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=nelements&page=601",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=599",
"results": [
{
"id": "jvasp-16715",
"created_at": "2022-09-04T14:38:32.995651Z",
"updated_at": "2022-09-04T14:38:32.995677Z",
"structure_string": "Ti6 As2\n1.0\n5.015099 -0.000000 -0.000000\n0.000000 5.015099 0.000000\n-0.000000 0.000000 5.015099\nTi As\n6 2\ndirect\n0.500000 0.250000 0.000000 Ti\n0.500000 0.750000 0.000000 Ti\n0.250000 0.000000 0.500000 Ti\n0.750000 0.000000 0.500000 Ti\n0.000000 0.500000 0.250000 Ti\n0.000000 0.500000 0.750000 Ti\n0.500000 0.500000 0.500000 As\n0.000000 0.000000 0.000000 As\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ti",
"As"
],
"chemical_system": "As-Ti",
"density": 5.753563631400348,
"density_atomic": 0.06342368262483336,
"volume": 126.13584813928202,
"volume_molar": 9.495097904709256,
"formula_full": "Ti6 As2",
"formula_reduced": "Ti3As",
"formula_anonymous": "AB3",
"energy_above_hull": 3.3230941875000006,
"spacegroup": 223
},
{
"id": "jvasp-9176",
"created_at": "2022-09-04T14:38:33.000803Z",
"updated_at": "2022-09-04T14:38:33.000834Z",
"structure_string": "Ga4 O6\n1.0\n2.986763 -0.000000 -0.742680\n-0.337531 5.698546 -1.357413\n0.001692 0.008009 6.383927\nGa O\n4 6\ndirect\n0.658830 0.313887 0.317663 Ga\n0.341168 0.686114 0.682338 Ga\n0.090521 0.794816 0.181042 Ga\n0.909478 0.205185 0.818959 Ga\n0.496323 0.255849 0.992649 O\n0.503676 0.744152 0.007352 O\n0.173257 0.562648 0.346514 O\n0.826742 0.437353 0.653486 O\n0.834812 0.890999 0.669626 O\n0.165187 0.109002 0.330375 O\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Ga",
"O"
],
"chemical_system": "Ga-O",
"density": 5.727063093445169,
"density_atomic": 0.09199852570003919,
"volume": 108.69739404960639,
"volume_molar": 6.5459100721191605,
"formula_full": "Ga4 O6",
"formula_reduced": "Ga2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 0.95205503,
"spacegroup": 12
},
{
"id": "jvasp-115196",
"created_at": "2022-09-04T14:38:43.606695Z",
"updated_at": "2022-09-04T14:38:43.606731Z",
"structure_string": "Li1 I2\n1.0\n4.439860 0.000000 0.000000\n0.000000 4.409517 0.000000\n0.000000 0.000000 6.523832\nLi I\n1 2\ndirect\n0.466689 0.000000 0.000000 Li\n-0.033345 0.000000 0.745371 I\n-0.033345 0.000000 0.254628 I\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"I"
],
"chemical_system": "I-Li",
"density": 3.3900823560674014,
"density_atomic": 0.023488657151697342,
"volume": 127.72122223186409,
"volume_molar": 25.63850594398423,
"formula_full": "Li1 I2",
"formula_reduced": "LiI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1385454250000001,
"spacegroup": 47
},
{
"id": "jvasp-4373",
"created_at": "2022-09-04T14:38:32.073508Z",
"updated_at": "2022-09-04T14:38:32.073533Z",
"structure_string": "U1 Hg2\n1.0\n2.577012 -4.463515 0.000000\n2.577012 4.463515 0.000000\n0.000000 0.000000 3.022807\nU Hg\n1 2\ndirect\n0.000000 0.000000 0.000000 U\n0.333332 0.666667 0.500000 Hg\n0.666667 0.333332 0.500000 Hg\n",
"nsites": 3,
"nelements": 2,
"elements": [
"U",
"Hg"
],
"chemical_system": "Hg-U",
"density": 15.263638195599647,
"density_atomic": 0.04314072112451264,
"volume": 69.53986678482744,
"volume_molar": 13.959295540329316,
"formula_full": "U1 Hg2",
"formula_reduced": "UHg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.8569150666666665,
"spacegroup": 191
},
{
"id": "jvasp-16658",
"created_at": "2022-09-04T14:38:30.652295Z",
"updated_at": "2022-09-04T14:38:30.652310Z",
