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=-density&page=1523",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=1521",
"results": [
{
"id": "jvasp-103485",
"created_at": "2022-09-04T14:36:46.111278Z",
"updated_at": "2022-09-04T14:36:46.111307Z",
"structure_string": "Fe2 Si1\n1.0\n2.587385 -0.015983 -4.064070\n-0.233011 2.576921 -4.064070\n0.014693 0.015983 4.817781\nFe Si\n2 1\ndirect\n0.338954 0.338954 -0.000000 Fe\n0.661045 0.661046 -0.000000 Fe\n0.000000 0.000000 0.000000 Si\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Fe",
"Si"
],
"chemical_system": "Fe-Si",
"density": 7.154260515876846,
"density_atomic": 0.0924710636882919,
"volume": 32.44258128264443,
"volume_molar": 6.512459703394205,
"formula_full": "Fe2 Si1",
"formula_reduced": "Fe2Si",
"formula_anonymous": "AB2",
"energy_above_hull": 2.891406533333333,
"spacegroup": 139
},
{
"id": "jvasp-71998",
"created_at": "2022-09-04T14:35:56.206520Z",
"updated_at": "2022-09-04T14:35:56.206552Z",
"structure_string": "Be1 Fe2 Ge1\n1.0\n-1.742209 1.742209 3.696404\n1.742209 -1.742209 3.696404\n1.742209 1.742209 -3.696404\nBe Fe Ge\n1 2 1\ndirect\n0.750000 0.250000 0.500000 Be\n0.000000 0.000000 0.000000 Fe\n0.250000 0.750000 0.500000 Fe\n0.499999 0.499999 0.000000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Fe",
"Ge"
],
"chemical_system": "Be-Fe-Ge",
"density": 7.153783363659041,
"density_atomic": 0.08912921112556581,
"volume": 44.87866491227858,
"volume_molar": 6.756640930565367,
"formula_full": "Be1 Fe2 Ge1",
"formula_reduced": "BeFe2Ge",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.3669532625,
"spacegroup": 119
},
{
"id": "jvasp-30883",
"created_at": "2022-09-04T14:38:31.969922Z",
"updated_at": "2022-09-04T14:38:31.969952Z",
"structure_string": "Zr4 Ga6\n1.0\n5.406916 0.001566 -1.027988\n-2.960709 4.524262 -1.027988\n-0.005543 -0.010255 7.435434\nZr Ga\n4 6\ndirect\n0.113510 0.751627 0.895656 Zr\n0.855974 0.217855 0.104343 Zr\n0.001628 0.863511 0.395656 Zr\n0.467855 0.605972 0.604342 Zr\n0.603441 0.603441 -0.000000 Ga\n0.853442 0.353441 0.499999 Ga\n0.519364 0.158232 0.730520 Ga\n0.427712 0.788842 0.269479 Ga\n0.408233 0.269364 0.230520 Ga\n0.038842 0.177711 0.769479 Ga\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Zr",
"Ga"
],
"chemical_system": "Ga-Zr",
"density": 7.153635716601114,
"density_atomic": 0.05500297643619017,
"volume": 181.80834289215528,
"volume_molar": 10.948754322389048,
"formula_full": "Zr4 Ga6",
"formula_reduced": "Zr2Ga3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.4375131950000002,
"spacegroup": 43
},
{
"id": "jvasp-92308",
"created_at": "2022-09-04T14:35:53.192285Z",
"updated_at": "2022-09-04T14:35:53.192299Z",
"structure_string": "Yb1 Cu2 S2\n1.0\n3.908065 0.000049 0.000050\n-1.953990 3.384376 -0.000007\n0.000084 0.000034 6.393148\nYb Cu S\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.666679 0.333347 0.639358 Cu\n0.333319 0.666653 0.360642 Cu\n0.666661 0.333330 0.253431 S\n0.333338 0.666670 0.746570 S\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Yb",
"Cu",
"S"
],
"chemical_system": "Cu-S-Yb",
"density": 7.153270992971775,
"density_atomic": 0.05913052257576667,
"volume": 84.55869798196471,
"volume_molar": 10.184487634594388,
"formula_full": "Yb1 Cu2 S2",
