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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_full&page=3440",
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"results": [
{
"id": "jvasp-122081",
"created_at": "2022-09-04T14:38:52.988724Z",
"updated_at": "2022-09-04T14:38:52.988748Z",
"structure_string": "Dy2 N6 O20\n1.0\n6.789827 -0.349636 2.141099\n2.225255 7.183190 2.895794\n0.108611 0.066967 6.650750\nDy N O\n2 6 20\ndirect\n0.476684 0.731162 0.592086 Dy\n0.523316 0.268838 0.407914 Dy\n0.066818 0.691383 0.778961 N\n0.933182 0.308617 0.221039 N\n0.468424 0.750627 0.145372 N\n0.531576 0.249373 0.854628 N\n0.845986 0.868168 0.315587 N\n0.154014 0.131832 0.684413 N\n0.575879 0.109789 0.789770 O\n0.470944 0.759057 -0.044175 O\n0.529056 0.240943 0.044175 O\n0.179119 0.281047 0.684764 O\n0.309671 0.046534 0.554623 O\n0.820881 0.718953 0.315236 O\n0.424121 0.890211 0.210229 O\n0.690329 0.953466 0.445377 O\n0.484678 0.406968 0.704585 O\n0.853030 0.291615 0.426553 O\n0.115931 0.313169 0.138724 O\n0.884069 0.686831 0.861275 O\n0.994509 0.930480 0.213873 O\n0.146969 0.708385 0.573447 O\n0.818517 0.316631 0.102307 O\n0.181483 0.683369 0.897693 O\n0.215836 0.451051 0.308184 O\n0.784164 0.548948 0.691816 O\n0.515322 0.593032 0.295415 O\n0.005491 0.069520 0.786127 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Dy",
"N",
"O"
],
"chemical_system": "Dy-N-O",
"density": 3.70467410112057,
"density_atomic": 0.08568693633639467,
"volume": 326.770931453028,
"volume_molar": 7.028073376737307,
"formula_full": "Dy2 N6 O20",
"formula_reduced": "DyN3O10",
"formula_anonymous": "AB3C10",
"energy_above_hull": null,
"spacegroup": 2
},
{
"id": "jvasp-57345",
"created_at": "2022-09-04T14:37:42.692668Z",
"updated_at": "2022-09-04T14:37:42.692690Z",
"structure_string": "Dy2 Mo2 Cl2 O8\n1.0\n6.091449 0.001456 1.513380\n1.776958 5.826506 1.513380\n0.012407 0.009189 6.848161\nDy Mo Cl O\n2 2 2 8\ndirect\n0.778265 0.778266 0.108968 Dy\n0.221736 0.221736 0.891031 Dy\n0.362498 0.362498 0.269742 Mo\n0.637503 0.637504 0.730258 Mo\n0.009082 0.009081 0.237916 Cl\n0.990919 0.990920 0.762084 Cl\n0.490168 0.110308 0.153655 O\n0.110308 0.490168 0.153655 O\n0.294670 0.294670 0.536175 O\n0.889693 0.509833 0.846345 O\n0.705331 0.705332 0.463825 O\n0.509832 0.889693 0.846345 O\n0.542218 0.542219 0.201451 O\n0.457783 0.457783 0.798549 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Dy",
"Mo",
"Cl",
"O"
],
"chemical_system": "Cl-Dy-Mo-O",
"density": 4.893967039216371,
"density_atomic": 0.05764474081354041,
"volume": 242.8669086271871,
"volume_molar": 10.446990783564136,
"formula_full": "Dy2 Mo2 Cl2 O8",
"formula_reduced": "DyMoClO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.4089314953571432,
"spacegroup": 12
},
{
"id": "jvasp-119307",
"created_at": "2022-09-04T14:38:30.088755Z",
"updated_at": "2022-09-04T14:38:30.088773Z",
