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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=699",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=697",
"results": [
{
"id": "jvasp-51162",
"created_at": "2022-09-04T14:36:54.504591Z",
"updated_at": "2022-09-04T14:36:54.504600Z",
"structure_string": "Sr1 Mn2 Si1\n1.0\n-0.000000 3.430100 3.430100\n3.430100 -0.000000 3.430100\n3.430100 3.430100 0.000000\nSr Mn Si\n1 2 1\ndirect\n0.750000 0.750000 0.750000 Sr\n0.000000 0.000000 0.000000 Mn\n0.250000 0.250000 0.250000 Mn\n0.500000 0.500000 0.500000 Si\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Mn",
"Si"
],
"chemical_system": "Mn-Si-Sr",
"density": 4.640902139130846,
"density_atomic": 0.049557529840780615,
"volume": 80.714273145802,
"volume_molar": 12.15181785562769,
"formula_full": "Sr1 Mn2 Si1",
"formula_reduced": "SrMn2Si",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.903169848189655,
"spacegroup": 216
},
{
"id": "jvasp-91798",
"created_at": "2022-09-04T14:36:00.485433Z",
"updated_at": "2022-09-04T14:36:00.485447Z",
"structure_string": "Sm2 Mn2 Si4\n1.0\n0.000000 -0.000000 -3.980032\n-4.030737 0.000000 0.000000\n2.015369 8.748316 -0.000000\nSm Mn Si\n2 2 4\ndirect\n0.750000 0.102079 0.204159 Sm\n0.250000 0.897921 0.795842 Sm\n0.750000 0.749739 0.499477 Mn\n0.250000 0.250261 0.500523 Mn\n0.750000 0.322150 0.644300 Si\n0.250000 0.677850 0.355701 Si\n0.750000 0.463332 0.926662 Si\n0.250000 0.536669 0.073338 Si\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Sm",
"Mn",
"Si"
],
"chemical_system": "Mn-Si-Sm",
"density": 6.187338639222119,
"density_atomic": 0.057002578225746114,
"volume": 140.34452912494183,
"volume_molar": 10.564681366078991,
"formula_full": "Sm2 Mn2 Si4",
"formula_reduced": "SmMnSi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.859608329094827,
"spacegroup": 63
},
{
"id": "jvasp-17240",
"created_at": "2022-09-04T14:38:01.876131Z",
"updated_at": "2022-09-04T14:38:01.876157Z",
"structure_string": "Sm1 Mn2 Si2\n1.0\n3.718918 0.000000 -1.314493\n-0.464622 3.689780 -1.314493\n-0.002139 -0.002426 5.911911\nSm Mn Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.750000 0.249999 0.500000 Mn\n0.250000 0.749999 0.500000 Mn\n0.623378 0.623378 0.246757 Si\n0.376622 0.376621 0.753244 Si\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sm",
"Mn",
"Si"
],
"chemical_system": "Mn-Si-Sm",
"density": 6.478542655783865,
"density_atomic": 0.06165268895566991,
"volume": 81.09946353832429,
"volume_molar": 9.767847699765532,
"formula_full": "Sm1 Mn2 Si2",
"formula_reduced": "Sm(MnSi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.357540111551724,
"spacegroup": 139
},
{
"id": "jvasp-35064",
"created_at": "2022-09-04T14:37:41.620868Z",
"updated_at": "2022-09-04T14:37:41.620898Z",
