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=3804",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=3802",
"results": [
{
"id": "jvasp-117395",
"created_at": "2022-09-04T14:38:49.813823Z",
"updated_at": "2022-09-04T14:38:49.813849Z",
"structure_string": "Mg2 Ti1 Mn3 S8\n1.0\n6.313812 0.006439 3.637580\n2.101402 5.954444 3.637077\n0.010133 0.008691 7.289411\nMg Ti Mn S\n2 1 3 8\ndirect\n0.872473 0.872437 0.872207 Mg\n0.127534 0.127558 0.127793 Mg\n0.500001 0.500004 0.499994 Ti\n0.499997 0.499999 0.000001 Mn\n0.999996 0.499994 0.500008 Mn\n0.500003 0.000002 0.499999 Mn\n0.736950 0.736982 0.736682 S\n0.261415 0.261527 0.719491 S\n0.261469 0.719275 0.261584 S\n0.719230 0.261456 0.261622 S\n0.738522 0.280721 0.738421 S\n0.280774 0.738548 0.738371 S\n0.263046 0.263016 0.263325 S\n0.738589 0.738473 0.280510 S\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Mg",
"Ti",
"Mn",
"S"
],
"chemical_system": "Mg-Mn-S-Ti",
"density": 3.142754958147125,
"density_atomic": 0.05117031296394678,
"volume": 273.5961378595441,
"volume_molar": 11.76881752558957,
"formula_full": "Mg2 Ti1 Mn3 S8",
"formula_reduced": "Mg2TiMn3S8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.575171296962233,
"spacegroup": 166
},
{
"id": "jvasp-119679",
"created_at": "2022-09-04T14:38:36.767030Z",
"updated_at": "2022-09-04T14:38:36.767049Z",
"structure_string": "Y2 Mg2 Mn2 S8\n1.0\n6.695308 0.146806 3.884893\n2.382997 6.210728 3.725835\n-0.045317 0.031503 7.445500\nY Mg Mn S\n2 2 2 8\ndirect\n0.499998 0.500010 0.499990 Y\n-0.000000 0.499987 0.500011 Y\n0.872688 0.877342 0.877383 Mg\n0.127314 0.122655 0.122616 Mg\n0.499988 0.499998 0.000003 Mn\n0.500004 -0.000002 0.500003 Mn\n0.715223 0.766717 0.748047 S\n0.278860 0.234481 0.726406 S\n0.260316 0.726369 0.234402 S\n0.729739 0.251795 0.233410 S\n0.739671 0.273632 0.765599 S\n0.270260 0.748219 0.766583 S\n0.284783 0.233277 0.251953 S\n0.721160 0.765519 0.273594 S\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Y",
"Mg",
"Mn",
"S"
],
"chemical_system": "Mg-Mn-S-Y",
"density": 3.2005216756157706,
"density_atomic": 0.0455175086086905,
"volume": 307.5739518249254,
"volume_molar": 13.230383085708285,
"formula_full": "Y2 Mg2 Mn2 S8",
"formula_reduced": "YMgMnS4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.0589302487684726,
"spacegroup": 15
},
{
"id": "jvasp-106038",
"created_at": "2022-09-04T14:35:52.822624Z",
"updated_at": "2022-09-04T14:35:52.822657Z",
"structure_string": "Mg3 Mn1 Te4\n1.0\n4.551611 0.000000 -0.000000\n0.000000 4.551611 0.000000\n0.000000 0.000000 12.820899\nMg Mn Te\n3 1 4\ndirect\n0.000000 0.000000 0.753735 Mg\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.246265 Mg\n0.500000 0.500000 0.000000 Mn\n0.000000 0.500000 0.373066 Te\n0.500000 0.000000 0.118809 Te\n0.000000 0.500000 0.881191 Te\n0.500000 0.000000 0.626935 Te\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Mn",
"Te"
],
"chemical_system": "Mg-Mn-Te",
"density": 3.990186889331274,
"density_atomic": 0.030119047362556394,
"volume": 265.6126504832784,
"volume_molar": 19.994459610587306,
"formula_full": "Mg3 Mn1 Te4",
"formula_reduced": "Mg3MnTe4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.6885631822557471,
"spacegroup": 115
},
{
"id": "jvasp-102715",
"created_at": "2022-09-04T14:36:49.508364Z",
"updated_at": "2022-09-04T14:36:49.508399Z",
"structure_string": "Mg1 Mn1 Te2\n1.0\n4.531576 0.000000 0.000000\n0.000000 4.531576 0.000000\n-0.000000 -0.000000 6.360966\nMg Mn Te\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mn\n-0.000000 0.500000 0.258801 Te\n0.500000 0.000000 0.741199 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Mn",
