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=id&page=624",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=622",
"results": [
{
"id": "jvasp-11058",
"created_at": "2022-09-04T14:37:29.613199Z",
"updated_at": "2022-09-04T14:37:29.613210Z",
"structure_string": "Mg2 Co4 O8\n1.0\n4.992121 0.000005 2.882207\n1.664046 4.706739 2.882204\n0.000001 -0.000002 5.764412\nMg Co O\n2 4 8\ndirect\n0.875000 0.875003 0.874998 Mg\n0.125002 0.124996 0.125001 Mg\n0.500000 0.500000 0.500000 Co\n0.500000 0.500000 0.000000 Co\n-0.000000 0.500000 0.500000 Co\n0.500000 -0.000000 0.500000 Co\n0.264144 0.264148 0.264145 O\n0.735856 0.735852 0.292436 O\n0.292438 0.735852 0.735854 O\n0.735857 0.292431 0.735856 O\n0.707563 0.264147 0.264145 O\n0.264144 0.707568 0.264144 O\n0.264144 0.264148 0.707564 O\n0.735856 0.735852 0.735855 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mg",
"Co",
"O"
],
"chemical_system": "Co-Mg-O",
"density": 5.055246521919236,
"density_atomic": 0.1033636741365084,
"volume": 135.44410177903256,
"volume_molar": 5.826167471607861,
"formula_full": "Mg2 Co4 O8",
"formula_reduced": "Mg(CoO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.25504355,
"spacegroup": 227
},
{
"id": "jvasp-110580",
"created_at": "2022-09-04T14:38:39.302540Z",
"updated_at": "2022-09-04T14:38:39.302563Z",
"structure_string": "Ho1 Cu4 Ni1\n1.0\n4.965035 0.000000 -0.000000\n-2.482516 4.299846 -0.000000\n0.000000 -0.000000 4.079325\nHo Cu Ni\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Ho\n0.666666 0.333333 0.000000 Cu\n0.499125 0.998252 0.499999 Cu\n0.001749 0.500875 0.499999 Cu\n0.499125 0.500875 0.499999 Cu\n0.333333 0.666668 0.000000 Ni\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ho",
"Cu",
"Ni"
],
"chemical_system": "Cu-Ho-Ni",
"density": 9.110427095648745,
"density_atomic": 0.06889500367136134,
"volume": 87.08904391123669,
"volume_molar": 8.741041351454804,
"formula_full": "Ho1 Cu4 Ni1",
"formula_reduced": "HoCu4Ni",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0934982944444444,
"spacegroup": 187
},
{
"id": "jvasp-110581",
"created_at": "2022-09-04T14:38:39.164882Z",
"updated_at": "2022-09-04T14:38:39.164900Z",
"structure_string": "In1 Ag1 Se2\n1.0\n4.130505 -0.031529 6.135249\n1.849491 3.693433 6.135249\n-0.051488 -0.031529 7.395925\nIn Ag Se\n1 1 2\ndirect\n0.507882 0.507881 0.507881 In\n0.988934 0.988932 0.988933 Ag\n0.122736 0.122736 0.122736 Se\n0.630449 0.630448 0.630449 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"In",
"Ag",
"Se"
],
"chemical_system": "Ag-In-Se",
"density": 5.501515050179659,
"density_atomic": 0.034819083910761,
"volume": 114.87953015225025,
"volume_molar": 17.29551752548788,
"formula_full": "In1 Ag1 Se2",
"formula_reduced": "InAgSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4248684908333332,
"spacegroup": 160
},
{
"id": "jvasp-110582",
"created_at": "2022-09-04T14:38:39.743107Z",
"updated_at": "2022-09-04T14:38:39.743129Z",
"structure_string": "Hf2 Al3 Cu1\n1.0\n4.527245 -0.006396 2.443666\n1.455031 4.287059 2.443666\n-0.008939 -0.006396 5.144646\nHf Al Cu\n2 3 1\ndirect\n0.124436 0.124435 0.124436 Hf\n0.875564 0.875563 0.875567 Hf\n-0.000000 0.500000 0.500001 Al\n0.500000 0.500000 0.000001 Al\n0.500000 -0.000001 0.500001 Al\n0.500000 0.499999 0.500002 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Hf",
"Al",
"Cu"
],
"chemical_system": "Al-Cu-Hf",
"density": 8.323795511205914,
"density_atomic": 0.059976078355011384,
"volume": 100.03988531035161,
"volume_molar": 10.040904515886561,