"structure_string": "K6 N2\n1.0\n3.722731 -6.447959 -0.000000\n3.722731 6.447959 0.000000\n0.000000 0.000000 7.218342\nK N\n6 2\ndirect\n0.273124 -0.000000 0.250000 K\n0.726876 -0.000000 0.750000 K\n0.273124 0.273124 0.750000 K\n-0.000000 0.273124 0.250000 K\n0.726876 0.726876 0.250000 K\n-0.000000 0.726876 0.750000 K\n0.000000 0.000000 0.500000 N\n0.000000 0.000000 0.000000 N\n",
"nsites": 8,
"nelements": 2,
"elements": [
"K",
"N"
],
"chemical_system": "K-N",
"density": 1.2583392344456075,
"density_atomic": 0.02308546429375071,
"volume": 346.53840608116417,
"volume_molar": 26.086288252085133,
"formula_full": "K6 N2",
"formula_reduced": "K3N",
"formula_anonymous": "AB3",
"energy_above_hull": 0.6787793124999999,
"spacegroup": 193
},
{
"id": "jvasp-110063",
"created_at": "2022-09-04T14:38:37.347494Z",
"updated_at": "2022-09-04T14:38:37.347516Z",
"structure_string": "Zn1 Sn3\n1.0\n4.108939 -0.132597 -4.278544\n-0.760279 4.040166 -4.278544\n0.113632 0.132597 5.930970\nZn Sn\n1 3\ndirect\n0.000000 0.000000 0.000000 Zn\n0.750000 0.250000 0.500001 Sn\n0.250000 0.750001 0.500001 Sn\n0.500000 0.500000 0.000001 Sn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zn",
"Sn"
],
"chemical_system": "Sn-Zn",
"density": 6.818977594168852,
"density_atomic": 0.038966589497590604,
"volume": 102.65204246954508,
"volume_molar": 15.454626226327461,
"formula_full": "Zn1 Sn3",
"formula_reduced": "ZnSn3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.2945136333333334,
"spacegroup": 139
},
{
"id": "jvasp-110033",
"created_at": "2022-09-04T14:38:37.336037Z",
"updated_at": "2022-09-04T14:38:37.336061Z",
"structure_string": "Sm1 Mg5\n1.0\n7.016512 0.035330 1.607399\n6.269575 3.150416 1.607399\n-0.019106 -0.004581 6.730367\nSm Mg\n1 5\ndirect\n0.499999 0.500001 0.500000 Sm\n0.174476 0.174477 0.669657 Mg\n0.830487 0.830491 0.844576 Mg\n0.499999 0.500001 0.000000 Mg\n0.169510 0.169511 0.155425 Mg\n0.825521 0.825524 0.330344 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Sm",
"Mg"
],
"chemical_system": "Mg-Sm",
"density": 3.0632471863418056,
"density_atomic": 0.04070979806579833,
"volume": 147.38466622463554,
"volume_molar": 14.792853431172885,
"formula_full": "Sm1 Mg5",
"formula_reduced": "SmMg5",
"formula_anonymous": "AB5",
"energy_above_hull": 0.0,
"spacegroup": 12
},
{
"id": "jvasp-110864",
"created_at": "2022-09-04T14:38:37.301610Z",
"updated_at": "2022-09-04T14:38:37.301637Z",
"structure_string": "Sr6 Ca2\n1.0\n8.221964 0.000000 0.000000\n-4.110982 7.120429 0.000000\n-0.000000 -0.000000 6.745340\nSr Ca\n6 2\ndirect\n0.168217 0.336435 0.250000 Sr\n0.663565 0.831783 0.250000 Sr\n0.168218 0.831783 0.250000 Sr\n0.831782 0.663565 0.750000 Sr\n0.336435 0.168217 0.750000 Sr\n0.831782 0.168217 0.750000 Sr\n0.333333 0.666667 0.750000 Ca\n0.666666 0.333333 0.250000 Ca\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sr",
"Ca"
],
"chemical_system": "Ca-Sr",
"density": 2.5476940368018046,
"density_atomic": 0.02025836588124983,
"volume": 394.898583967447,
"volume_molar": 29.726685732208065,
"formula_full": "Sr6 Ca2",
"formula_reduced": "Sr3Ca",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0007925,
"spacegroup": 194
},
{
"id": "jvasp-116562",
"created_at": "2022-09-04T14:38:43.605202Z",
"updated_at": "2022-09-04T14:38:43.605221Z",