"Te"
],
"chemical_system": "Mg-Mn-Te",
"density": 4.251573153659315,
"density_atomic": 0.030622340484457142,
"volume": 130.6235884233037,
"volume_molar": 19.665840901536033,
"formula_full": "Mg1 Mn1 Te2",
"formula_reduced": "MgMnTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.184000456178161,
"spacegroup": 115
},
{
"id": "jvasp-109386",
"created_at": "2022-09-04T14:38:02.232676Z",
"updated_at": "2022-09-04T14:38:02.232702Z",
"structure_string": "Mg1 Mn3 Te4\n1.0\n4.502335 -0.000000 0.000000\n0.000000 4.502335 0.000000\n-0.000000 -0.000000 12.702415\nMg Mn Te\n1 3 4\ndirect\n0.000000 0.000000 0.000000 Mg\n0.499999 0.499999 0.746960 Mn\n0.000000 0.000000 0.500000 Mn\n0.499999 0.499999 0.253040 Mn\n-0.000000 0.499999 0.623536 Te\n0.499999 0.000000 0.376464 Te\n-0.000000 0.499999 0.130941 Te\n0.499999 0.000000 0.869060 Te\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Mn",
"Te"
],
"chemical_system": "Mg-Mn-Te",
"density": 4.511145004283313,
"density_atomic": 0.031069057419226328,
"volume": 257.49091425764965,
"volume_molar": 19.383081626008213,
"formula_full": "Mg1 Mn3 Te4",
"formula_reduced": "MgMn3Te4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 2.2334264801005745,
"spacegroup": 115
},
{
"id": "jvasp-37199",
"created_at": "2022-09-04T14:38:04.549975Z",
"updated_at": "2022-09-04T14:38:04.550005Z",
"structure_string": "Mg3 Mo1\n1.0\n4.192164 -0.000000 -0.000000\n-0.000000 4.192164 -0.000000\n0.000000 0.000000 4.192164\nMg Mo\n3 1\ndirect\n0.500000 0.500000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.000000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Mo\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mg",
"Mo"
],
"chemical_system": "Mg-Mo",
"density": 3.805819877685439,
"density_atomic": 0.05429316992342088,
"volume": 73.6740920753365,
"volume_molar": 11.091893821071924,
"formula_full": "Mg3 Mo1",
"formula_reduced": "Mg3Mo",
"formula_anonymous": "AB3",
"energy_above_hull": 0.9285132625,
"spacegroup": 221
},
{
"id": "jvasp-91880",
"created_at": "2022-09-04T14:36:10.372860Z",
"updated_at": "2022-09-04T14:36:10.372882Z",
"structure_string": "Mg7 Mo1\n1.0\n6.208077 0.000000 -0.000000\n-3.104039 5.376352 0.000000\n0.000000 -0.000000 4.914906\nMg Mo\n7 1\ndirect\n0.169463 0.834730 0.250000 Mg\n0.665269 0.330536 0.250000 Mg\n0.665269 0.834730 0.250000 Mg\n0.322530 0.177470 0.750001 Mg\n0.322530 0.645060 0.750001 Mg\n0.854940 0.177470 0.750001 Mg\n0.833333 0.666667 0.750001 Mg\n0.166667 0.333333 0.250000 Mo\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mg",
"Mo"
],
"chemical_system": "Mg-Mo",
"density": 2.693352286167484,
"density_atomic": 0.04876744253063561,
"volume": 164.04386994405982,
"volume_molar": 12.34869094522827,
"formula_full": "Mg7 Mo1",
"formula_reduced": "Mg7Mo",
"formula_anonymous": "AB7",
"energy_above_hull": 0.0293436562499999,
"spacegroup": 187
},
{
"id": "jvasp-79166",
"created_at": "2022-09-04T14:37:51.537153Z",
"updated_at": "2022-09-04T14:37:51.537178Z",
"structure_string": "Mg3 Mo1\n1.0\n6.131840 0.256632 0.000000\n-1.421834 2.462690 -0.000000\n0.000000 0.000000 4.889066\nMg Mo\n3 1\ndirect\n0.650994 0.650993 0.250000 Mg\n0.329602 0.329602 0.750001 Mg\n0.867956 0.367955 0.750001 Mg\n0.151448 0.651448 0.250000 Mo\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mg",
"Mo"
],
"chemical_system": "Mg-Mo",
"density": 3.708235301290895,
"density_atomic": 0.05290104518857499,
"volume": 75.61287278429572,
"volume_molar": 11.383784079375047,
"formula_full": "Mg3 Mo1",
"formula_reduced": "Mg3Mo",
"formula_anonymous": "AB3",
"energy_above_hull": 0.9385082625,
"spacegroup": 25
},
{
"id": "jvasp-111847",