"structure_string": "Sm2 Mn2 Si2\n1.0\n3.994332 0.000000 0.000000\n0.000000 3.994332 0.000000\n0.000000 0.000000 7.152039\nSm Mn Si\n2 2 2\ndirect\n0.500000 0.000000 0.329931 Sm\n0.000000 0.500000 0.670069 Sm\n0.500000 0.500000 0.000000 Mn\n0.000000 0.000000 0.000000 Mn\n0.500000 0.000000 0.806680 Si\n0.000000 0.500000 0.193320 Si\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sm",
"Mn",
"Si"
],
"chemical_system": "Mn-Si-Sm",
"density": 6.792523227419652,
"density_atomic": 0.05258151041269004,
"volume": 114.10855171159096,
"volume_molar": 11.452962672115662,
"formula_full": "Sm2 Mn2 Si2",
"formula_reduced": "SmMnSi",
"formula_anonymous": "ABC",
"energy_above_hull": 2.4737082387931038,
"spacegroup": 129
},
{
"id": "jvasp-57640",
"created_at": "2022-09-04T14:37:54.064780Z",
"updated_at": "2022-09-04T14:37:54.064808Z",
"structure_string": "Mn10 Si6\n1.0\n3.370552 -5.837967 -0.000000\n3.370552 5.837967 0.000000\n-0.000000 0.000000 4.601316\nMn Si\n10 6\ndirect\n0.235602 0.235602 0.750001 Mn\n0.764397 0.764397 0.250000 Mn\n0.235602 -0.000000 0.250000 Mn\n-0.000000 0.764398 0.750001 Mn\n0.764398 -0.000000 0.750001 Mn\n-0.000000 0.235602 0.250000 Mn\n0.333333 0.666667 0.500000 Mn\n0.666667 0.333333 0.000000 Mn\n0.666667 0.333333 0.500000 Mn\n0.333333 0.666667 0.000000 Mn\n-0.000000 0.392919 0.750001 Si\n0.607081 -0.000000 0.250000 Si\n0.392919 0.392919 0.250000 Si\n0.607080 0.607080 0.750001 Si\n0.392919 -0.000000 0.750001 Si\n-0.000000 0.607081 0.250000 Si\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Mn",
"Si"
],
"chemical_system": "Mn-Si",
"density": 6.583159315316855,
"density_atomic": 0.08835787440276814,
"volume": 181.08176671460015,
"volume_molar": 6.81562430140503,
"formula_full": "Mn10 Si6",
"formula_reduced": "Mn5Si3",
"formula_anonymous": "A3B5",
"energy_above_hull": 4.424529000862068,
"spacegroup": 193
},
{
"id": "jvasp-98116",
"created_at": "2022-09-04T14:36:15.338075Z",
"updated_at": "2022-09-04T14:36:15.338094Z",
"structure_string": "Mn40 Si16\n1.0\n8.474242 -0.000000 0.000000\n-0.000000 8.686537 -0.000000\n-0.000000 0.000000 8.686537\nMn Si\n40 16\ndirect\n0.000000 0.866691 0.866691 Mn\n0.848744 0.220925 0.175200 Mn\n0.534847 0.868149 0.042612 Mn\n0.284847 0.542612 0.631851 Mn\n0.329234 0.422076 0.184200 Mn\n0.929449 0.005862 0.399218 Mn\n0.250000 0.633309 0.366691 Mn\n0.679449 0.899218 0.494138 Mn\n0.820551 0.505862 0.100782 Mn\n0.570551 0.600782 0.994138 Mn\n0.420766 0.922076 0.315800 Mn\n0.401256 0.279075 0.675200 Mn\n0.098744 0.324801 0.720926 Mn\n0.429449 0.994138 0.600782 Mn\n0.465153 0.042612 0.868149 Mn\n0.750000 0.366691 0.633309 Mn\n0.348744 0.779075 0.824801 Mn\n0.965153 0.957389 0.131851 Mn\n0.670766 0.184200 0.422076 Mn\n0.651256 0.824801 0.779075 Mn\n0.750000 0.045276 0.954724 Mn\n0.598744 0.675200 0.279075 Mn\n0.000000 0.545276 0.545276 Mn\n0.179449 0.100782 0.505862 Mn\n0.784847 0.457388 0.368149 Mn\n0.250000 0.954724 0.045276 Mn\n0.170766 0.815800 0.577925 Mn\n0.034847 0.131851 0.957389 Mn\n0.151256 0.175200 0.220925 Mn\n0.079234 0.684200 0.077924 Mn\n0.715153 0.631851 0.542612 Mn\n0.901256 0.720926 0.324801 Mn\n0.579234 