"formula_reduced": "Yb(CuS)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.2360043199999998,
"spacegroup": 164
},
{
"id": "jvasp-71553",
"created_at": "2022-09-04T14:35:50.576415Z",
"updated_at": "2022-09-04T14:35:50.576443Z",
"structure_string": "Ca1 Be2 Os1\n1.0\n3.080916 0.000000 -0.000000\n0.000000 3.080916 0.000000\n0.000000 -0.000000 6.073261\nCa Be Os\n1 2 1\ndirect\n0.500001 0.500001 0.000000 Ca\n0.000000 0.000000 0.668890 Be\n0.000000 0.000000 0.331109 Be\n0.500001 0.500001 0.500000 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Be",
"Os"
],
"chemical_system": "Be-Ca-Os",
"density": 7.153206452514592,
"density_atomic": 0.06938703512244557,
"volume": 57.64765698579425,
"volume_molar": 8.679057621316257,
"formula_full": "Ca1 Be2 Os1",
"formula_reduced": "CaBe2Os",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.285061905,
"spacegroup": 123
},
{
"id": "jvasp-110911",
"created_at": "2022-09-04T14:38:46.748722Z",
"updated_at": "2022-09-04T14:38:46.748744Z",
"structure_string": "Zr2 Zn4 Ge2\n1.0\n3.905955 0.027571 -8.206862\n-0.174351 3.902160 -8.206862\n-0.026181 -0.027571 9.088915\nZr Zn Ge\n2 4 2\ndirect\n0.126117 0.126117 0.000000 Zr\n0.873884 0.873883 0.000001 Zr\n0.398012 0.398012 0.000001 Zn\n0.601989 0.601988 0.000001 Zn\n0.500001 0.000000 0.500001 Zn\n0.000000 0.500000 0.500001 Zn\n0.750001 0.250000 0.500001 Ge\n0.250001 0.750000 0.500001 Ge\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Zr",
"Zn",
"Ge"
],
"chemical_system": "Ge-Zn-Zr",
"density": 7.153015723413743,
"density_atomic": 0.05847180019109018,
"volume": 136.81808964073974,
"volume_molar": 10.299222429135408,
"formula_full": "Zr2 Zn4 Ge2",
"formula_reduced": "ZrZn2Ge",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4000078125,
"spacegroup": 139
},
{
"id": "jvasp-110904",
"created_at": "2022-09-04T14:38:37.303994Z",
"updated_at": "2022-09-04T14:38:37.304013Z",
"structure_string": "Ba2 Zr1 U1 O6\n1.0\n5.304394 -0.000000 3.062493\n1.768131 5.001031 3.062493\n-0.000000 -0.000000 6.124987\nBa Zr U O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.749999 0.750000 0.750000 Ba\n0.000000 0.000000 0.000000 Zr\n0.499999 0.500000 0.500000 U\n0.755682 0.244317 0.244317 O\n0.244317 0.755682 0.755683 O\n0.244317 0.755682 0.244317 O\n0.755682 0.244317 0.755683 O\n0.244317 0.244317 0.755683 O\n0.755682 0.755682 0.244317 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Zr",
"U",
"O"
],
"chemical_system": "Ba-O-U-Zr",
"density": 7.152974088528546,
"density_atomic": 0.06154595386702462,
"volume": 162.48021797835597,
"volume_molar": 9.784787433811424,
"formula_full": "Ba2 Zr1 U1 O6",
"formula_reduced": "Ba2ZrUO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.561437344,
"spacegroup": 225
},
{
"id": "jvasp-2967",
"created_at": "2022-09-04T14:36:57.761650Z",
"updated_at": "2022-09-04T14:36:57.761678Z",
"structure_string": "Sm2 O2 F2\n1.0\n3.751105 0.000575 5.761764\n1.710724 3.338294 5.761764\n0.000941 0.000575 6.875224\nSm O F\n2 2 2\ndirect\n0.758169 0.758172 0.758171 Sm\n0.241828 0.241829 0.241829 Sm\n0.878402 0.878406 0.878404 O\n0.121595 0.121596 0.121595 O\n0.369753 0.369755 0.369754 F\n0.630243 0.630246 0.630245 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sm",
"O",
"F"
],
"chemical_system": "F-O-Sm",
