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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=1509",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=1507",
"results": [
{
"id": "jvasp-122684",
"created_at": "2022-09-04T14:38:54.138989Z",
"updated_at": "2022-09-04T14:38:54.139015Z",
"structure_string": "Nb1 Ga3\n1.0\n5.038009 -0.751568 -0.883372\n-3.096263 4.044693 0.883372\n-0.727271 0.428825 3.727708\nNb Ga\n1 3\ndirect\n0.124962 0.875037 -0.125045 Nb\n0.375017 0.624984 0.625123 Ga\n0.874973 0.125026 0.124885 Ga\n0.625048 0.374952 0.375038 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Nb",
"Ga"
],
"chemical_system": "Ga-Nb",
"density": 7.784779034359507,
"density_atomic": 0.06207859130606527,
"volume": 64.43445181091259,
"volume_molar": 9.700833464968813,
"formula_full": "Nb1 Ga3",
"formula_reduced": "NbGa3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.97182409375,
"spacegroup": 139
},
{
"id": "jvasp-59539",
"created_at": "2022-09-04T14:37:33.641469Z",
"updated_at": "2022-09-04T14:37:33.641494Z",
"structure_string": "Nb10 Ga8\n1.0\n4.001844 -6.931398 0.000000\n4.001844 6.931398 0.000000\n0.000000 -0.000000 5.463438\nNb Ga\n10 8\ndirect\n0.666666 0.333332 0.000000 Nb\n0.719123 -0.000000 0.250000 Nb\n0.719122 0.719122 0.750000 Nb\n0.280876 0.280876 0.250000 Nb\n-0.000000 0.719123 0.250000 Nb\n-0.000000 0.280877 0.750000 Nb\n0.666666 0.333332 0.500000 Nb\n0.333332 0.666666 0.000000 Nb\n0.333332 0.666666 0.500000 Nb\n0.280877 -0.000000 0.750000 Nb\n-0.000000 0.616531 0.750000 Ga\n0.000000 0.000000 0.000000 Ga\n0.000000 0.000000 0.500000 Ga\n0.616531 -0.000000 0.750000 Ga\n-0.000000 0.383468 0.250000 Ga\n0.616531 0.616531 0.250000 Ga\n0.383468 0.383468 0.750000 Ga\n0.383468 -0.000000 0.250000 Ga\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Nb",
"Ga"
],
"chemical_system": "Ga-Nb",
"density": 8.145891210840956,
"density_atomic": 0.059387562269460674,
"volume": 303.0937676533707,
"volume_molar": 10.140407401596296,
"formula_full": "Nb10 Ga8",
"formula_reduced": "Nb5Ga4",
"formula_anonymous": "A4B5",
"energy_above_hull": 3.3443095888888887,
"spacegroup": 193
},
{
"id": "jvasp-21686",
"created_at": "2022-09-04T14:38:34.553270Z",
"updated_at": "2022-09-04T14:38:34.553287Z",
"structure_string": "Nb6 Ga4\n1.0\n6.935944 0.000000 0.000000\n0.000000 6.935944 0.000000\n-0.000000 0.000000 3.532184\nNb Ga\n6 4\ndirect\n0.000000 0.000000 0.000000 Nb\n0.500000 0.500000 0.000000 Nb\n0.675674 0.175674 0.499999 Nb\n0.175674 0.324325 0.499999 Nb\n0.824325 0.675674 0.499999 Nb\n0.324325 0.824325 0.499999 Nb\n0.874042 0.374042 0.000000 Ga\n0.374042 0.125957 0.000000 Ga\n0.625957 0.874042 0.000000 Ga\n0.125957 0.625957 0.000000 Ga\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Nb",
"Ga"
],
"chemical_system": "Ga-Nb",
"density": 8.172829587352698,
"density_atomic": 0.05884987232500936,
"volume": 169.92390305917982,
"volume_molar": 10.233056627109756,
"formula_full": "Nb6 Ga4",
"formula_reduced": "Nb3Ga2",
"formula_anonymous": "A2B3",
"energy_above_hull": 3.2546245699999994,
"spacegroup": 127
},
{
"id": "jvasp-20117",
"created_at": "2022-09-04T14:38:30.599620Z",
"updated_at": "2022-09-04T14:38:30.599647Z",