0.315800 0.922076 Mn\n0.215153 0.368149 0.457388 Mn\n0.070551 0.399218 0.005862 Mn\n0.320551 0.494138 0.899218 Mn\n0.829234 0.577925 0.815800 Mn\n0.920766 0.077924 0.684200 Mn\n0.500000 0.133309 0.133309 Mn\n0.500000 0.454724 0.454724 Mn\n0.298366 0.236105 0.965686 Si\n0.401768 0.195946 0.379892 Si\n0.451634 0.736105 0.534315 Si\n0.701634 0.965686 0.236105 Si\n0.798366 0.763895 0.034315 Si\n0.548366 0.534315 0.736105 Si\n0.098232 0.620108 0.804055 Si\n0.848232 0.304055 0.879893 Si\n0.201634 0.034315 0.763895 Si\n0.048366 0.465685 0.263895 Si\n0.151768 0.879893 0.304055 Si\n0.901768 0.804055 0.620108 Si\n0.348232 0.695946 0.120108 Si\n0.598232 0.379892 0.195946 Si\n0.651768 0.120108 0.695946 Si\n0.951634 0.263895 0.465685 Si\n",
"nsites": 56,
"nelements": 2,
"elements": [
"Mn",
"Si"
],
"chemical_system": "Mn-Si",
"density": 6.8737027614284,
"density_atomic": 0.08757775683814048,
"volume": 639.4317692276376,
"volume_molar": 6.876335929829769,
"formula_full": "Mn40 Si16",
"formula_reduced": "Mn5Si2",
"formula_anonymous": "A2B5",
"energy_above_hull": 4.447666200985221,
"spacegroup": 92
},
{
"id": "jvasp-19710",
"created_at": "2022-09-04T14:38:27.081223Z",
"updated_at": "2022-09-04T14:38:27.081254Z",
"structure_string": "Mn4 Si4\n1.0\n4.535196 -0.000000 -0.000000\n-0.000000 4.535196 -0.000000\n-0.000000 -0.000000 4.535196\nMn Si\n4 4\ndirect\n0.864210 0.635791 0.364210 Mn\n0.635791 0.364210 0.864210 Mn\n0.364210 0.864210 0.635791 Mn\n0.135790 0.135790 0.135790 Mn\n0.155402 0.344598 0.655402 Si\n0.344598 0.655402 0.155402 Si\n0.655402 0.155402 0.344598 Si\n0.844599 0.844599 0.844599 Si\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mn",
"Si"
],
"chemical_system": "Mn-Si",
"density": 5.911833296931741,
"density_atomic": 0.08576336333525887,
"volume": 93.27992383795721,
"volume_molar": 7.021810392928223,
"formula_full": "Mn4 Si4",
"formula_reduced": "MnSi",
"formula_anonymous": "AB",
"energy_above_hull": 2.286502920689655,
"spacegroup": 198
},
{
"id": "jvasp-17632",
"created_at": "2022-09-04T14:38:20.397426Z",
"updated_at": "2022-09-04T14:38:20.397447Z",
"structure_string": "Mn3 Si1\n1.0\n3.455290 -0.000000 1.994913\n1.151763 3.257679 1.994913\n-0.000000 -0.000000 3.989825\nMn Si\n3 1\ndirect\n0.250000 0.250000 0.250000 Mn\n0.749999 0.750000 0.750000 Mn\n0.499999 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Si\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mn",
"Si"
],
"chemical_system": "Mn-Si",
"density": 7.132369999002349,
"density_atomic": 0.08906628797143455,
"volume": 44.91037059142832,
"volume_molar": 6.761414332133644,
"formula_full": "Mn3 Si1",
"formula_reduced": "Mn3Si",
"formula_anonymous": "AB3",
"energy_above_hull": 3.8970500810344815,
"spacegroup": 225
},
{
"id": "jvasp-92166",
"created_at": "2022-09-04T14:36:04.448568Z",
"updated_at": "2022-09-04T14:36:04.448591Z",
