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=updated_at&page=1158",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=updated_at&page=1156",
"results": [
{
"id": "jvasp-107996",
"created_at": "2022-09-04T14:36:19.291618Z",
"updated_at": "2022-09-04T14:36:19.291635Z",
"structure_string": "Ti6 N4\n1.0\n4.614045 -0.000613 3.294326\n1.695413 4.291269 3.294326\n-0.000901 -0.000613 5.669391\nTi N\n6 4\ndirect\n0.573170 0.926831 0.250001 Ti\n0.250000 0.573171 0.926830 Ti\n0.926831 0.250001 0.573170 Ti\n0.073169 0.750001 0.426831 Ti\n0.750000 0.426831 0.073170 Ti\n0.426830 0.073171 0.750000 Ti\n0.840842 0.840843 0.840842 N\n0.659159 0.659160 0.659159 N\n0.340841 0.340842 0.340842 N\n0.159159 0.159159 0.159159 N\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Ti",
"N"
],
"chemical_system": "N-Ti",
"density": 5.0761444335629,
"density_atomic": 0.08906378575332353,
"volume": 112.2790808342305,
"volume_molar": 6.761604291871542,
"formula_full": "Ti6 N4",
"formula_reduced": "Ti3N2",
"formula_anonymous": "A2B3",
"energy_above_hull": 4.3226583,
"spacegroup": 167
},
{
"id": "jvasp-43766",
"created_at": "2022-09-04T14:36:19.294213Z",
"updated_at": "2022-09-04T14:36:19.294237Z",
"structure_string": "Li2 Fe1 F6\n1.0\n4.824664 0.000000 -0.002877\n-2.412333 4.178819 0.001439\n0.003500 0.000000 4.336495\nLi Fe F\n2 1 6\ndirect\n0.333327 0.666677 0.500000 Li\n0.666650 0.333323 0.499999 Li\n-0.000012 0.000000 0.000000 Fe\n0.000001 0.690576 0.759219 F\n-0.000022 0.309424 0.240781 F\n0.309424 0.309424 0.759219 F\n0.309399 -0.000000 0.240743 F\n0.690554 0.690577 0.240780 F\n0.690578 -0.000000 0.759255 F\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Li",
"Fe",
"F"
],
"chemical_system": "F-Fe-Li",
"density": 3.489311487556787,
"density_atomic": 0.10293968056531617,
"volume": 87.42984192854006,
"volume_molar": 5.850164607980201,
"formula_full": "Li2 Fe1 F6",
"formula_reduced": "Li2FeF6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.2345374661111108,
"spacegroup": 162
},
{
"id": "jvasp-65725",
"created_at": "2022-09-04T14:36:19.294460Z",
"updated_at": "2022-09-04T14:36:19.294484Z",
"structure_string": "Ba1 Ga1 W2\n1.0\n-2.085945 2.085945 5.024358\n2.085945 -2.085945 5.024358\n2.085945 2.085945 -5.024358\nBa Ga W\n1 1 2\ndirect\n0.250000 0.749999 0.499999 Ba\n0.749999 0.250000 0.499999 Ga\n0.000000 0.000000 0.000000 W\n0.500000 0.500000 0.000000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Ga",
"W"
],
"chemical_system": "Ba-Ga-W",
"density": 10.91356628009262,
"density_atomic": 0.04574184911525051,
"volume": 87.44727371912003,
"volume_molar": 13.16549478536974,
"formula_full": "Ba1 Ga1 W2",
"formula_reduced": "BaGaW2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.19800207375,
"spacegroup": 139
},
{
"id": "jvasp-100306",
"created_at": "2022-09-04T14:36:19.295721Z",
"updated_at": "2022-09-04T14:36:19.295751Z",
"structure_string": "Li1 Si1 Ag2\n1.0\n3.901551 -0.000000 2.252562\n1.300517 3.678418 2.252562\n-0.000000 -0.000000 4.505123\nLi Si Ag\n1 1 2\ndirect\n0.250000 0.250000 0.249999 Li\n0.000000 0.000000 0.000000 Si\n0.750000 0.750001 0.749998 Ag\n0.500000 0.500000 0.499999 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Si",
"Ag"
],
"chemical_system": "Ag-Li-Si",
"density": 6.44031873068511,
"density_atomic": 0.061866417957127405,
