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=id&page=119",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=117",
"results": [
{
"id": "jvasp-101753",
"created_at": "2022-09-04T14:36:36.821153Z",
"updated_at": "2022-09-04T14:36:36.821164Z",
"structure_string": "Cr2 Ag1 S4\n1.0\n6.464654 -0.020542 2.838335\n5.541618 3.329061 2.838335\n0.025751 0.007096 5.918457\nCr Ag S\n2 1 4\ndirect\n0.757579 0.757580 0.225188 Cr\n0.242419 0.242421 0.774814 Cr\n0.499999 0.500001 0.500001 Ag\n0.363421 0.363424 0.973902 S\n0.636577 0.636578 0.026100 S\n0.849117 0.849120 0.489341 S\n0.150881 0.150882 0.510661 S\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Cr",
"Ag",
"S"
],
"chemical_system": "Ag-Cr-S",
"density": 4.419869513726404,
"density_atomic": 0.054780464368453095,
"volume": 127.78277951274818,
"volume_molar": 10.993226927568768,
"formula_full": "Cr2 Ag1 S4",
"formula_reduced": "Cr2AgS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.668838865714286,
"spacegroup": 12
},
{
"id": "jvasp-101754",
"created_at": "2022-09-04T14:36:36.162913Z",
"updated_at": "2022-09-04T14:36:36.162932Z",
"structure_string": "Mg2 In2 S6\n1.0\n6.535558 0.031942 1.661808\n-3.904917 5.240818 1.661808\n-0.009381 -0.018802 6.458848\nMg In S\n2 2 6\ndirect\n0.670589 0.329410 0.000000 Mg\n0.329410 0.670590 0.000000 Mg\n0.835541 0.835541 0.349626 In\n0.164459 0.164459 0.650375 In\n0.514602 0.873059 0.262901 S\n0.485398 0.126942 0.737100 S\n0.126942 0.485398 0.737100 S\n0.873058 0.514602 0.262901 S\n0.751057 0.751058 0.774920 S\n0.248943 0.248943 0.225081 S\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Mg",
"In",
"S"
],
"chemical_system": "In-Mg-S",
"density": 3.5133595001189044,
"density_atomic": 0.04495607105599873,
"volume": 222.43936725573013,
"volume_molar": 13.39561180179342,
"formula_full": "Mg2 In2 S6",
"formula_reduced": "MgInS3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.766347804,
"spacegroup": 12
},
{
"id": "jvasp-101755",
"created_at": "2022-09-04T14:36:36.389865Z",
"updated_at": "2022-09-04T14:36:36.389892Z",
"structure_string": "Si2 Sn2 N4\n1.0\n4.389389 0.000000 2.335809\n1.533058 4.449958 2.411233\n0.002014 -0.000093 5.288330\nSi Sn N\n2 2 4\ndirect\n0.620143 0.879475 0.879475 Si\n0.879094 0.120526 0.120525 Si\n0.178609 0.369720 0.369719 Sn\n0.418047 0.630282 0.630280 Sn\n0.935036 0.909674 0.909672 N\n0.254383 0.090327 0.090327 N\n0.627345 0.500000 -0.000000 N\n0.627343 0.000000 0.500000 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Si",
"Sn",
"N"
],
"chemical_system": "N-Si-Sn",
"density": 5.621463403745112,
"density_atomic": 0.07746343328341003,
"volume": 103.27453433068169,
"volume_molar": 7.774172283285219,
"formula_full": "Si2 Sn2 N4",
"formula_reduced": "SiSnN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.3197141999999995,
"spacegroup": 46
},
{
"id": "jvasp-101756",
"created_at": "2022-09-04T14:36:38.783223Z",
"updated_at": "2022-09-04T14:36:38.783246Z",
"structure_string": "Ba1 Sr2 N2\n1.0\n4.277754 -0.000933 -0.001660\n-2.139716 3.630572 0.023018\n0.000634 0.054708 7.465447\nBa Sr N\n1 2 2\ndirect\n0.046776 -0.001022 0.500003 Ba\n0.659672 0.334756 0.148515 Sr\n0.325119 0.665583 0.851510 Sr\n0.654377 0.340935 0.754211 N\n0.314111 0.659750 0.245763 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ba",
"Sr",
"N"
],
"chemical_system": "Ba-N-Sr",
"density": 4.878623905502178,
"density_atomic": 0.04313190055004351,
"volume": 115.92347975018588,
"volume_molar": 13.962150248892579,
"formula_full": "Ba1 Sr2 N2",
"formula_reduced": "BaSr2N2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.7792650179999998,
