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=energy_above_hull&page=4516",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=4514",
"results": [
{
"id": "jvasp-21610",
"created_at": "2022-09-04T14:38:32.559833Z",
"updated_at": "2022-09-04T14:38:32.559856Z",
"structure_string": "Mg2 B8 Os6\n1.0\n2.931873 -0.000000 -0.000000\n-1.465937 5.961331 0.000000\n0.000000 -0.000000 9.844566\nMg B Os\n2 8 6\ndirect\n0.499999 0.000000 0.000000 Mg\n0.499999 0.000000 0.500000 Mg\n0.622804 0.245610 0.250000 B\n0.377194 0.754389 0.750000 B\n0.344313 0.688629 0.250000 B\n0.655685 0.311371 0.750000 B\n0.160070 0.320140 0.890108 B\n0.839928 0.679860 0.390108 B\n0.839928 0.679860 0.109893 B\n0.160070 0.320140 0.609893 B\n0.198019 0.396041 0.106965 Os\n0.018030 0.036060 0.750000 Os\n0.981968 0.963940 0.250000 Os\n0.801978 0.603959 0.893035 Os\n0.801978 0.603959 0.606965 Os\n0.198019 0.396041 0.393035 Os\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Mg",
"B",
"Os"
],
"chemical_system": "B-Mg-Os",
"density": 12.319057042417175,
"density_atomic": 0.0929897365288464,
"volume": 172.06199949858586,
"volume_molar": 6.476134877672084,
"formula_full": "Mg2 B8 Os6",
"formula_reduced": "MgB4Os3",
"formula_anonymous": "AB3C4",
"energy_above_hull": 5.065044297916668,
"spacegroup": 63
},
{
"id": "jvasp-119475",
"created_at": "2022-09-04T14:38:51.021936Z",
"updated_at": "2022-09-04T14:38:51.021966Z",
"structure_string": "Zr3 Mn8 Si1\n1.0\n4.825721 0.000000 0.000000\n-2.412861 4.179197 0.000000\n-0.000000 -0.000000 8.008928\nZr Mn Si\n3 8 1\ndirect\n0.333334 0.666667 0.556156 Zr\n0.333334 0.666667 0.935332 Zr\n0.000000 0.000000 0.079452 Zr\n0.666667 0.333334 0.498280 Mn\n0.666667 0.333334 0.988866 Mn\n0.495854 0.504147 0.256096 Mn\n0.495854 0.991709 0.256096 Mn\n0.008292 0.504147 0.256096 Mn\n0.840964 0.159036 0.744794 Mn\n0.840964 0.681930 0.744794 Mn\n0.318071 0.159036 0.744794 Mn\n0.000000 0.000000 0.439306 Si\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Zr",
"Mn",
"Si"
],
"chemical_system": "Mn-Si-Zr",
"density": 7.62063761600466,
"density_atomic": 0.07429366850800667,
"volume": 161.52116648684205,
"volume_molar": 8.105860002526311,
"formula_full": "Zr3 Mn8 Si1",
"formula_reduced": "Zr3Mn8Si",
"formula_anonymous": "AB3C8",
"energy_above_hull": 5.065557502586207,
"spacegroup": 156
},
{
"id": "jvasp-92587",
"created_at": "2022-09-04T14:36:31.099503Z",
"updated_at": "2022-09-04T14:36:31.099538Z",
"structure_string": "Co1 B2 Mo2\n1.0\n0.000000 0.000000 3.176044\n-3.563669 2.283478 1.588022\n-3.563669 -2.283478 1.588022\nCo B Mo\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Co\n0.499998 0.297252 0.702749 B\n0.499998 0.702749 0.297252 B\n0.200845 0.299155 0.299155 Mo\n0.799152 0.700846 0.700846 Mo\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Co",
"B",
"Mo"
],
"chemical_system": "B-Co-Mo",
"density": 8.751885201286601,
"density_atomic": 0.09672958116832629,
"volume": 51.690495705746216,
"volume_molar": 6.225748821883585,
"formula_full": "Co1 B2 Mo2",
"formula_reduced": "Co(BMo)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 5.066159573333333,
"spacegroup": 71
},
{
"id": "jvasp-74049",
"created_at": "2022-09-04T14:36:09.361179Z",
"updated_at": "2022-09-04T14:36:09.361204Z",
"structure_string": "Sc1 Be1 W2\n1.0\n3.194307 0.000000 -0.000000\n0.000000 3.194307 0.000000\n-0.000000 0.000000 6.157699\nSc Be W\n1 1 2\ndirect\n0.500001 0.500001 0.740570 Sc\n0.000000 0.000000 0.462203 Be\n0.000000 0.000000 0.034000 W\n0.500001 0.500001 0.263228 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Be",
"W"
],
"chemical_system": "Be-Sc-W",
"density": 11.143650342132194,