"volume": 64.65543233442004,
"volume_molar": 9.734102860413321,
"formula_full": "Li1 Si1 Ag2",
"formula_reduced": "LiSiAg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8222832799999997,
"spacegroup": 216
},
{
"id": "jvasp-67721",
"created_at": "2022-09-04T14:36:19.296886Z",
"updated_at": "2022-09-04T14:36:19.296922Z",
"structure_string": "Be1 Zn1 P1\n1.0\n-1.364193 1.364193 5.594639\n1.364193 -1.364193 5.594639\n1.364193 1.364193 -5.594639\nBe Zn P\n1 1 1\ndirect\n0.990670 0.990670 0.000000 Be\n0.641486 0.641486 0.000000 Zn\n0.367845 0.367845 0.000000 P\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Zn",
"P"
],
"chemical_system": "Be-P-Zn",
"density": 4.202281890241188,
"density_atomic": 0.07203400496605444,
"volume": 41.64699715660306,
"volume_molar": 8.360135970279446,
"formula_full": "Be1 Zn1 P1",
"formula_reduced": "BeZnP",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0806573333333334,
"spacegroup": 107
},
{
"id": "jvasp-91644",
"created_at": "2022-09-04T14:36:19.300918Z",
"updated_at": "2022-09-04T14:36:19.300948Z",
"structure_string": "Nd1 Al1 H6\n1.0\n3.225337 1.862150 2.072636\n-3.225337 1.862150 2.072636\n-0.000000 -3.724298 2.072636\nNd Al H\n1 1 6\ndirect\n0.500001 0.500001 0.500001 Nd\n0.000000 0.000000 0.000000 Al\n0.936768 0.295969 0.295970 H\n0.295970 0.295970 0.936768 H\n0.295969 0.936768 0.295970 H\n0.063234 0.704032 0.704032 H\n0.704032 0.704032 0.063234 H\n0.704032 0.063234 0.704032 H\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Nd",
"Al",
"H"
],
"chemical_system": "Al-H-Nd",
"density": 3.941153385082003,
"density_atomic": 0.10710903210485605,
"volume": 74.6902464039473,
"volume_molar": 5.6224397155456804,
"formula_full": "Nd1 Al1 H6",
"formula_reduced": "NdAlH6",
"formula_anonymous": "ABC6",
"energy_above_hull": 2.6852680375,
"spacegroup": 166
},
{
"id": "jvasp-92540",
"created_at": "2022-09-04T14:36:19.306271Z",
"updated_at": "2022-09-04T14:36:19.306292Z",
"structure_string": "Dy2 In1 Ni2\n1.0\n0.000000 0.000000 -3.648190\n-3.898125 -0.000000 0.000000\n1.949062 7.112421 0.000000\nDy In Ni\n2 1 2\ndirect\n0.500000 0.638226 0.276453 Dy\n0.500000 0.361774 0.723547 Dy\n0.000000 0.000000 0.000000 In\n0.000000 0.801510 0.603021 Ni\n0.000000 0.198489 0.396979 Ni\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Dy",
"In",
"Ni"
],
"chemical_system": "Dy-In-Ni",
"density": 9.147728803367139,
"density_atomic": 0.049433269874219345,
"volume": 101.14645486172101,
"volume_molar": 12.182363771045404,
"formula_full": "Dy2 In1 Ni2",
"formula_reduced": "Dy2InNi2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.818977554,
"spacegroup": 65
},
{
"id": "jvasp-71810",
"created_at": "2022-09-04T14:36:19.314152Z",
"updated_at": "2022-09-04T14:36:19.314186Z",
"structure_string": "Be1 Zn1 Ir2\n1.0\n-1.834342 1.834342 3.929486\n1.834342 -1.834342 3.929486\n1.834342 1.834342 -3.929486\nBe Zn Ir\n1 1 2\ndirect\n0.750000 0.250000 0.499999 Be\n0.500000 0.500000 0.000000 Zn\n0.000000 0.000000 0.000000 Ir\n0.250000 0.750000 0.499999 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Zn",
"Ir"
],
"chemical_system": "Be-Ir-Zn",
"density": 14.4068283244656,
"density_atomic": 0.07563166027844417,
"volume": 52.88790415645606,
"volume_molar": 7.962460083289185,
"formula_full": "Be1 Zn1 Ir2",