"structure_string": "Mn4 Si4\n1.0\n4.535093 0.000000 -0.000000\n-0.000000 4.535093 0.000000\n0.000000 -0.000000 4.535093\nMn Si\n4 4\ndirect\n0.364208 0.864207 0.635792 Mn\n0.864207 0.635792 0.364208 Mn\n0.635792 0.364208 0.864207 Mn\n0.135792 0.135792 0.135792 Mn\n0.655404 0.155405 0.344595 Si\n0.155405 0.344595 0.655404 Si\n0.344595 0.655404 0.155405 Si\n0.844595 0.844595 0.844595 Si\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mn",
"Si"
],
"chemical_system": "Mn-Si",
"density": 5.912236110717026,
"density_atomic": 0.08576920698193981,
"volume": 93.27356846944544,
"volume_molar": 7.021331981381227,
"formula_full": "Mn4 Si4",
"formula_reduced": "MnSi",
"formula_anonymous": "AB",
"energy_above_hull": 2.286502920689655,
"spacegroup": 198
},
{
"id": "jvasp-107749",
"created_at": "2022-09-04T14:36:07.290809Z",
"updated_at": "2022-09-04T14:36:07.290843Z",
"structure_string": "Mn3 Si1\n1.0\n2.774508 0.000000 0.000000\n0.000000 2.774508 0.000000\n0.000000 -0.000000 5.662624\nMn Si\n3 1\ndirect\n0.000000 0.000000 0.748025 Mn\n0.000000 0.000000 0.251974 Mn\n0.500000 0.500000 -0.000000 Mn\n0.500000 0.500000 0.500000 Si\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mn",
"Si"
],
"chemical_system": "Mn-Si",
"density": 7.348366612361045,
"density_atomic": 0.09176357044120984,
"volume": 43.59028294962302,
"volume_molar": 6.562670492271446,
"formula_full": "Mn3 Si1",
"formula_reduced": "Mn3Si",
"formula_anonymous": "AB3",
"energy_above_hull": 3.917200081034482,
"spacegroup": 123
},
{
"id": "jvasp-106349",
"created_at": "2022-09-04T14:36:34.451382Z",
"updated_at": "2022-09-04T14:36:34.451412Z",
"structure_string": "Mn1 Zn1 Se2\n1.0\n4.093458 0.000000 0.000000\n-2.046730 3.545039 0.000000\n-0.000000 -0.000000 6.731942\nMn Zn Se\n1 1 2\ndirect\n0.333333 0.666667 0.496958 Mn\n0.666667 0.333333 0.998933 Zn\n0.333333 0.666667 0.121356 Se\n0.666667 0.333333 0.630752 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Zn",
"Se"
],
"chemical_system": "Mn-Se-Zn",
"density": 4.729978339175027,
"density_atomic": 0.04094569712357667,
"volume": 97.69036262657221,
"volume_molar": 14.70762786581653,
"formula_full": "Mn1 Zn1 Se2",
"formula_reduced": "MnZnSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.2367535936781608,
"spacegroup": 156
},
{
"id": "jvasp-106025",
"created_at": "2022-09-04T14:36:14.221021Z",
"updated_at": "2022-09-04T14:36:14.221036Z",
"structure_string": "Mn1 Zn1 Se2\n1.0\n3.931627 0.004968 5.921543\n1.790508 3.500256 5.921543\n0.008110 0.004968 7.107904\nMn Zn Se\n1 1 2\ndirect\n0.000696 0.000696 0.000696 Mn\n0.499974 0.499975 0.499972 Zn\n0.126230 0.126230 0.126229 Se\n0.623102 0.623103 0.623099 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Zn",
"Se"
],
"chemical_system": "Mn-Se-Zn",
"density": 4.7381063870625,
"density_atomic": 0.04101605866926284,
"volume": 97.52277838917695,
"volume_molar": 14.682397469147741,
"formula_full": "Mn1 Zn1 Se2",
"formula_reduced": "MnZnSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.2357260936781609,
"spacegroup": 160
}
]
}