"created_at": "2022-09-04T14:38:42.108002Z",
"updated_at": "2022-09-04T14:38:42.108026Z",
"structure_string": "Mg6 Mo2 N8\n1.0\n5.799665 -0.012975 -0.045396\n1.407187 5.626377 -0.045396\n0.006118 0.004765 6.049535\nMg Mo N\n6 2 8\ndirect\n0.150118 0.615102 0.168262 Mg\n0.849883 0.384897 0.831736 Mg\n0.384898 0.849882 0.831736 Mg\n0.615102 0.150117 0.168262 Mg\n0.113718 0.113718 0.323573 Mg\n0.886282 0.886281 0.676425 Mg\n0.668223 0.668222 0.330359 Mo\n0.331778 0.331777 0.669638 Mo\n0.124699 0.124698 0.681786 N\n0.875301 0.875300 0.318212 N\n0.601823 0.151373 0.820248 N\n0.398177 0.848626 0.179750 N\n0.848626 0.398176 0.179750 N\n0.151375 0.601823 0.820248 N\n0.356947 0.356947 0.365699 N\n0.643053 0.643052 0.634299 N\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Mg",
"Mo",
"N"
],
"chemical_system": "Mg-Mo-N",
"density": 3.78121352329675,
"density_atomic": 0.0810061110815646,
"volume": 197.5159625165772,
"volume_molar": 7.434180803885698,
"formula_full": "Mg6 Mo2 N8",
"formula_reduced": "Mg3MoN4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 3.37721700625,
"spacegroup": 12
},
{
"id": "jvasp-22723",
"created_at": "2022-09-04T14:36:17.257429Z",
"updated_at": "2022-09-04T14:36:17.257448Z",
"structure_string": "Mg2 Mo2 N4\n1.0\n2.924563 0.000000 0.000000\n-1.462282 2.532746 0.000000\n-0.000000 0.000000 10.578468\nMg Mo N\n2 2 4\ndirect\n0.000000 0.000000 0.000000 Mg\n0.000000 0.000000 0.500000 Mg\n0.666666 0.333332 0.250000 Mo\n0.333336 0.666671 0.750000 Mo\n0.333334 0.666667 0.127311 N\n0.333334 0.666667 0.372689 N\n0.666668 0.333336 0.627311 N\n0.666668 0.333336 0.872689 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Mo",
"N"
],
"chemical_system": "Mg-Mo-N",
"density": 6.283809435356481,
"density_atomic": 0.10209737847382741,
"volume": 78.35656624671117,
"volume_molar": 5.898428392599493,
"formula_full": "Mg2 Mo2 N4",
"formula_reduced": "MgMoN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.5819353625000003,
"spacegroup": 194
},
{
"id": "jvasp-116318",
"created_at": "2022-09-04T14:38:49.554310Z",
"updated_at": "2022-09-04T14:38:49.554334Z",
"structure_string": "Mg1 Mo1 N1\n1.0\n2.895747 0.000000 0.000000\n0.000000 2.895747 0.000000\n0.000000 0.000000 6.766833\nMg Mo N\n1 1 1\ndirect\n0.000000 0.000000 0.295366 Mg\n0.000000 0.000000 0.749550 Mo\n0.000000 0.000000 -0.003813 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Mg",
"Mo",
"N"
],
"chemical_system": "Mg-Mo-N",
"density": 3.9288206382772075,
"density_atomic": 0.052870639804206754,
"volume": 56.74226775219201,
"volume_molar": 11.390330781510304,
"formula_full": "Mg1 Mo1 N1",
"formula_reduced": "MgMoN",
"formula_anonymous": "ABC",
"energy_above_hull": 3.2322760666666666,
"spacegroup": 99
},
{
"id": "jvasp-93070",
"created_at": "2022-09-04T14:36:13.146352Z",
"updated_at": "2022-09-04T14:36:13.146386Z",
"structure_string": "Na1 Mg6 Mo1\n1.0\n6.230163 0.000069 0.000000\n-3.115022 5.395513 0.000000\n0.000000 0.000000 4.981054\nNa Mg Mo\n1 6 1\ndirect\n0.083337 0.416663 0.250000 Na\n0.107257 0.928621 0.250000 Mg\n0.571378 0.392743 0.250000 Mg\n0.571367 0.928632 0.250000 Mg\n0.422343 0.586190 0.749999 Mg\n0.913810 0.077658 0.749999 Mg\n0.913823 0.586176 0.749999 Mg\n0.416683 0.083317 0.749999 Mo\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Na",
"Mg",
"Mo"
],
"chemical_system": "Mg-Mo-Na",
"density": 2.6256988381885926,
"density_atomic": 0.04777864264017255,
"volume": 167.43882952575876,
"volume_molar": 12.604252501172041,
"formula_full": "Na1 Mg6 Mo1",
"formula_reduced": "NaMg6Mo",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0522748999999999,
"spacegroup": 187
}
]
}