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=-created_at&page=594",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=592",
"results": [
{
"id": "jvasp-40965",
"created_at": "2022-09-04T14:38:36.535498Z",
"updated_at": "2022-09-04T14:38:36.535534Z",
"structure_string": "Pm2 Pt1 Rh1\n1.0\n0.000000 3.541490 3.541490\n3.541490 0.000000 3.541490\n3.541490 3.541490 0.000000\nPm Pt Rh\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Pm\n0.500000 0.500000 0.500000 Pm\n0.250000 0.250000 0.250000 Pt\n0.750000 0.750000 0.750000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Pt",
"Rh"
],
"chemical_system": "Pm-Pt-Rh",
"density": 10.990833101631672,
"density_atomic": 0.04502688842611414,
"volume": 88.8358076655399,
"volume_molar": 13.374543457254207,
"formula_full": "Pm2 Pt1 Rh1",
"formula_reduced": "Pm2PtRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.9308091875,
"spacegroup": 225
},
{
"id": "jvasp-56571",
"created_at": "2022-09-04T14:38:36.531985Z",
"updated_at": "2022-09-04T14:38:36.532026Z",
"structure_string": "Ba5 Al5 Sn1\n1.0\n3.052835 -5.287666 -0.000000\n3.052835 5.287666 -0.000000\n-0.000000 -0.000000 11.125480\nBa Al Sn\n5 5 1\ndirect\n0.666668 0.333334 0.799975 Ba\n0.666668 0.333334 0.200025 Ba\n0.000000 0.000000 0.673202 Ba\n0.000000 0.000000 0.326798 Ba\n0.333334 0.666668 0.000000 Ba\n0.972325 0.486162 0.500000 Al\n0.333334 0.666668 0.676464 Al\n0.513840 0.486162 0.500000 Al\n0.513839 0.027677 0.500000 Al\n0.333334 0.666668 0.323536 Al\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 11,
"nelements": 3,
"elements": [
"Ba",
"Al",
"Sn"
],
"chemical_system": "Al-Ba-Sn",
"density": 4.346879322526169,
"density_atomic": 0.03062503440406063,
"volume": 359.1832699636572,
"volume_molar": 19.664111003256576,
"formula_full": "Ba5 Al5 Sn1",
"formula_reduced": "Ba5Al5Sn",
"formula_anonymous": "AB5C5",
"energy_above_hull": 0.7998923227272727,
"spacegroup": 187
},
{
"id": "jvasp-110660",
"created_at": "2022-09-04T14:38:36.529598Z",
"updated_at": "2022-09-04T14:38:36.529632Z",
"structure_string": "K2 Na1 Nd1 Br6\n1.0\n6.941896 -0.000000 4.007905\n2.313965 6.544882 4.007905\n-0.000000 -0.000000 8.015811\nK Na Nd Br\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500001 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Nd\n0.748127 0.251873 0.251874 Br\n0.251874 0.251873 0.748127 Br\n0.251874 0.748126 0.748127 Br\n0.251874 0.748126 0.251874 Br\n0.748127 0.251873 0.748127 Br\n0.748128 0.748126 0.251874 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Na",
"Nd",
"Br"
],
"chemical_system": "Br-K-Na-Nd",
"density": 3.3049985073324493,
"density_atomic": 0.02745823435659587,
"volume": 364.189476647753,
"volume_molar": 21.932002916835017,
"formula_full": "K2 Na1 Nd1 Br6",
"formula_reduced": "K2NaNdBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-110849",
"created_at": "2022-09-04T14:38:36.528307Z",
"updated_at": "2022-09-04T14:38:36.528323Z",