"structure_string": "Zr22 Os8\n1.0\n8.252475 -0.000000 4.764569\n2.750825 7.780508 4.764569\n-0.000000 -0.000000 9.529137\nZr Os\n22 8\ndirect\n0.799590 0.799589 0.200411 Zr\n0.162836 0.162836 0.162836 Zr\n0.511495 0.162836 0.162835 Zr\n0.162836 0.511494 0.162835 Zr\n0.162836 0.162836 0.511494 Zr\n0.837165 0.837165 0.837164 Zr\n0.488506 0.837165 0.837164 Zr\n0.837165 0.488506 0.837164 Zr\n0.383145 0.383145 0.383145 Zr\n0.850567 0.383145 0.383145 Zr\n0.383146 0.850566 0.383145 Zr\n0.837165 0.837165 0.488505 Zr\n0.616856 0.616855 0.616855 Zr\n0.200412 0.799589 0.200411 Zr\n0.383145 0.383145 0.850566 Zr\n0.200411 0.200411 0.799589 Zr\n0.799589 0.200411 0.799589 Zr\n0.799589 0.200411 0.200411 Zr\n0.616856 0.616855 0.149434 Zr\n0.616855 0.149434 0.616855 Zr\n0.149434 0.616855 0.616855 Zr\n0.200412 0.799589 0.799589 Zr\n0.000000 0.500000 -0.000000 Os\n0.000000 0.000000 0.000000 Os\n0.500001 0.500000 0.500000 Os\n0.000000 0.000000 0.500000 Os\n0.500000 0.000000 0.500000 Os\n0.000000 0.500000 0.500000 Os\n0.500001 0.500000 -0.000000 Os\n0.500000 0.000000 -0.000000 Os\n",
"nsites": 30,
"nelements": 2,
"elements": [
"Zr",
"Os"
],
"chemical_system": "Os-Zr",
"density": 9.57693328750441,
"density_atomic": 0.049031537629913795,
"volume": 611.8510952366546,
"volume_molar": 12.282178065584333,
"formula_full": "Zr22 Os8",
"formula_reduced": "Zr11Os4",
"formula_anonymous": "A4B11",
"energy_above_hull": 5.882683300000001,
"spacegroup": 225
},
{
"id": "jvasp-114975",
"created_at": "2022-09-04T14:38:43.839669Z",
"updated_at": "2022-09-04T14:38:43.839694Z",
"structure_string": "Ge2 Cl1\n1.0\n5.024593 -0.000000 0.000000\n-2.512296 4.351425 -0.000000\n0.000000 -0.000000 2.916415\nGe Cl\n2 1\ndirect\n0.333333 0.666666 0.000000 Ge\n0.666666 0.333333 0.000000 Ge\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ge",
"Cl"
],
"chemical_system": "Cl-Ge",
"density": 4.706573445752394,
"density_atomic": 0.04704782380206288,
"volume": 63.764904677024845,
"volume_molar": 12.800041050434196,
"formula_full": "Ge2 Cl1",
"formula_reduced": "Ge2Cl",
"formula_anonymous": "AB2",
"energy_above_hull": 0.5325886558333333,
"spacegroup": 191
},
{
"id": "jvasp-38150",
"created_at": "2022-09-04T14:38:30.750075Z",
"updated_at": "2022-09-04T14:38:30.750099Z",
"structure_string": "Mn6 Be2\n1.0\n2.391684 -4.142519 -0.000000\n2.391684 4.142519 0.000000\n-0.000000 -0.000000 4.031182\nMn Be\n6 2\ndirect\n0.172270 0.827728 0.750000 Mn\n0.655457 0.827728 0.750000 Mn\n0.172271 0.344541 0.750000 Mn\n0.827728 0.172270 0.250000 Mn\n0.344541 0.172271 0.250000 Mn\n0.827728 0.655457 0.250000 Mn\n0.333332 0.666666 0.250000 Be\n0.666666 0.333332 0.750000 Be\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mn",
"Be"
],
"chemical_system": "Be-Mn",
"density": 7.227097481020528,
"density_atomic": 0.10015191964744333,
"volume": 79.87864863860574,
"volume_molar": 6.013005822753327,
"formula_full": "Mn6 Be2",
"formula_reduced": "Mn3Be",
"formula_anonymous": "AB3",
"energy_above_hull": 3.627371956034482,
"spacegroup": 194
},
{
"id": "jvasp-111270",
"created_at": "2022-09-04T14:38:47.615027Z",
"updated_at": "2022-09-04T14:38:47.615046Z",
"structure_string": "Ho2 As6\n1.0\n6.011915 -0.000000 0.000000\n-3.005959 5.206471 0.000000\n-0.000000 0.000000 5.479932\nHo As\n2 6\ndirect\n0.333333 0.666667 0.750000 Ho\n0.666667 0.333333 0.250000 Ho\n0.182027 0.364054 0.250000 As\n0.635946 0.817972 0.250000 As\n0.182027 0.817972 0.250000 As\n0.817973 0.635946 0.750000 As\n0.364055 0.182027 0.750000 As\n0.817973 0.182027 0.750000 As\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ho",
"As"
],
"chemical_system": "As-Ho",
"density": 7.545232134434391,
"density_atomic": 0.04663999897780779,
"volume": 171.52659038021324,
"volume_molar": 12.911965891906325,
"formula_full": "Ho2 As6",
"formula_reduced": "HoAs3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.9591177041666663,
"spacegroup": 194
}
]
}