"formula_full": "Hf2 Al3 Cu1",
"formula_reduced": "Hf2Al3Cu",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.8139591416666665,
"spacegroup": 166
},
{
"id": "jvasp-110584",
"created_at": "2022-09-04T14:38:37.236534Z",
"updated_at": "2022-09-04T14:38:37.236562Z",
"structure_string": "Fe2 Cu1 S3\n1.0\n3.573135 0.000000 0.000000\n-1.786567 3.094425 -0.000000\n0.000000 0.000000 8.653934\nFe Cu S\n2 1 3\ndirect\n0.000000 0.000000 0.269324 Fe\n0.666666 0.333334 0.566351 Fe\n0.333333 0.666668 0.917167 Cu\n0.000000 0.000000 0.019583 S\n0.666666 0.333334 0.322732 S\n0.333333 0.666668 0.654842 S\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Fe",
"Cu",
"S"
],
"chemical_system": "Cu-Fe-S",
"density": 4.710484503369254,
"density_atomic": 0.06270588268154656,
"volume": 95.68480250044728,
"volume_molar": 9.60378915417489,
"formula_full": "Fe2 Cu1 S3",
"formula_reduced": "Fe2CuS3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.184098575,
"spacegroup": 156
},
{
"id": "jvasp-110586",
"created_at": "2022-09-04T14:38:37.473845Z",
"updated_at": "2022-09-04T14:38:37.473864Z",
"structure_string": "Fe2 Co1 Se4\n1.0\n5.551410 0.000565 2.908900\n4.430282 3.345259 2.908900\n-0.028804 -0.009655 6.140405\nFe Co Se\n2 1 4\ndirect\n0.499999 0.499999 0.501534 Fe\n0.760992 0.760994 0.213980 Fe\n0.237261 0.237259 0.787488 Co\n0.618485 0.618487 0.047778 Se\n0.381448 0.381446 0.951161 Se\n0.135497 0.135496 0.524708 Se\n0.866319 0.866321 0.473353 Se\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Fe",
"Co",
"Se"
],
"chemical_system": "Co-Fe-Se",
"density": 7.06548184792802,
"density_atomic": 0.0612266841032159,
"volume": 114.32923573322059,
"volume_molar": 9.835810722409658,
"formula_full": "Fe2 Co1 Se4",
"formula_reduced": "Fe2CoSe4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.5246850523809528,
"spacegroup": 8
},
{
"id": "jvasp-110587",
"created_at": "2022-09-04T14:38:38.147157Z",
"updated_at": "2022-09-04T14:38:38.147166Z",
"structure_string": "Ga2 Ag2 Se2 S2\n1.0\n5.330151 -0.011364 2.519372\n-1.207346 5.191624 2.519372\n-0.009021 -0.011335 6.773984\nGa Ag Se S\n2 2 2 2\ndirect\n0.249145 0.492921 0.501402 Ga\n0.492921 0.249146 0.001402 Ga\n0.735316 0.032876 0.498131 Ag\n0.032875 0.735315 -0.001868 Ag\n0.870663 0.605528 0.742395 Se\n0.605528 0.870663 0.242396 Se\n0.362605 0.160944 0.758070 S\n0.160944 0.362605 0.258071 S\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Ga",
"Ag",
"Se",
"S"
],
"chemical_system": "Ag-Ga-S-Se",
"density": 5.1076601382007025,
"density_atomic": 0.04262969066478645,
"volume": 187.6626331377128,
"volume_molar": 14.126634901844335,
"formula_full": "Ga2 Ag2 Se2 S2",
"formula_reduced": "GaAgSeS",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.5226282379166667,
"spacegroup": 9
},
{
"id": "jvasp-110588",
"created_at": "2022-09-04T14:38:38.294302Z",
"updated_at": "2022-09-04T14:38:38.294317Z",
"structure_string": "Ga2 Hg1 Te4\n1.0\n5.503540 -0.048548 -5.215402\n-1.050692 5.402533 -5.215402\n0.040376 0.048548 7.582068\nGa Hg Te\n2 1 4\ndirect\n0.750000 0.250000 0.500000 Ga\n0.250000 0.750000 0.500001 Ga\n0.000000 0.000000 0.000000 Hg\n0.837891 0.405213 -0.000000 Te\n0.405214 0.837890 0.000000 Te\n0.162110 0.162109 0.567324 Te\n0.594787 0.594786 0.432677 Te\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Ga",
"Hg",
"Te"
],
"chemical_system": "Ga-Hg-Te",
"density": 6.197622778580921,
"density_atomic": 0.0307207946677072,
"volume": 227.85868906438787,
"volume_molar": 19.602815699068806,
"formula_full": "Ga2 Hg1 Te4",