"structure_string": "Pm1 Pr1\n1.0\n3.671195 -0.000000 0.000000\n-1.835597 3.179348 0.000000\n-0.000000 -0.000000 5.948175\nPm Pr\n1 1\ndirect\n0.666667 0.333334 0.500000 Pm\n0.333333 0.666667 -0.000000 Pr\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pm",
"Pr"
],
"chemical_system": "Pm-Pr",
"density": 6.838260106331613,
"density_atomic": 0.028807179470750642,
"volume": 69.42713714928944,
"volume_molar": 20.904999623842304,
"formula_full": "Pm1 Pr1",
"formula_reduced": "PmPr",
"formula_anonymous": "AB",
"energy_above_hull": 1.0994405125000002,
"spacegroup": 187
},
{
"id": "jvasp-110847",
"created_at": "2022-09-04T14:38:36.525891Z",
"updated_at": "2022-09-04T14:38:36.525920Z",
"structure_string": "Pm6 Hg2\n1.0\n7.007413 0.000000 0.000000\n-3.503707 6.068597 0.000000\n-0.000000 -0.000000 5.495054\nPm Hg\n6 2\ndirect\n0.174392 0.348784 0.250000 Pm\n0.651216 0.825608 0.250000 Pm\n0.174392 0.825608 0.250000 Pm\n0.825607 0.651217 0.749999 Pm\n0.348783 0.174392 0.749999 Pm\n0.825607 0.174392 0.749999 Pm\n0.333333 0.666667 0.749999 Hg\n0.666666 0.333333 0.250000 Hg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pm",
"Hg"
],
"chemical_system": "Hg-Pm",
"density": 9.033128152829669,
"density_atomic": 0.034235132244533804,
"volume": 233.67808083397514,
"volume_molar": 17.590528691360706,
"formula_full": "Pm6 Hg2",
"formula_reduced": "Pm3Hg",
"formula_anonymous": "AB3",
"energy_above_hull": 1.0417191166666666,
"spacegroup": 194
},
{
"id": "jvasp-31702",
"created_at": "2022-09-04T14:38:36.524477Z",
"updated_at": "2022-09-04T14:38:36.524493Z",
"structure_string": "Nb1 W7 Se16\n1.0\n-1.503667 2.994474 0.000000\n-0.000001 0.000002 13.122869\n10.380498 5.212514 0.000000\nNb W Se\n1 7 16\ndirect\n0.499921 0.750000 0.913748 Nb\n0.500075 0.250000 0.583358 W\n0.499923 0.750000 0.417417 W\n0.000075 0.250000 0.333225 W\n0.999923 0.750000 0.170579 W\n0.500075 0.250000 0.083350 W\n0.999921 0.750000 0.664386 W\n0.000076 0.250000 0.833440 W\n0.999922 0.877820 0.335584 Se\n0.499922 0.622214 0.582333 Se\n0.000077 0.122581 0.666780 Se\n0.500076 0.122601 0.416652 Se\n0.499921 0.877786 0.582333 Se\n0.999920 0.619629 0.828619 Se\n0.500076 0.122459 0.916741 Se\n0.500076 0.377540 0.916741 Se\n0.999920 0.880372 0.828619 Se\n0.999923 0.622180 0.335584 Se\n0.499922 0.877329 0.086903 Se\n0.000076 0.377505 0.166635 Se\n0.000076 0.122495 0.166635 Se\n0.499922 0.622671 0.086903 Se\n0.500075 0.377399 0.416652 Se\n0.000076 0.377419 0.666780 Se\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Nb",
"W",
"Se"
],
"chemical_system": "Nb-Se-W",
"density": 8.593027175709352,
"density_atomic": 0.04698801666021399,
"volume": 510.76852580418534,
"volume_molar": 12.816333159043737,
"formula_full": "Nb1 W7 Se16",
"formula_reduced": "NbW7Se16",
"formula_anonymous": "AB7C16",
"energy_above_hull": 4.392340552777778,
"spacegroup": 25
},
{
"id": "jvasp-110811",
"created_at": "2022-09-04T14:38:36.521685Z",
"updated_at": "2022-09-04T14:38:36.521709Z",