"structure_string": "Dy2 Mo2 Cl2 O8\n1.0\n6.083768 0.015005 1.515417\n1.759971 5.823655 1.515417\n0.005781 0.004303 6.838316\nDy Mo Cl O\n2 2 2 8\ndirect\n0.778381 0.778382 0.108799 Dy\n0.221619 0.221619 0.891202 Dy\n0.362551 0.362551 0.269715 Mo\n0.637449 0.637450 0.730286 Mo\n0.009087 0.009087 0.238698 Cl\n0.990913 0.990914 0.761303 Cl\n0.110314 0.490297 0.153475 O\n0.490296 0.110315 0.153475 O\n0.294507 0.294507 0.536144 O\n0.509703 0.889686 0.846527 O\n0.705493 0.705494 0.463857 O\n0.889685 0.509704 0.846527 O\n0.542244 0.542245 0.201816 O\n0.457756 0.457756 0.798185 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Dy",
"Mo",
"Cl",
"O"
],
"chemical_system": "Cl-Dy-Mo-O",
"density": 4.911087297253415,
"density_atomic": 0.057846395795949995,
"volume": 242.02026431144017,
"volume_molar": 10.410572131827836,
"formula_full": "Dy2 Mo2 Cl2 O8",
"formula_reduced": "DyMoClO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.407655781071429,
"spacegroup": 12
},
{
"id": "jvasp-107712",
"created_at": "2022-09-04T14:37:02.616267Z",
"updated_at": "2022-09-04T14:37:02.616300Z",
"structure_string": "Dy2 Mn4 Si2 C2\n1.0\n5.586098 0.004483 0.000000\n-4.360468 3.491536 0.000000\n-0.000000 -0.000000 6.961212\nDy Mn Si C\n2 4 2 2\ndirect\n0.544021 0.455979 0.250000 Dy\n0.455979 0.544021 0.750000 Dy\n0.831597 0.168402 0.061849 Mn\n0.168403 0.831598 0.938151 Mn\n0.168403 0.831598 0.561849 Mn\n0.831597 0.168402 0.438151 Mn\n0.265068 0.734933 0.250000 Si\n0.734933 0.265067 0.750000 Si\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Dy",
"Mn",
"Si",
"C"
],
"chemical_system": "C-Dy-Mn-Si",
"density": 7.635642983001164,
"density_atomic": 0.0735791913782659,
"volume": 135.9079899178375,
"volume_molar": 8.184570456938784,
"formula_full": "Dy2 Mn4 Si2 C2",
"formula_reduced": "DyMn2SiC",
"formula_anonymous": "ABCD2",
"energy_above_hull": 3.950965916551724,
"spacegroup": 63
},
{
"id": "jvasp-14570",
"created_at": "2022-09-04T14:36:34.787891Z",
"updated_at": "2022-09-04T14:36:34.787917Z",
"structure_string": "Dy2 Mn4\n1.0\n4.402917 -0.000000 2.542025\n1.467639 4.151110 2.542025\n-0.000000 -0.000000 5.084050\nDy Mn\n2 4\ndirect\n0.125000 0.125000 0.125000 Dy\n0.875001 0.875000 0.875001 Dy\n0.500000 0.000000 0.500000 Mn\n0.000000 0.500000 0.500000 Mn\n0.500000 0.500000 0.500001 Mn\n0.500000 0.500000 0.000001 Mn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Dy",
"Mn"
],
"chemical_system": "Dy-Mn",
"density": 9.734945417669577,
"density_atomic": 0.06457087876147588,
"volume": 92.9211451831705,
"volume_molar": 9.326403597890812,
"formula_full": "Dy2 Mn4",
"formula_reduced": "DyMn2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.957516994252874,
"spacegroup": 227
},
{
"id": "jvasp-100005",
"created_at": "2022-09-04T14:36:31.838629Z",
"updated_at": "2022-09-04T14:36:31.838665Z",
"structure_string": "Dy2 Mn2 Fe2\n1.0\n4.448227 -0.009090 -2.495969\n-1.456115 4.142800 -2.594916\n-0.016583 0.009090 5.100618\nDy Mn Fe\n2 2 2\ndirect\n0.126649 0.876648 0.250000 Dy\n0.873353 0.123352 0.750001 Dy\n0.500001 0.500000 -0.000000 Mn\n0.000001 0.500000 0.500000 Mn\n0.500001 0.500000 0.500000 Fe\n0.500000 -0.000000 0.000000 Fe\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Dy",
"Mn",
"Fe"
],
"chemical_system": "Dy-Fe-Mn",
"density": 9.666225192573522,
"density_atomic": 0.06390228352547718,
"volume": 93.89335824920657,
"volume_molar": 9.423983663430485,
"formula_full": "Dy2 Mn2 Fe2",