"structure_string": "Nb5 Ga13\n1.0\n3.776151 0.000000 -0.353696\n0.000000 3.781084 0.000000\n0.021340 0.000000 20.562308\nNb Ga\n5 13\ndirect\n0.500000 0.000000 -0.000000 Nb\n0.284266 0.000000 0.568534 Nb\n0.892309 0.500000 0.784617 Nb\n0.107691 0.500000 0.215383 Nb\n0.715733 0.000000 0.431466 Nb\n0.771517 0.500000 0.543035 Ga\n0.387978 0.000000 0.775955 Ga\n0.612022 0.000000 0.224045 Ga\n0.164830 0.000000 0.329661 Ga\n0.445213 0.500000 0.890428 Ga\n0.945406 0.000000 0.890814 Ga\n0.000000 0.500000 0.000000 Ga\n0.228483 0.500000 0.456965 Ga\n0.664387 0.500000 0.328774 Ga\n0.335613 0.500000 0.671226 Ga\n0.554787 0.500000 0.109572 Ga\n0.054593 0.000000 0.109186 Ga\n0.835169 0.000000 0.670339 Ga\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Nb",
"Ga"
],
"chemical_system": "Ga-Nb",
"density": 7.753270025306845,
"density_atomic": 0.061304556069076685,
"volume": 293.6160239007029,
"volume_molar": 9.823316807341984,
"formula_full": "Nb5 Ga13",
"formula_reduced": "Nb5Ga13",
"formula_anonymous": "A5B13",
"energy_above_hull": 1.5037420680555555,
"spacegroup": 65
},
{
"id": "jvasp-15008",
"created_at": "2022-09-04T14:35:58.054797Z",
"updated_at": "2022-09-04T14:35:58.054817Z",
"structure_string": "Nb6 Ga2\n1.0\n5.194063 0.000000 -0.000000\n0.000000 5.194063 -0.000000\n-0.000000 -0.000000 5.194063\nNb Ga\n6 2\ndirect\n0.250000 0.000000 0.500000 Nb\n0.750000 0.000000 0.500000 Nb\n0.000000 0.500000 0.250000 Nb\n0.000000 0.500000 0.750000 Nb\n0.500000 0.750000 0.000000 Nb\n0.500000 0.250000 0.000000 Nb\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.500000 Ga\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Nb",
"Ga"
],
"chemical_system": "Ga-Nb",
"density": 8.258251910949097,
"density_atomic": 0.05709109174505803,
"volume": 140.1269402190492,
"volume_molar": 10.548301978340245,
"formula_full": "Nb6 Ga2",
"formula_reduced": "Nb3Ga",
"formula_anonymous": "AB3",
"energy_above_hull": 3.96470763125,
"spacegroup": 223
},
{
"id": "jvasp-20532",
"created_at": "2022-09-04T14:37:34.615024Z",
"updated_at": "2022-09-04T14:37:34.615045Z",
"structure_string": "Nb1 Ga3\n1.0\n3.548485 0.000000 -1.417601\n-0.566325 3.503001 -1.417601\n0.010364 0.012174 5.175958\nNb Ga\n1 3\ndirect\n0.000000 0.000000 0.000000 Nb\n0.500000 0.500000 0.000000 Ga\n0.250000 0.749999 0.500000 Ga\n0.749999 0.249999 0.500000 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Nb",
"Ga"
],
"chemical_system": "Ga-Nb",
"density": 7.78152091929275,
"density_atomic": 0.062052609940022055,
"volume": 64.46143045177736,
"volume_molar": 9.704895194288842,
"formula_full": "Nb1 Ga3",
"formula_reduced": "NbGa3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.97638409375,
"spacegroup": 139
},
{
"id": "jvasp-20261",
"created_at": "2022-09-04T14:37:35.081342Z",
"updated_at": "2022-09-04T14:37:35.081364Z",
"structure_string": "Nb1 Ga3\n1.0\n3.548485 0.000000 -1.417601\n-0.566325 3.503001 -1.417601\n0.010364 0.012174 5.175958\nNb Ga\n1 3\ndirect\n0.000000 0.000000 0.000000 Nb\n0.500000 0.500000 0.000000 Ga\n0.250000 0.749999 0.500000 Ga\n0.749999 0.249999 0.500000 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Nb",
"Ga"
],
"chemical_system": "Ga-Nb",
"density": 7.78152091929275,
"density_atomic": 0.062052609940022055,
"volume": 64.46143045177736,
"volume_molar": 9.704895194288842,
"formula_full": "Nb1 Ga3",
"formula_reduced": "NbGa3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.97638409375,
"spacegroup": 139
},
{
"id": "jvasp-91819",
"created_at": "2022-09-04T14:35:48.084940Z",
"updated_at": "2022-09-04T14:35:48.084963Z",