"spacegroup": 5
},
{
"id": "jvasp-101757",
"created_at": "2022-09-04T14:36:39.099712Z",
"updated_at": "2022-09-04T14:36:39.099721Z",
"structure_string": "Ba2 Fe1 N2\n1.0\n3.933283 0.000000 -1.207391\n-0.371292 3.914924 -1.209546\n-0.000718 0.003199 7.008027\nBa Fe N\n2 1 2\ndirect\n0.861362 0.861361 0.222723 Ba\n0.138638 0.138638 0.777277 Ba\n0.500000 0.500000 0.500000 Fe\n0.366805 0.366805 0.233610 N\n0.633194 0.633194 0.766390 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ba",
"Fe",
"N"
],
"chemical_system": "Ba-Fe-N",
"density": 5.5160173408524775,
"density_atomic": 0.046327871605966804,
"volume": 107.92639132068446,
"volume_molar": 12.998958405040083,
"formula_full": "Ba2 Fe1 N2",
"formula_reduced": "Ba2FeN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.704334788,
"spacegroup": 139
},
{
"id": "jvasp-101758",
"created_at": "2022-09-04T14:36:56.364943Z",
"updated_at": "2022-09-04T14:36:56.364968Z",
"structure_string": "Sr1 Pb2 N2\n1.0\n3.606565 -0.000000 -0.000001\n-1.803282 3.123377 -0.000000\n0.000000 0.000000 9.307627\nSr Pb N\n1 2 2\ndirect\n-0.000000 -0.000000 0.500000 Sr\n0.666666 0.333334 0.188033 Pb\n0.333334 0.666667 0.811968 Pb\n0.666666 0.333334 0.673592 N\n0.333334 0.666667 0.326408 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Pb",
"N"
],
"chemical_system": "N-Pb-Sr",
"density": 8.394506940851882,
"density_atomic": 0.04768841211334703,
"volume": 104.84727375941712,
"volume_molar": 12.628100817629287,
"formula_full": "Sr1 Pb2 N2",
"formula_reduced": "Sr(PbN)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.12470689,
"spacegroup": 164
},
{
"id": "jvasp-101759",
"created_at": "2022-09-04T14:36:39.002638Z",
"updated_at": "2022-09-04T14:36:39.002653Z",
"structure_string": "Ca1 Ag1 N1\n1.0\n4.102386 0.000056 0.000000\n-2.051144 3.552832 0.000000\n-0.000000 -0.000000 4.185343\nCa Ag N\n1 1 1\ndirect\n0.000008 0.000036 0.500000 Ca\n0.666671 0.333392 -0.000000 Ag\n0.666674 0.333373 0.500000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Ag",
"N"
],
"chemical_system": "Ag-Ca-N",
"density": 4.408513299867597,
"density_atomic": 0.049178534580071265,
"volume": 61.00222435695954,
"volume_molar": 12.245466058357028,
"formula_full": "Ca1 Ag1 N1",
"formula_reduced": "CaAgN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.214076976666666,
"spacegroup": 187
},
{
"id": "jvasp-10176",
"created_at": "2022-09-04T14:37:18.815163Z",
"updated_at": "2022-09-04T14:37:18.815189Z",
"structure_string": "Ba6 Si2 O10\n1.0\n6.450507 0.000000 -3.519085\n-1.919843 6.158184 -3.519085\n0.016718 0.022723 7.702096\nBa Si O\n6 2 10\ndirect\n0.250000 0.250000 0.500000 Ba\n0.181473 0.681472 -0.000001 Ba\n0.318528 0.181472 -0.000000 Ba\n0.681473 0.818527 -0.000001 Ba\n0.818528 0.318527 -0.000001 Ba\n0.750001 0.749999 0.499999 Ba\n0.250000 0.749999 0.499999 Si\n0.750001 0.250000 0.500000 Si\n0.500000 0.500000 -0.000001 O\n0.209952 0.709951 0.675101 O\n0.709952 0.465150 0.675101 O\n0.965151 0.209951 0.675101 O\n0.290049 0.534849 0.324898 O\n0.034850 0.790048 0.324898 O\n0.790049 0.290048 0.324898 O\n0.534850 0.034849 0.324898 O\n0.465151 0.965149 0.675101 O\n0.000000 0.000000 0.000000 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ba",
"Si",
"O"
],
"chemical_system": "Ba-O-Si",
"density": 5.626238255396577,
"density_atomic": 0.05863476068115436,
"volume": 306.9851363064458,
"volume_molar": 10.270598344806684,
"formula_full": "Ba6 Si2 O10",
"formula_reduced": "Ba3SiO5",
"formula_anonymous": "AB3C5",
"energy_above_hull": 1.55548489,
"spacegroup": 140
},
{
"id": "jvasp-101760",
"created_at": "2022-09-04T14:36:37.081956Z",