"formula_reduced": "DyMnFe",
"formula_anonymous": "ABC",
"energy_above_hull": 2.6820764137931032,
"spacegroup": 74
},
{
"id": "jvasp-110257",
"created_at": "2022-09-04T14:38:15.485785Z",
"updated_at": "2022-09-04T14:38:15.485822Z",
"structure_string": "Dy2 Mn2 Al2\n1.0\n4.662512 0.017493 -2.435737\n-1.663696 4.235487 -2.639110\n0.115478 -0.017493 5.259135\nDy Mn Al\n2 2 2\ndirect\n0.137750 0.887751 0.250000 Dy\n0.862249 0.112249 0.749999 Dy\n0.500000 -0.000000 -0.000001 Mn\n0.500000 0.500000 0.499999 Mn\n0.000000 0.500001 0.500000 Al\n0.499999 0.500000 -0.000001 Al\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Dy",
"Mn",
"Al"
],
"chemical_system": "Al-Dy-Mn",
"density": 7.737429201666706,
"density_atomic": 0.05719167887790381,
"volume": 104.91036664283202,
"volume_molar": 10.529749918439052,
"formula_full": "Dy2 Mn2 Al2",
"formula_reduced": "DyMnAl",
"formula_anonymous": "ABC",
"energy_above_hull": 2.1051721804597703,
"spacegroup": 74
},
{
"id": "jvasp-122057",
"created_at": "2022-09-04T14:38:54.301838Z",
"updated_at": "2022-09-04T14:38:54.301871Z",
"structure_string": "Dy2 Mn12 P7\n1.0\n9.115308 0.000000 0.000000\n-4.557655 7.894088 0.000000\n-0.000000 -0.000000 3.659229\nDy Mn P\n2 12 7\ndirect\n0.666667 0.333333 -0.000000 Dy\n0.333334 0.666667 0.500000 Dy\n0.784957 0.882380 0.500000 Mn\n0.097424 0.215044 0.500000 Mn\n0.117621 0.902577 0.500000 Mn\n0.430104 0.387795 0.500000 Mn\n0.957692 0.569897 0.500000 Mn\n0.612206 0.042309 0.500000 Mn\n0.274848 0.154971 -0.000000 Mn\n0.880124 0.725152 -0.000000 Mn\n0.570017 0.615323 -0.000000 Mn\n0.045306 0.429983 -0.000000 Mn\n0.384678 0.954694 -0.000000 Mn\n0.845029 0.119877 -0.000000 Mn\n0.880629 0.282465 0.500000 P\n0.123326 0.719124 -0.000000 P\n0.280877 0.404202 -0.000000 P\n0.595799 0.876675 -0.000000 P\n0.717535 0.598164 0.500000 P\n0.401836 0.119372 0.500000 P\n0.000000 0.000000 0.000000 P\n",
"nsites": 21,
"nelements": 3,
"elements": [
"Dy",
"Mn",
"P"
],
"chemical_system": "Dy-Mn-P",
"density": 7.5745276588984005,
"density_atomic": 0.07975471995643638,
"volume": 263.3073003261828,
"volume_molar": 7.550826789046984,
"formula_full": "Dy2 Mn12 P7",
"formula_reduced": "Dy2Mn12P7",
"formula_anonymous": "A2B7C12",
"energy_above_hull": 4.466759447454844,
"spacegroup": 174
},
{
"id": "jvasp-105739",
"created_at": "2022-09-04T14:35:41.828866Z",
"updated_at": "2022-09-04T14:35:41.828884Z",
"structure_string": "Dy2 Mg6\n1.0\n6.649028 0.000000 -0.000000\n-3.324514 5.758228 0.000000\n0.000000 0.000000 5.164128\nDy Mg\n2 6\ndirect\n0.666667 0.333333 0.250000 Dy\n0.333334 0.666667 0.750000 Dy\n0.164072 0.328144 0.250000 Mg\n0.164072 0.835929 0.250000 Mg\n0.671857 0.835929 0.250000 Mg\n0.328144 0.164071 0.750000 Mg\n0.835929 0.164071 0.750000 Mg\n0.835929 0.671857 0.750000 Mg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Dy",
"Mg"
],
"chemical_system": "Dy-Mg",
"density": 3.9542962913485495,
"density_atomic": 0.04046187181186639,
"volume": 197.71700224836889,
"volume_molar": 14.883495227311425,
"formula_full": "Dy2 Mg6",
"formula_reduced": "DyMg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0013325,
"spacegroup": 194
},
{
"id": "jvasp-117241",
