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=605",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=603",
"results": [
{
"id": "jvasp-110807",
"created_at": "2022-09-04T14:38:47.854578Z",
"updated_at": "2022-09-04T14:38:47.854606Z",
"structure_string": "K3 Li1\n1.0\n5.409608 -0.826311 -4.044963\n-1.855096 5.148327 -4.044963\n0.679575 0.826311 6.720399\nK Li\n3 1\ndirect\n0.750000 0.250000 0.500001 K\n0.250000 0.750000 0.500001 K\n0.500000 0.500000 0.000000 K\n0.000000 0.000000 0.000000 Li\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Li"
],
"chemical_system": "K-Li",
"density": 0.9481968319018983,
"density_atomic": 0.01838494281241607,
"volume": 217.56934687328175,
"volume_molar": 32.75583079830422,
"formula_full": "K3 Li1",
"formula_reduced": "K3Li",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-117969",
"created_at": "2022-09-04T14:38:47.807523Z",
"updated_at": "2022-09-04T14:38:47.807541Z",
"structure_string": "Ca2 C1\n1.0\n3.622229 0.000000 0.573100\n0.000000 3.618801 0.000000\n0.738963 0.000000 7.023448\nCa C\n2 1\ndirect\n0.082269 0.000000 -0.098414 Ca\n-0.148931 0.000000 0.365080 Ca\n0.466662 0.000000 0.133333 C\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ca",
"C"
],
"chemical_system": "C-Ca",
"density": 1.6905287351721412,
"density_atomic": 0.03313757139688064,
"volume": 90.53167970789801,
"volume_molar": 18.173150614673247,
"formula_full": "Ca2 C1",
"formula_reduced": "Ca2C",
"formula_anonymous": "AB2",
"energy_above_hull": 1.7842502799999995,
"spacegroup": 65
},
{
"id": "jvasp-113442",
"created_at": "2022-09-04T14:38:47.819774Z",
"updated_at": "2022-09-04T14:38:47.819796Z",
"structure_string": "B1 O2\n1.0\n4.049678 0.000000 -0.096506\n0.000000 2.811421 0.000000\n0.056902 0.000000 2.374106\nB O\n1 2\ndirect\n0.744711 0.000000 -0.033346 B\n-0.420491 0.000000 -0.533303 O\n0.075781 0.000000 -0.033352 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"B",
"O"
],
"chemical_system": "B-O",
"density": 2.6284385655708564,
"density_atomic": 0.11092432358724143,
"volume": 27.04546580029866,
"volume_molar": 5.429053398972153,
"formula_full": "B1 O2",
"formula_reduced": "BO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.3237998611111115,
"spacegroup": 25
},
{
"id": "jvasp-118890",
"created_at": "2022-09-04T14:38:47.831595Z",
"updated_at": "2022-09-04T14:38:47.831610Z",
"structure_string": "Li1 F2\n1.0\n4.689657 0.000000 0.000000\n0.000000 3.178282 0.000000\n0.000000 0.000000 3.395125\nLi F\n1 2\ndirect\n0.000000 0.423971 0.000000 Li\n0.212536 -0.075986 0.000000 F\n0.787464 -0.075986 0.000000 F\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"F"
],
"chemical_system": "F-Li",
"density": 1.474591376476663,
"density_atomic": 0.05928324642717823,
"volume": 50.6045161289389,
"volume_molar": 10.158250640672012,
"formula_full": "Li1 F2",
"formula_reduced": "LiF2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.4385067608333332,
"spacegroup": 47
},
{
"id": "jvasp-120326",
"created_at": "2022-09-04T14:38:47.839679Z",
"updated_at": "2022-09-04T14:38:47.839719Z",
"structure_string": "Mg2 C1\n1.0\n3.664834 -0.481831 0.808175\n2.526102 -5.358936 2.843093\n-0.991923 1.872663 -3.150867\nMg C\n2 1\ndirect\n0.809339 0.693613 -0.027329 Mg\n0.309677 0.192567 -0.028468 Mg\n0.059537 0.943087 0.972101 C\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Mg",
"C"
],
"chemical_system": "C-Mg",
"density": 2.5535697590957627,
"density_atomic": 0.07610250228915998,
"volume": 39.42051719404921,
"volume_molar": 7.913196779152154,
"formula_full": "Mg2 C1",
"formula_reduced": "Mg2C",
"formula_anonymous": "AB2",
"energy_above_hull": 1.3150126999999996,
"spacegroup": 225
},
{
"id": "jvasp-113484",
"created_at": "2022-09-04T14:38:47.908567Z",
"updated_at": "2022-09-04T14:38:47.908584Z",
"structure_string": "Ba2 I2\n1.0\n4.892779 0.000000 -0.000000\n0.000000 4.892779 -0.000000\n0.000000 -0.000000 7.097553\nBa I\n2 2\ndirect\n0.000000 0.000000 0.206686 Ba\n0.500000 0.500000 0.793314 Ba\n0.000000 0.000000 0.709529 I\n0.500000 0.500000 0.290470 I\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ba",
"I"
],
"chemical_system": "Ba-I",
"density": 5.164684426374827,
"density_atomic": 0.023541826117348865,
"volume": 169.91035360049017,
"volume_molar": 25.580601649088116,
"formula_full": "Ba2 I2",
"formula_reduced": "BaI",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 129
},
{
"id": "jvasp-113641",