"updated_at": "2022-09-04T14:36:37.081976Z",
"structure_string": "Sr2 Pt1 N2\n1.0\n3.698316 0.000424 -1.069364\n-0.308934 3.685391 -1.069364\n0.010777 0.011720 6.968333\nSr Pt N\n2 1 2\ndirect\n0.149250 0.649248 0.798498 Sr\n0.850753 0.350750 0.201503 Sr\n0.500001 -0.000001 0.500000 Pt\n0.650042 0.150040 0.800080 N\n0.349961 0.849959 0.199921 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Pt",
"N"
],
"chemical_system": "N-Pt-Sr",
"density": 6.957542941730058,
"density_atomic": 0.05259273037545858,
"volume": 95.0701734689393,
"volume_molar": 11.4505193341514,
"formula_full": "Sr2 Pt1 N2",
"formula_reduced": "Sr2PtN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.3550521040000003,
"spacegroup": 139
},
{
"id": "jvasp-101761",
"created_at": "2022-09-04T14:36:40.021950Z",
"updated_at": "2022-09-04T14:36:40.021976Z",
"structure_string": "Fe4 Se3 N2\n1.0\n4.875413 -0.023642 4.264936\n1.125014 3.091598 -0.000000\n0.078723 -0.028647 8.718593\nFe Se N\n4 3 2\ndirect\n0.390793 0.804603 0.635425 Fe\n0.609205 0.195397 0.364577 Fe\n0.552072 0.723964 0.151719 Fe\n0.447926 0.276036 0.848282 Fe\n0.000000 0.000000 0.000000 Se\n0.770124 0.614937 0.785820 Se\n0.229874 0.385063 0.214181 Se\n0.434543 0.782728 0.406863 N\n0.565455 0.217272 0.593138 N\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Fe",
"Se",
"N"
],
"chemical_system": "Fe-N-Se",
"density": 6.214423345062426,
"density_atomic": 0.0689812693569137,
"volume": 130.4701998658998,
"volume_molar": 8.730110095308685,
"formula_full": "Fe4 Se3 N2",
"formula_reduced": "Fe4Se3N2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 3.697758733333333,
"spacegroup": 12
},
{
"id": "jvasp-101762",
"created_at": "2022-09-04T14:36:40.266270Z",
"updated_at": "2022-09-04T14:36:40.266290Z",
"structure_string": "La2 Zn1 Fe1 O6\n1.0\n4.786104 -0.003797 2.609719\n1.547377 4.528529 2.610674\n-0.005179 -0.004877 5.451355\nLa Zn Fe O\n2 1 1 6\ndirect\n0.750882 0.750883 0.750885 La\n0.249118 0.249115 0.249117 La\n0.500000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Fe\n0.304829 0.765437 0.173415 O\n0.765414 0.173411 0.304836 O\n0.173409 0.304839 0.765433 O\n0.695171 0.234563 0.826584 O\n0.826592 0.695160 0.234567 O\n0.234585 0.826588 0.695164 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"La",
"Zn",
"Fe",
"O"
],
"chemical_system": "Fe-La-O-Zn",
"density": 6.949765479051879,
"density_atomic": 0.08453996019625078,
"volume": 118.28725701769949,
"volume_molar": 7.123425118748842,
"formula_full": "La2 Zn1 Fe1 O6",
"formula_reduced": "La2ZnFeO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.13939069,
"spacegroup": 148
},
{
"id": "jvasp-101763",
"created_at": "2022-09-04T14:36:40.603660Z",
"updated_at": "2022-09-04T14:36:40.603680Z",
"structure_string": "Ba2 Co1 W1 O6\n1.0\n5.012574 -0.000755 2.824980\n-3.359333 4.669346 0.102383\n0.060532 -0.084281 5.752203\nBa Co W O\n2 1 1 6\ndirect\n0.499999 0.750012 0.749986 Ba\n0.500000 0.249988 0.250013 Ba\n0.000000 0.000000 0.000000 Co\n0.000000 0.500001 0.499999 W\n-0.000001 0.259479 0.740513 O\n-0.000033 0.259425 0.259454 O\n0.481036 0.740509 0.259471 O\n0.518963 0.259491 0.740529 O\n0.000034 0.740576 0.740544 O\n0.000002 0.740522 0.259485 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Co",
"W",
"O"
],
"chemical_system": "Ba-Co-O-W",
"density": 7.564176899451563,
"density_atomic": 0.07425951399502274,
"volume": 134.66287970414473,
"volume_molar": 8.109588167253067,
"formula_full": "Ba2 Co1 W1 O6",
"formula_reduced": "Ba2CoWO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.7635193839999994,
"spacegroup": 225
}
]
}