"structure_string": "La2 Mg1 Cd1\n1.0\n4.811169 0.000000 2.777730\n1.603723 4.536013 2.777730\n-0.000000 -0.000000 5.555459\nLa Mg Cd\n2 1 1\ndirect\n0.250000 0.250000 0.250000 La\n0.750000 0.749999 0.750001 La\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Mg",
"Cd"
],
"chemical_system": "Cd-La-Mg",
"density": 5.677498238535473,
"density_atomic": 0.03299249363038093,
"volume": 121.23969909072362,
"volume_molar": 18.25306334060954,
"formula_full": "La2 Mg1 Cd1",
"formula_reduced": "La2MgCd",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.57562175625,
"spacegroup": 225
},
{
"id": "jvasp-109944",
"created_at": "2022-09-04T14:38:36.521241Z",
"updated_at": "2022-09-04T14:38:36.521250Z",
"structure_string": "Dy1 Pu3\n1.0\n4.363808 -0.012177 -3.900710\n-0.881432 4.273880 -3.900710\n0.009950 0.012177 5.853056\nDy Pu\n1 3\ndirect\n0.000000 0.000000 0.000000 Dy\n0.750000 0.250000 0.500001 Pu\n0.250001 0.750000 0.500001 Pu\n0.500000 0.500000 0.000000 Pu\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Dy",
"Pu"
],
"chemical_system": "Dy-Pu",
"density": 13.563069243423376,
"density_atomic": 0.036524857305645024,
"volume": 109.5144593318312,
"volume_molar": 16.487787233789575,
"formula_full": "Dy1 Pu3",
"formula_reduced": "DyPu3",
"formula_anonymous": "AB3",
"energy_above_hull": 6.314986625000001,
"spacegroup": 139
},
{
"id": "jvasp-20842",
"created_at": "2022-09-04T14:38:36.513082Z",
"updated_at": "2022-09-04T14:38:36.513102Z",
"structure_string": "Be4 Al8 O16\n1.0\n4.461366 -0.000000 0.000000\n-0.000000 5.523769 0.000000\n0.000000 0.000000 9.484499\nBe Al O\n4 8 16\ndirect\n0.066654 0.250000 0.407322 Be\n0.933347 0.750000 0.592678 Be\n0.433346 0.250000 0.907322 Be\n0.566654 0.750000 0.092678 Be\n0.000000 0.000000 0.000000 Al\n0.500000 0.000000 0.500000 Al\n0.500000 0.500000 0.500000 Al\n0.000000 0.500000 0.000000 Al\n0.505642 0.250000 0.227040 Al\n0.994359 0.250000 0.727040 Al\n0.494358 0.750000 0.772960 Al\n0.005642 0.750000 0.272960 Al\n0.212874 0.750000 0.090382 O\n0.259360 0.250000 0.066461 O\n0.759360 0.750000 0.433539 O\n0.287127 0.750000 0.590382 O\n0.787127 0.250000 0.909618 O\n0.712874 0.250000 0.409618 O\n0.743006 0.515849 0.163200 O\n0.256995 0.484151 0.836800 O\n0.243005 0.484151 0.336800 O\n0.256995 0.015849 0.836800 O\n0.743006 0.984151 0.163200 O\n0.243005 0.015849 0.336800 O\n0.240640 0.250000 0.566461 O\n0.756995 0.515849 0.663200 O\n0.756995 0.984151 0.663200 O\n0.740641 0.750000 0.933539 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Be",
"Al",
"O"
],
"chemical_system": "Al-Be-O",
"density": 3.608296618500159,
"density_atomic": 0.11979543659488218,
"volume": 233.73177473102675,
"volume_molar": 5.027020169695908,
"formula_full": "Be4 Al8 O16",
"formula_reduced": "BeAl2O4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.9570608142857135,
"spacegroup": 62
},
{
"id": "jvasp-54908",
"created_at": "2022-09-04T14:38:36.508382Z",