"created_at": "2022-09-04T14:38:46.495082Z",
"updated_at": "2022-09-04T14:38:46.495104Z",
"structure_string": "Dy2 Mg2 V2 S8\n1.0\n6.612071 0.003176 3.884256\n2.208719 6.118776 3.804902\n0.019974 -0.000898 7.536276\nDy Mg V S\n2 2 2 8\ndirect\n0.500000 0.500001 0.499999 Dy\n-0.000000 0.499998 0.500002 Dy\n0.877977 0.872027 0.872019 Mg\n0.122023 0.127972 0.127982 Mg\n0.499999 0.500001 -0.000000 V\n0.500001 1.000001 0.500000 V\n0.712394 0.755149 0.755146 S\n0.266917 0.233333 0.732815 S\n0.266929 0.732812 0.233352 S\n0.722686 0.244865 0.244838 S\n0.733068 0.267188 0.766649 S\n0.277313 0.755137 0.755161 S\n0.287606 0.244850 0.244856 S\n0.733085 0.766667 0.267186 S\n",
"nsites": 14,
"nelements": 4,
"elements": [
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"Mg",
"V",
"S"
],
"chemical_system": "Dy-Mg-S-V",
"density": 3.993370264165687,
"density_atomic": 0.045993845716238366,
"volume": 304.38854985890487,
"volume_molar": 13.093362092732882,
"formula_full": "Dy2 Mg2 V2 S8",
"formula_reduced": "DyMgVS4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.81588425,
"spacegroup": 74
},
{
"id": "jvasp-111852",
"created_at": "2022-09-04T14:38:53.638659Z",
"updated_at": "2022-09-04T14:38:53.638694Z",
"structure_string": "Dy2 Mg2 Mn2 S8\n1.0\n6.587107 -0.163637 4.068159\n2.172711 6.066658 3.716712\n0.063376 -0.125871 7.642337\nDy Mg Mn S\n2 2 2 8\ndirect\n0.500001 0.500000 0.499998 Dy\n-0.000000 0.499999 0.500001 Dy\n0.871546 0.878454 0.878458 Mg\n0.128457 0.121545 0.121542 Mg\n0.500001 0.499999 0.000000 Mn\n0.500003 -0.000002 0.500001 Mn\n0.716334 0.745985 0.768466 S\n0.259366 0.234250 0.725754 S\n0.280631 0.725744 0.234254 S\n0.730784 0.231535 0.254015 S\n0.719368 0.274254 0.765747 S\n0.269218 0.768466 0.745982 S\n0.283666 0.254017 0.231533 S\n0.740636 0.765748 0.274247 S\n",
"nsites": 14,
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"elements": [
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"Mn",
"S"
],
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"density": 3.983373870522438,
"density_atomic": 0.04538315815589415,
"volume": 308.4844812233885,
"volume_molar": 13.269549772877307,
"formula_full": "Dy2 Mg2 Mn2 S8",
"formula_reduced": "DyMgMnS4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.8182818273399015,
"spacegroup": 15
},
{
"id": "jvasp-40441",
"created_at": "2022-09-04T14:38:09.851752Z",
"updated_at": "2022-09-04T14:38:09.851774Z",
"structure_string": "Dy2 Mg1 Tl1\n1.0\n-0.000000 3.749573 3.749573\n3.749573 0.000000 3.749573\n3.749573 3.749573 -0.000000\nDy Mg Tl\n2 1 1\ndirect\n0.500000 0.500000 0.500000 Dy\n0.000000 0.000000 0.000000 Dy\n0.249999 0.249999 0.249999 Mg\n0.749999 0.749999 0.749999 Tl\n",
"nsites": 4,
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"elements": [
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"Mg",
"Tl"
],
"chemical_system": "Dy-Mg-Tl",
"density": 8.720452253769471,
"density_atomic": 0.0379388843731806,
"volume": 105.43272597724678,
"volume_molar": 15.873267913637214,
"formula_full": "Dy2 Mg1 Tl1",
"formula_reduced": "Dy2MgTl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3920435687499999,
"spacegroup": 225
}
]
}