"density_atomic": 0.06366316548674691,
"volume": 62.83068033795305,
"volume_molar": 9.45938002604294,
"formula_full": "Sc1 Be1 W2",
"formula_reduced": "ScBeW2",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.0671428375,
"spacegroup": 99
},
{
"id": "jvasp-121046",
"created_at": "2022-09-04T14:38:54.260993Z",
"updated_at": "2022-09-04T14:38:54.261020Z",
"structure_string": "Al1 C3\n1.0\n3.252992 0.019673 0.398203\n0.063709 -5.606045 -0.269865\n-1.311892 1.077581 -2.805111\nAl C\n1 3\ndirect\n0.857916 0.556077 0.130404 Al\n0.736927 0.192655 0.888326 C\n0.657289 0.954119 0.729182 C\n0.571802 0.697857 0.558458 C\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Al",
"C"
],
"chemical_system": "Al-C",
"density": 2.126311761004688,
"density_atomic": 0.08128366501812403,
"volume": 49.21037946687209,
"volume_molar": 7.408795800062938,
"formula_full": "Al1 C3",
"formula_reduced": "AlC3",
"formula_anonymous": "AB3",
"energy_above_hull": 5.0678532,
"spacegroup": 160
},
{
"id": "jvasp-90720",
"created_at": "2022-09-04T14:36:16.858765Z",
"updated_at": "2022-09-04T14:36:16.858789Z",
"structure_string": "Nb2 Cr2 N4\n1.0\n3.046796 0.000000 0.000000\n0.000000 3.046796 0.000000\n-0.000000 0.000000 9.193430\nNb Cr N\n2 2 4\ndirect\n0.000000 0.500001 0.670166 Nb\n0.500001 0.000000 0.329834 Nb\n0.000000 0.500001 0.052314 Cr\n0.500001 0.000000 0.947686 Cr\n0.000000 0.500001 0.253623 N\n0.500001 0.000000 0.746377 N\n0.000000 0.000000 0.500000 N\n0.500001 0.500001 0.500000 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Nb",
"Cr",
"N"
],
"chemical_system": "Cr-N-Nb",
"density": 6.728986316977639,
"density_atomic": 0.09374015339009273,
"volume": 85.34229687793011,
"volume_molar": 6.424291557257546,
"formula_full": "Nb2 Cr2 N4",
"formula_reduced": "NbCrN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.068220825,
"spacegroup": 129
},
{
"id": "jvasp-15563",
"created_at": "2022-09-04T14:36:09.372809Z",
"updated_at": "2022-09-04T14:36:09.372845Z",
"structure_string": "U2 P1 N2\n1.0\n1.902263 -3.294816 0.000000\n1.902263 3.294816 -0.000000\n0.000000 -0.000000 6.559706\nU P N\n2 1 2\ndirect\n0.666667 0.333332 0.719462 U\n0.333332 0.666667 0.280539 U\n0.000000 0.000000 0.000000 P\n0.333332 0.666667 0.628856 N\n0.666667 0.333332 0.371144 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"U",
"P",
"N"
],
"chemical_system": "N-P-U",
"density": 10.804963271308939,
"density_atomic": 0.060807046078360336,
"volume": 82.22731282747463,
"volume_molar": 9.903689043272118,
"formula_full": "U2 P1 N2",
"formula_reduced": "U2PN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 5.0682448,
"spacegroup": 164
},
{
"id": "jvasp-56566",
"created_at": "2022-09-04T14:38:34.508033Z",
"updated_at": "2022-09-04T14:38:34.508055Z",
"structure_string": "Ta6 Co16 Si7\n1.0\n6.846847 0.000000 3.953029\n2.282283 6.455269 3.953029\n-0.000000 -0.000000 7.906058\nTa Co Si\n6 16 7\ndirect\n0.797922 0.797922 0.202079 Ta\n0.797922 0.202079 0.797922 Ta\n0.202079 0.202079 0.797922 Ta\n0.202078 0.797922 0.202079 Ta\n0.202078 0.797922 0.797922 Ta\n0.797922 0.202079 0.202079 Ta\n0.496414 0.834529 0.834529 Co\n0.144062 0.618646 0.618646 Co\n0.834529 0.834529 0.834529 Co\n0.381354 0.381354 0.381354 Co\n0.855938 0.381354 0.381354 Co\n0.618646 0.618646 0.618646 Co\n0.381354 0.855938 0.381354 Co\n0.165471 0.165471 0.165471 Co\n0.165471 0.503586 0.165472 Co\n0.834529 0.496414 0.834529 Co\n0.165471 0.165471 0.503586 Co\n0.834529 0.834529 0.496414 Co\n0.381354 0.381354 0.855938 Co\n0.503586 0.165471 0.165471 Co\n0.618646 0.144062 0.618646 Co\n0.618646 0.618646 0.144062 Co\n0.500000 0.500000 0.000000 Si\n-0.000000 0.500000 0.500000 Si\n0.500000 -0.000000 0.500000 Si\n0.500000 0.500000 0.500000 Si\n-0.000000 0.500000 0.000000 Si\n0.500000 -0.000000 -0.000000 Si\n0.000000 0.000000 0.500000 Si\n",