"created_at": "2022-09-04T14:38:47.946431Z",
"updated_at": "2022-09-04T14:38:47.946453Z",
"structure_string": "Hg2 I1\n1.0\n7.162818 0.971782 0.769809\n-4.149952 -4.063809 0.002822\n-1.032671 1.067162 -4.129166\nHg I\n2 1\ndirect\n0.881501 0.176167 -0.020656 Hg\n0.214588 0.777986 0.646105 Hg\n0.548267 0.477292 0.312857 I\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Hg",
"I"
],
"chemical_system": "Hg-I",
"density": 9.05177158934719,
"density_atomic": 0.03096722915782141,
"volume": 96.87660412595514,
"volume_molar": 19.446818213243287,
"formula_full": "Hg2 I1",
"formula_reduced": "Hg2I",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 164
},
{
"id": "jvasp-115626",
"created_at": "2022-09-04T14:38:47.895349Z",
"updated_at": "2022-09-04T14:38:47.895371Z",
"structure_string": "Be1 C2\n1.0\n2.244537 0.000000 0.000000\n0.000000 3.239423 0.000000\n0.000000 0.000000 4.053567\nBe C\n1 2\ndirect\n0.466688 0.000000 0.000000 Be\n-0.033344 0.000000 0.338669 C\n-0.033344 0.000000 0.661332 C\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Be",
"C"
],
"chemical_system": "Be-C",
"density": 1.8611140189467381,
"density_atomic": 0.10178633303872199,
"volume": 29.47350504176948,
"volume_molar": 5.91645320173685,
"formula_full": "Be1 C2",
"formula_reduced": "BeC2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.487775366666666,
"spacegroup": 47
},
{
"id": "jvasp-118924",
"created_at": "2022-09-04T14:38:47.896965Z",
"updated_at": "2022-09-04T14:38:47.896981Z",
"structure_string": "Au1 C2\n1.0\n5.777766 0.000000 0.000000\n0.000000 2.851978 0.000000\n0.000000 0.000000 2.585637\nAu C\n1 2\ndirect\n0.466689 0.000000 0.000000 Au\n-0.033344 0.000000 0.748956 C\n-0.033344 0.000000 0.251045 C\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Au",
"C"
],
"chemical_system": "Au-C",
"density": 8.612793886458126,
"density_atomic": 0.07041214601919245,
"volume": 42.60628555735656,
"volume_molar": 8.552701629571873,
"formula_full": "Au1 C2",
"formula_reduced": "AuC2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.025992523333334,
"spacegroup": 47
},
{
"id": "jvasp-114014",
"created_at": "2022-09-04T14:38:47.903967Z",
"updated_at": "2022-09-04T14:38:47.903990Z",
"structure_string": "B2 O1\n1.0\n2.715292 -0.255319 -0.537850\n0.836644 -3.656433 -0.979648\n-0.547805 -0.235023 -2.287107\nB O\n2 1\ndirect\n0.092984 0.317789 0.429454 B\n0.438485 0.628312 0.272789 B\n0.227514 0.048121 0.062678 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"B",
"O"
],
"chemical_system": "B-O",
"density": 2.7594301789241342,
"density_atomic": 0.13251242878214928,
"volume": 22.639385811364207,
"volume_molar": 4.544585602532736,
"formula_full": "B2 O1",
"formula_reduced": "B2O",
"formula_anonymous": "AB2",
"energy_above_hull": 3.082819555555556,
"spacegroup": 44
},
{
"id": "jvasp-118930",
"created_at": "2022-09-04T14:38:47.925782Z",
"updated_at": "2022-09-04T14:38:47.925799Z",
"structure_string": "Au1 F3\n1.0\n5.592911 -0.928874 -1.155181\n1.979384 -2.840613 -0.552086\n-1.211468 3.112960 -3.686112\nAu F\n1 3\ndirect\n0.865486 0.376128 0.019084 Au\n0.365499 -0.123948 0.019096 F\n0.708047 0.211450 0.349605 F\n0.022937 0.540799 0.688601 F\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Au",
"F"
],
"chemical_system": "Au-F",
"density": 7.317181863423321,
"density_atomic": 0.06940430076714274,
"volume": 57.63331603066409,
"volume_molar": 8.676898540055591,
"formula_full": "Au1 F3",
"formula_reduced": "AuF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.022675,
"spacegroup": 2
},
{
"id": "jvasp-110833",
"created_at": "2022-09-04T14:38:47.928841Z",
"updated_at": "2022-09-04T14:38:47.928875Z",
"structure_string": "Na2 Sn6\n1.0\n6.697950 -0.000000 0.000000\n-3.348975 5.800595 0.000000\n-0.000000 -0.000000 5.598936\nNa Sn\n2 6\ndirect\n0.333334 0.666666 0.750000 Na\n0.666667 0.333333 0.250000 Na\n0.160472 0.320944 0.250000 Sn\n0.679056 0.839527 0.250000 Sn\n0.160472 0.839527 0.250000 Sn\n0.839528 0.679055 0.750000 Sn\n0.320944 0.160472 0.750000 Sn\n0.839528 0.160472 0.750000 Sn\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Na",
"Sn"
],
"chemical_system": "Na-Sn",
"density": 5.788094008503025,
"density_atomic": 0.03677646979956887,
"volume": 217.5303949400218,
"volume_molar": 16.37498322384004,
"formula_full": "Na2 Sn6",
"formula_reduced": "NaSn3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.266891105,
"spacegroup": 194
}
]
}