"density": 7.152845468175475,
"density_atomic": 0.06971723042966033,
"volume": 86.06193853402667,
"volume_molar": 8.63795179883961,
"formula_full": "Sm2 O2 F2",
"formula_reduced": "SmOF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 166
},
{
"id": "jvasp-4412",
"created_at": "2022-09-04T14:37:58.611492Z",
"updated_at": "2022-09-04T14:37:58.611508Z",
"structure_string": "Cu1 Ag1 Te2\n1.0\n3.181864 0.000000 0.000000\n0.000000 4.230501 0.000000\n0.000000 0.000000 7.357583\nCu Ag Te\n1 1 2\ndirect\n0.499999 0.000000 0.567673 Cu\n0.000000 0.500000 0.443498 Ag\n0.000000 0.000000 0.203778 Te\n0.499999 0.500000 0.785050 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cu",
"Ag",
"Te"
],
"chemical_system": "Ag-Cu-Te",
"density": 7.152795677185738,
"density_atomic": 0.040387912460877196,
"volume": 99.0395332730976,
"volume_molar": 14.910750254382432,
"formula_full": "Cu1 Ag1 Te2",
"formula_reduced": "CuAgTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2881833108333334,
"spacegroup": 25
},
{
"id": "jvasp-122919",
"created_at": "2022-09-04T14:38:54.605727Z",
"updated_at": "2022-09-04T14:38:54.605752Z",
"structure_string": "V1 As1\n1.0\n3.080096 0.000000 0.000000\n0.000000 3.080096 0.000000\n-0.000000 0.000000 3.080096\nV As\n1 1\ndirect\n0.500001 0.500001 0.500001 V\n0.000000 0.000000 0.000000 As\n",
"nsites": 2,
"nelements": 2,
"elements": [
"V",
"As"
],
"chemical_system": "As-V",
"density": 7.152448895357694,
"density_atomic": 0.06844429231670868,
"volume": 29.22084416835673,
"volume_molar": 8.79860183539347,
"formula_full": "V1 As1",
"formula_reduced": "VAs",
"formula_anonymous": "AB",
"energy_above_hull": null,
"spacegroup": 221
},
{
"id": "jvasp-106284",
"created_at": "2022-09-04T14:38:40.021613Z",
"updated_at": "2022-09-04T14:38:40.021635Z",
"structure_string": "Zr2 Ni2 H2\n1.0\n5.566384 -0.013097 0.000000\n-4.518148 3.251329 -0.000000\n0.000000 0.000000 3.884868\nZr Ni H\n2 2 2\ndirect\n0.142643 0.857356 0.750000 Zr\n0.857355 0.142643 0.250000 Zr\n0.431778 0.568221 0.750000 Ni\n0.568220 0.431778 0.250000 Ni\n0.764011 0.235987 0.750000 H\n0.235987 0.764012 0.250000 H\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Zr",
"Ni",
"H"
],
"chemical_system": "H-Ni-Zr",
"density": 7.152423405727785,
"density_atomic": 0.08561763161698968,
"volume": 70.07902328857902,
"volume_molar": 7.033762376119017,
"formula_full": "Zr2 Ni2 H2",
"formula_reduced": "ZrNiH",
"formula_anonymous": "ABC",
"energy_above_hull": 2.1826356333333337,
"spacegroup": 63
},
{
"id": "jvasp-15029",
"created_at": "2022-09-04T14:37:09.937589Z",
"updated_at": "2022-09-04T14:37:09.937610Z",
"structure_string": "Ce2 O3\n1.0\n1.911659 -3.311090 0.000000\n1.911659 3.311090 -0.000000\n0.000000 -0.000000 6.019691\nCe O\n2 3\ndirect\n0.333333 0.666667 0.243823 Ce\n0.666667 0.333333 0.756177 Ce\n0.333333 0.666667 0.642215 O\n0.666667 0.333333 0.357785 O\n0.000000 0.000000 0.000000 O\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Ce",
"O"
],
"chemical_system": "Ce-O",
"density": 7.152239172339131,
"density_atomic": 0.06561216953817296,
"volume": 76.20537524050344,
"volume_molar": 9.17838992733861,
"formula_full": "Ce2 O3",
"formula_reduced": "Ce2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.7774407,
"spacegroup": 164
}
]
}