"structure_string": "Na2 Ga2 Te4\n1.0\n6.526946 0.000000 -3.015537\n-1.393218 6.376516 -3.015537\n-0.610922 -0.758815 7.249054\nNa Ga Te\n2 2 4\ndirect\n0.250000 0.750001 0.500000 Na\n0.000000 0.000000 0.000000 Na\n0.750001 0.250001 0.500000 Ga\n0.500000 0.500000 -0.000000 Ga\n0.426085 0.375000 0.250000 Te\n0.125000 0.573916 0.750000 Te\n0.625001 0.176085 0.750000 Te\n0.823916 0.875001 0.250000 Te\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Na",
"Ga",
"Te"
],
"chemical_system": "Ga-Na-Te",
"density": 4.25062940881715,
"density_atomic": 0.029430237562493577,
"volume": 271.8292702535077,
"volume_molar": 20.4624266019338,
"formula_full": "Na2 Ga2 Te4",
"formula_reduced": "NaGaTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0217392145833334,
"spacegroup": 122
},
{
"id": "jvasp-7641",
"created_at": "2022-09-04T14:37:04.484436Z",
"updated_at": "2022-09-04T14:37:04.484474Z",
"structure_string": "Na2 Ga2 Te4\n1.0\n6.512126 0.003723 -1.751135\n-3.826434 5.269364 -1.751135\n-0.001896 -0.003723 6.743459\nNa Ga Te\n2 2 4\ndirect\n0.250000 0.250000 0.000000 Na\n0.750000 0.749999 0.000001 Na\n0.750000 0.250000 0.500001 Ga\n0.250000 0.750000 0.500001 Ga\n0.677386 0.177386 0.854773 Te\n0.177386 0.322614 0.500000 Te\n0.822614 0.677386 0.500001 Te\n0.322614 0.822613 0.145228 Te\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Na",
"Ga",
"Te"
],
"chemical_system": "Ga-Na-Te",
"density": 4.993036729527147,
"density_atomic": 0.03457047015282652,
"volume": 231.41137406098917,
"volume_molar": 17.41989835075362,
"formula_full": "Na2 Ga2 Te4",
"formula_reduced": "NaGaTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0173367145833334,
"spacegroup": 140
},
{
"id": "jvasp-12795",
"created_at": "2022-09-04T14:37:50.417920Z",
"updated_at": "2022-09-04T14:37:50.417944Z",
"structure_string": "Na12 Ga4 Se12\n1.0\n7.224569 0.000000 0.000000\n0.000000 7.478247 -0.096382\n0.000000 -0.033924 13.203503\nNa Ga Se\n12 4 12\ndirect\n0.470548 0.725617 0.785130 Na\n0.970548 0.774385 0.714870 Na\n0.529452 0.274384 0.214870 Na\n0.029452 0.225616 0.285130 Na\n0.499690 0.331557 0.607059 Na\n0.999690 0.168444 0.892940 Na\n0.500310 0.668444 0.392941 Na\n0.000310 0.831557 0.107060 Na\n0.499526 0.216192 0.899127 Na\n0.999526 0.283809 0.600872 Na\n0.500474 0.783809 0.100873 Na\n0.000474 0.716192 0.399127 Na\n0.642978 0.086250 0.416015 Ga\n0.142978 0.413750 0.083985 Ga\n0.357022 0.913751 0.583985 Ga\n0.857022 0.586251 0.916015 Ga\n0.703105 0.921940 0.572214 Se\n0.203105 0.578061 0.927786 Se\n0.296895 0.078061 0.427786 Se\n0.796895 0.421940 0.072214 Se\n0.255300 0.074674 0.731426 Se\n0.755300 0.425327 0.768574 Se\n0.744700 0.925327 0.268574 Se\n0.244700 0.574674 0.231426 Se\n0.740560 0.884254 0.926685 Se\n0.240560 0.615748 0.573315 Se\n0.259440 0.115747 0.073315 Se\n0.759440 0.384253 0.426685 Se\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Na",
"Ga",
"Se"
],
"chemical_system": "Ga-Na-Se",
"density": 3.4971649416826596,
"density_atomic": 0.039252877209467206,
"volume": 713.3235062128597,
"volume_molar": 15.341909149394914,
"formula_full": "Na12 Ga4 Se12",
"formula_reduced": "Na3GaSe3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 0.1173099178571429,
"spacegroup": 14
},
{
"id": "jvasp-12798",
"created_at": "2022-09-04T14:37:56.402555Z",
"updated_at": "2022-09-04T14:37:56.402577Z",