"updated_at": "2022-09-04T14:38:36.508407Z",
"structure_string": "Nb5 Sb4\n1.0\n3.338357 -0.000000 0.817447\n1.669178 7.370543 0.408724\n-0.083822 -0.000000 7.567767\nNb Sb\n5 4\ndirect\n0.954821 0.392806 0.697556 Nb\n0.347627 0.697555 0.607194 Nb\n0.000000 0.000000 0.000000 Nb\n0.045181 0.607194 0.302445 Nb\n0.652375 0.302445 0.392806 Nb\n0.635765 0.041503 0.686972 Sb\n0.677267 0.686971 0.958497 Sb\n0.364238 0.958496 0.313028 Sb\n0.322736 0.313028 0.041503 Sb\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Nb",
"Sb"
],
"chemical_system": "Nb-Sb",
"density": 8.462806391665387,
"density_atomic": 0.048202127657998216,
"volume": 186.71374973022841,
"volume_molar": 12.493516474476086,
"formula_full": "Nb5 Sb4",
"formula_reduced": "Nb5Sb4",
"formula_anonymous": "A4B5",
"energy_above_hull": 4.458375711111111,
"spacegroup": 87
},
{
"id": "jvasp-119638",
"created_at": "2022-09-04T14:38:36.507840Z",
"updated_at": "2022-09-04T14:38:36.507869Z",
"structure_string": "Li2 Gd2 S4 O16\n1.0\n7.554616 -0.000000 0.000000\n0.000000 7.554616 0.000000\n-0.000000 -0.000000 5.947031\nLi Gd S O\n2 2 4 16\ndirect\n-0.000000 0.500000 0.750000 Li\n0.500000 0.000000 0.250000 Li\n-0.000000 0.500000 0.250000 Gd\n0.500000 0.000000 0.750000 Gd\n0.222458 0.277542 0.750000 S\n0.777543 0.722458 0.750000 S\n0.722458 0.222458 0.250000 S\n0.277542 0.777543 0.250000 S\n0.903166 0.206309 0.156487 O\n0.096835 0.793691 0.156487 O\n0.293691 0.596835 0.343513 O\n0.706310 0.403166 0.343513 O\n0.793691 0.903166 0.843513 O\n0.206309 0.096835 0.843513 O\n0.913614 0.684419 0.570046 O\n0.315581 0.913614 0.429954 O\n0.413614 0.815582 0.070046 O\n0.586386 0.184419 0.070046 O\n0.596835 0.706310 0.656487 O\n0.684419 0.086386 0.429954 O\n0.815582 0.586386 0.929954 O\n0.184419 0.413614 0.929954 O\n0.086386 0.315581 0.570046 O\n0.403166 0.293691 0.656487 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Gd",
"S",
"O"
],
"chemical_system": "Gd-Li-O-S",
"density": 3.4865000089750624,
"density_atomic": 0.07071088147340454,
"volume": 339.41027886955095,
"volume_molar": 8.516568644763707,
"formula_full": "Li2 Gd2 S4 O16",
"formula_reduced": "LiGd(SO4)2",
"formula_anonymous": "ABC2D8",
"energy_above_hull": 2.9100109583333333,
"spacegroup": 118
},
{
"id": "jvasp-110795",
"created_at": "2022-09-04T14:38:36.506694Z",
"updated_at": "2022-09-04T14:38:36.506722Z",
"structure_string": "In3 Bi1\n1.0\n4.896947 -0.000000 0.000000\n0.000000 4.896947 0.000000\n-0.000000 -0.000000 4.896947\nIn Bi\n3 1\ndirect\n-0.000000 0.500000 0.500000 In\n0.500000 0.000000 0.500000 In\n0.500000 0.500000 -0.000000 In\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 4,
"nelements": 2,
"elements": [
"In",
"Bi"
],
"chemical_system": "Bi-In",
"density": 7.825985461336916,
"density_atomic": 0.034063069480445234,
"volume": 117.42922939743588,
"volume_molar": 17.67938371924222,
"formula_full": "In3 Bi1",
"formula_reduced": "In3Bi",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
}
]
}