"nsites": 29,
"nelements": 3,
"elements": [
"Ta",
"Co",
"Si"
],
"chemical_system": "Co-Si-Ta",
"density": 10.57441822914679,
"density_atomic": 0.0829913891332624,
"volume": 349.43384250905365,
"volume_molar": 7.256344089300664,
"formula_full": "Ta6 Co16 Si7",
"formula_reduced": "Ta6Co16Si7",
"formula_anonymous": "A6B7C16",
"energy_above_hull": 5.069084131034482,
"spacegroup": 225
},
{
"id": "jvasp-51338",
"created_at": "2022-09-04T14:37:05.960768Z",
"updated_at": "2022-09-04T14:37:05.960794Z",
"structure_string": "Fe1 Pb1 W2\n1.0\n-0.000000 3.203300 3.203300\n3.203300 0.000000 3.203300\n3.203300 3.203300 -0.000000\nFe Pb W\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Fe\n0.250000 0.250000 0.250000 Pb\n0.000000 0.000000 0.000000 W\n0.750000 0.750000 0.750000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Fe",
"Pb",
"W"
],
"chemical_system": "Fe-Pb-W",
"density": 15.931853566018415,
"density_atomic": 0.06084671752375568,
"volume": 65.73896115987401,
"volume_molar": 9.897231938023355,
"formula_full": "Fe1 Pb1 W2",
"formula_reduced": "FePbW2",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.06934658,
"spacegroup": 216
},
{
"id": "jvasp-51507",
"created_at": "2022-09-04T14:37:31.026210Z",
"updated_at": "2022-09-04T14:37:31.026241Z",
"structure_string": "Mn4 N1\n1.0\n4.268459 -0.000000 0.000000\n0.000000 4.268399 0.000000\n0.000000 0.000000 4.268440\nMn N\n4 1\ndirect\n0.500000 0.500000 0.500000 Mn\n0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 0.500000 Mn\n0.500000 0.500000 0.000000 Mn\n0.000000 0.000000 0.000000 N\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Mn",
"N"
],
"chemical_system": "Mn-N",
"density": 4.991279734764161,
"density_atomic": 0.06429314930340338,
"volume": 77.76878336453373,
"volume_molar": 9.36669120310337,
"formula_full": "Mn4 N1",
"formula_reduced": "Mn4N",
"formula_anonymous": "AB4",
"energy_above_hull": 5.069772443103448,
"spacegroup": 221
},
{
"id": "jvasp-117951",
"created_at": "2022-09-04T14:38:52.004676Z",
"updated_at": "2022-09-04T14:38:52.004694Z",
"structure_string": "Si1 C1\n1.0\n7.408481 0.000000 0.000000\n0.000000 7.408481 0.000000\n0.000000 0.000000 10.583545\nSi C\n1 1\ndirect\n0.000000 0.000000 0.089773 Si\n0.000000 0.000000 0.910227 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Si",
"C"
],
"chemical_system": "C-Si",
"density": 0.11462063483637148,
"density_atomic": 0.0034430275049691906,
"volume": 580.8841193146079,
"volume_molar": 174.90829658806018,
"formula_full": "Si1 C1",
"formula_reduced": "SiC",
"formula_anonymous": "AB",
"energy_above_hull": 5.069854299999999,
"spacegroup": 99
},
{
"id": "jvasp-65281",
"created_at": "2022-09-04T14:36:15.987056Z",
"updated_at": "2022-09-04T14:36:15.987080Z",
"structure_string": "Hf4 Be1 P1\n1.0\n-0.000000 3.954375 3.954375\n3.954375 -0.000000 3.954375\n3.954375 3.954375 0.000000\nHf Be P\n4 1 1\ndirect\n0.122033 0.625988 0.625988 Hf\n0.625988 0.625988 0.625988 Hf\n0.625988 0.122033 0.625988 Hf\n0.625988 0.625988 0.122033 Hf\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 P\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Hf",
"Be",
"P"
],
"chemical_system": "Be-Hf-P",
"density": 10.12338504336667,
"density_atomic": 0.048516302956516044,
"volume": 123.669769425293,
"volume_molar": 12.412612653930978,
"formula_full": "Hf4 Be1 P1",
"formula_reduced": "Hf4BeP",
"formula_anonymous": "ABC4",
"energy_above_hull": 5.070600600000001,
"spacegroup": 216
}
]
}