"formula_reduced": "Ga2HgTe4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.1448586166666665,
"spacegroup": 121
},
{
"id": "jvasp-110589",
"created_at": "2022-09-04T14:38:38.698569Z",
"updated_at": "2022-09-04T14:38:38.698606Z",
"structure_string": "Fe1 Co1 Sb4\n1.0\n3.333041 0.000000 0.000000\n0.000000 5.717531 0.013269\n0.000000 -0.000390 6.496363\nFe Co Sb\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 Co\n0.500000 0.302770 0.144212 Sb\n0.500000 0.697230 0.855788 Sb\n0.000000 0.802422 0.355714 Sb\n0.000000 0.197578 0.644286 Sb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Fe",
"Co",
"Sb"
],
"chemical_system": "Co-Fe-Sb",
"density": 8.072255184644751,
"density_atomic": 0.0484653911030754,
"volume": 123.79968186451438,
"volume_molar": 12.425651837188747,
"formula_full": "Fe1 Co1 Sb4",
"formula_reduced": "FeCoSb4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.419163466666667,
"spacegroup": 10
},
{
"id": "jvasp-110590",
"created_at": "2022-09-04T14:38:38.304083Z",
"updated_at": "2022-09-04T14:38:38.304103Z",
"structure_string": "Dy1 Zn1 Si1\n1.0\n4.112893 -0.000000 0.000000\n-2.056446 3.561869 -0.000000\n0.000000 -0.000000 4.029389\nDy Zn Si\n1 1 1\ndirect\n0.333332 0.666667 0.000000 Dy\n0.666666 0.333333 0.500000 Zn\n0.000000 0.000000 0.500000 Si\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Dy",
"Zn",
"Si"
],
"chemical_system": "Dy-Si-Zn",
"density": 7.201370937949638,
"density_atomic": 0.05082257954951324,
"volume": 59.028880993285455,
"volume_molar": 11.849341008228455,
"formula_full": "Dy1 Zn1 Si1",
"formula_reduced": "DyZnSi",
"formula_anonymous": "ABC",
"energy_above_hull": 0.6701385000000003,
"spacegroup": 187
},
{
"id": "jvasp-110593",
"created_at": "2022-09-04T14:38:38.409205Z",
"updated_at": "2022-09-04T14:38:38.409225Z",
"structure_string": "Er2 Ga3 Cu1\n1.0\n4.332079 0.000000 -0.000000\n-2.166040 3.751691 0.000000\n-0.000000 -0.000000 7.121416\nEr Ga Cu\n2 3 1\ndirect\n0.333333 0.666667 0.731685 Er\n0.333333 0.666667 0.261608 Er\n0.666667 0.333333 0.478335 Ga\n0.666667 0.333333 0.046615 Ga\n0.000000 0.000000 0.948263 Ga\n0.000000 0.000000 0.533496 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Er",
"Ga",
"Cu"
],
"chemical_system": "Cu-Er-Ga",
"density": 8.711936021782481,
"density_atomic": 0.05183957890966316,
"volume": 115.74168089705624,
"volume_molar": 11.61687823601793,
"formula_full": "Er2 Ga3 Cu1",
"formula_reduced": "Er2Ga3Cu",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.1507553486111111,
"spacegroup": 156
},
{
"id": "jvasp-110594",
"created_at": "2022-09-04T14:38:38.408593Z",
"updated_at": "2022-09-04T14:38:38.408620Z",
"structure_string": "Dy3 Mn3 Ga2 Si1\n1.0\n6.893729 -0.000000 -0.000000\n-3.446863 5.970144 -0.000000\n-0.000000 0.000000 4.151949\nDy Mn Ga Si\n3 3 2 1\ndirect\n0.002733 0.423701 0.500000 Dy\n0.576299 0.579031 0.500000 Dy\n0.420969 0.997267 0.500000 Dy\n0.010839 0.776679 0.000000 Mn\n0.223321 0.234159 0.000000 Mn\n0.765841 0.989161 0.000000 Mn\n0.000000 0.000000 0.500000 Ga\n0.666667 0.333333 0.000000 Ga\n0.333333 0.666667 0.000000 Si\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Dy",
"Mn",
"Ga",
"Si"
],
"chemical_system": "Dy-Ga-Mn-Si",
"density": 7.966914615420728,
"density_atomic": 0.05266856501369371,
"volume": 170.8799166573082,
"volume_molar": 11.434032346304207,
"formula_full": "Dy3 Mn3 Ga2 Si1",
"formula_reduced": "Dy3Mn3Ga2Si",
"formula_anonymous": "AB2C3D3",
"energy_above_hull": 2.4890049415708804,
"spacegroup": 174
}
]
}