"structure_string": "Na12 Ga4 S12\n1.0\n6.907935 0.000000 0.000000\n0.000000 7.166408 -0.099427\n0.000000 -0.028362 12.704434\nNa Ga S\n12 4 12\ndirect\n0.463462 0.724229 0.790189 Na\n0.963462 0.775772 0.709810 Na\n0.536539 0.275772 0.209811 Na\n0.036539 0.224229 0.290189 Na\n0.503351 0.338226 0.610369 Na\n0.003350 0.161775 0.889631 Na\n0.496650 0.661775 0.389631 Na\n0.996651 0.838226 0.110369 Na\n0.502650 0.209742 0.898813 Na\n0.002650 0.290258 0.601186 Na\n0.497351 0.790258 0.101186 Na\n0.997351 0.709742 0.398814 Na\n0.357738 0.913899 0.583693 Ga\n0.642263 0.086102 0.416306 Ga\n0.142262 0.413899 0.083693 Ga\n0.857738 0.586102 0.916306 Ga\n0.742975 0.879885 0.926548 S\n0.699310 0.924157 0.570023 S\n0.199310 0.575844 0.929976 S\n0.300691 0.075844 0.429976 S\n0.800691 0.424156 0.070024 S\n0.257429 0.071742 0.728706 S\n0.757430 0.428258 0.771294 S\n0.742571 0.928258 0.271294 S\n0.242571 0.571742 0.228706 S\n0.257026 0.120116 0.073451 S\n0.757026 0.379884 0.426549 S\n0.242975 0.620116 0.573451 S\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Na",
"Ga",
"S"
],
"chemical_system": "Ga-Na-S",
"density": 2.480715709851557,
"density_atomic": 0.04452115158102043,
"volume": 628.9145497291344,
"volume_molar": 13.526471230288811,
"formula_full": "Na12 Ga4 S12",
"formula_reduced": "Na3GaS3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 0.3460141892857143,
"spacegroup": 14
},
{
"id": "jvasp-97695",
"created_at": "2022-09-04T14:35:41.336159Z",
"updated_at": "2022-09-04T14:35:41.336189Z",
"structure_string": "Na16 Ga8 S20\n1.0\n6.119590 0.000000 0.000000\n0.000000 7.973350 -0.171673\n0.000000 0.130092 19.845091\nNa Ga S\n16 8 20\ndirect\n0.743278 0.923083 0.956460 Na\n0.996037 0.114220 0.199732 Na\n0.496037 0.885780 0.300268 Na\n0.003963 0.885780 0.800268 Na\n0.503963 0.114220 0.699732 Na\n0.026223 0.656567 0.215701 Na\n0.973777 0.343432 0.784299 Na\n0.473777 0.656567 0.715701 Na\n0.526223 0.343432 0.284299 Na\n0.540068 0.404060 0.102953 Na\n0.959932 0.404060 0.602953 Na\n0.459932 0.595939 0.897047 Na\n0.756722 0.923083 0.456460 Na\n0.256722 0.076917 0.043541 Na\n0.243278 0.076917 0.543541 Na\n0.040068 0.595940 0.397047 Na\n0.913073 0.344879 0.963735 Ga\n0.933470 0.835057 0.635094 Ga\n0.566530 0.835057 0.135094 Ga\n0.066530 0.164943 0.364906 Ga\n0.413073 0.655121 0.536265 Ga\n0.086927 0.655121 0.036265 Ga\n0.586927 0.344879 0.463735 Ga\n0.433470 0.164943 0.864906 Ga\n0.488570 0.370401 0.791576 S\n0.522745 0.611834 0.424048 S\n0.977255 0.611833 0.924048 S\n0.477255 0.388166 0.575952 S\n0.011430 0.370401 0.291576 S\n0.511430 0.629599 0.208425 S\n0.975695 0.905756 0.326255 S\n0.475695 0.094243 0.173745 S\n0.022745 0.388166 0.075952 S\n0.024305 0.094243 0.673745 S\n0.940609 0.258846 0.470975 S\n0.440609 0.741154 0.029025 S\n0.059391 0.741154 0.529025 S\n0.559391 0.258846 0.970975 S\n0.931325 0.869093 0.097507 S\n0.431325 0.130907 0.402493 S\n0.068676 0.130907 0.902493 S\n0.568676 0.869093 0.597507 S\n0.524305 0.905756 0.826255 S\n0.988570 0.629599 0.708425 S\n",
"nsites": 44,
"nelements": 3,
"elements": [
"Na",
"Ga",
"S"
],
"chemical_system": "Ga-Na-S",
"density": 2.686695601046245,
"density_atomic": 0.04543338906894579,
"volume": 968.4507561879083,
"volume_molar": 13.254879029300056,
"formula_full": "Na16 Ga8 S20",
"formula_reduced": "Na4Ga2S5",
"formula_anonymous": "A2B4C5",
"energy_above_hull": 0.5311164227272729,
"spacegroup": 14
}
]
}