"formula_reduced": "BeZnIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.368949675,
"spacegroup": 119
},
{
"id": "jvasp-69227",
"created_at": "2022-09-04T14:36:19.315500Z",
"updated_at": "2022-09-04T14:36:19.315515Z",
"structure_string": "Ba1 Ni2 Cl1\n1.0\n4.294913 -0.000000 -0.000000\n0.000000 4.294913 0.000000\n-0.000000 -0.000000 5.985879\nBa Ni Cl\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.816735 Ni\n0.000000 0.000000 0.183265 Ni\n0.500000 0.500000 0.500000 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Ni",
"Cl"
],
"chemical_system": "Ba-Cl-Ni",
"density": 4.363752816994674,
"density_atomic": 0.036226244649449846,
"volume": 110.41718617832905,
"volume_molar": 16.6236959372256,
"formula_full": "Ba1 Ni2 Cl1",
"formula_reduced": "BaNi2Cl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.507376209375,
"spacegroup": 123
},
{
"id": "jvasp-93278",
"created_at": "2022-09-04T14:36:19.317240Z",
"updated_at": "2022-09-04T14:36:19.317272Z",
"structure_string": "Ho1 Co2 B2\n1.0\n3.335535 -0.000026 -1.195496\n-0.428522 3.307899 -1.195500\n0.007114 0.008090 5.270599\nHo Co B\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ho\n0.249999 0.750002 0.500000 Co\n0.750002 0.249997 0.499999 Co\n0.351880 0.351880 0.703725 B\n0.648121 0.648119 0.296274 B\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ho",
"Co",
"B"
],
"chemical_system": "B-Co-Ho",
"density": 8.682833178600971,
"density_atomic": 0.08588375467329737,
"volume": 58.21822787115035,
"volume_molar": 7.011967260756451,
"formula_full": "Ho1 Co2 B2",
"formula_reduced": "Ho(CoB)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.483680506666668,
"spacegroup": 139
},
{
"id": "jvasp-90864",
"created_at": "2022-09-04T14:36:19.318615Z",
"updated_at": "2022-09-04T14:36:19.318635Z",
"structure_string": "Li4 Zn2 Si2\n1.0\n-2.133354 -3.696656 0.000000\n-2.133354 3.696656 -0.000000\n0.000000 0.000000 -7.633423\nLi Zn Si\n4 2 2\ndirect\n0.666739 0.333259 0.581855 Li\n0.333259 0.666739 0.418144 Li\n0.333259 0.666739 0.081855 Li\n0.666739 0.333259 0.918144 Li\n0.666402 0.333596 0.250000 Zn\n0.333596 0.666402 0.750000 Zn\n0.000000 0.000000 0.500000 Si\n0.000000 0.000000 0.000000 Si\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Li",
"Zn",
"Si"
],
"chemical_system": "Li-Si-Zn",
"density": 2.961877191376781,
"density_atomic": 0.06644597790566266,
"volume": 120.39855913262471,
"volume_molar": 9.063213379973119,
"formula_full": "Li4 Zn2 Si2",
"formula_reduced": "Li2ZnSi",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7333947499999998,
"spacegroup": 194
},
{
"id": "jvasp-68143",
"created_at": "2022-09-04T14:36:19.326801Z",
"updated_at": "2022-09-04T14:36:19.326831Z",
"structure_string": "Be1 P2 Cl1\n1.0\n3.129734 0.000000 -0.000000\n0.000000 3.129734 0.000000\n-0.000000 0.000000 7.458698\nBe P Cl\n1 2 1\ndirect\n0.000000 0.000000 0.519070 Be\n0.000000 0.000000 0.235447 P\n0.499999 0.499999 0.122866 P\n0.499999 0.499999 0.622617 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"P",
"Cl"
],
"chemical_system": "Be-Cl-P",
"density": 2.4186036600394396,
"density_atomic": 0.05474974647648601,
"volume": 73.05969903838596,
"volume_molar": 10.999394787309923,
"formula_full": "Be1 P2 Cl1",
"formula_reduced": "BeP2Cl",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.934757791875,
"spacegroup": 99
}
]
}