000000 7.108660\nTi Al Pd\n1 1 2\ndirect\n0.000000 0.000000 0.500000 Ti\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.229081 Pd\n0.500000 0.500000 0.770919 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Al",
"Pd"
],
"chemical_system": "Al-Pd-Ti",
"density": 7.966075948273228,
"density_atomic": 0.06670106625086139,
"volume": 59.96905634095981,
"volume_molar": 9.028552463240764,
"formula_full": "Ti1 Al1 Pd2",
"formula_reduced": "TiAlPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.026860633333333,
"spacegroup": 123
}
]
}