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=142",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=140",
"results": [
{
"id": "jvasp-93692",
"created_at": "2022-09-04T14:36:03.222356Z",
"updated_at": "2022-09-04T14:36:03.222379Z",
"structure_string": "Ta3 N3\n1.0\n5.238392 0.000000 0.000000\n-2.619196 4.536580 0.000000\n0.000000 0.000000 2.924485\nTa N\n3 3\ndirect\n0.000000 0.000000 0.000000 Ta\n0.333332 0.666667 0.499999 Ta\n0.666667 0.333333 0.499999 Ta\n0.392065 0.000000 0.000000 N\n0.607935 0.607935 0.000000 N\n-0.000000 0.392065 0.000000 N\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ta",
"N"
],
"chemical_system": "N-Ta",
"density": 13.974228105524208,
"density_atomic": 0.08633269215106103,
"volume": 69.49858565167263,
"volume_molar": 6.9755044235881485,
"formula_full": "Ta3 N3",
"formula_reduced": "TaN",
"formula_anonymous": "AB",
"energy_above_hull": 3.2904162249999995,
"spacegroup": 189
},
{
"id": "jvasp-99257",
"created_at": "2022-09-04T14:35:58.600925Z",
"updated_at": "2022-09-04T14:35:58.600952Z",
"structure_string": "Co2 Sb4\n1.0\n3.446999 0.000000 0.000000\n0.000000 5.593307 -0.000000\n0.000000 0.000000 6.435574\nCo Sb\n2 4\ndirect\n0.000000 0.000000 0.000000 Co\n0.500000 0.500000 0.500000 Co\n0.000000 0.202571 0.356784 Sb\n0.000000 0.797429 0.643216 Sb\n0.500000 0.702572 0.143216 Sb\n0.500000 0.297429 0.856783 Sb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Co",
"Sb"
],
"chemical_system": "Co-Sb",
"density": 8.095434564734948,
"density_atomic": 0.048356420714005796,
"volume": 124.07866238665136,
"volume_molar": 12.453652836748867,
"formula_full": "Co2 Sb4",
"formula_reduced": "CoSb2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.8762610333333336,
"spacegroup": 58
},
{
"id": "jvasp-93273",
"created_at": "2022-09-04T14:36:03.698936Z",
"updated_at": "2022-09-04T14:36:03.698954Z",
"structure_string": "Ba2 Rh4\n1.0\n4.866273 -0.000000 2.809544\n1.622092 4.587965 2.809544\n-0.000000 0.000000 5.619087\nBa Rh\n2 4\ndirect\n0.375000 0.375000 0.375000 Ba\n0.624999 0.625001 0.625000 Ba\n-0.000000 0.500001 -0.000000 Rh\n0.500000 0.000000 -0.000000 Rh\n0.000000 0.000000 0.000000 Rh\n0.000000 0.000000 0.500000 Rh\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ba",
"Rh"
],
"chemical_system": "Ba-Rh",
"density": 9.08375865314088,
"density_atomic": 0.047826536196504156,
"volume": 125.45336704602424,
"volume_molar": 12.59163058611839,
"formula_full": "Ba2 Rh4",
"formula_reduced": "BaRh2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.588607323333333,
"spacegroup": 227
},
{
"id": "jvasp-75",
"created_at": "2022-09-04T14:36:01.784205Z",
"updated_at": "2022-09-04T14:36:01.784228Z",
"structure_string": "W2 Se4\n1.0\n1.664339 -2.882719 0.000000\n1.664339 2.882719 0.000000\n0.000000 0.000000 13.231735\nW Se\n2 4\ndirect\n0.666667 0.333333 0.250000 W\n0.333333 0.666667 0.750000 W\n0.333333 0.666667 0.122875 Se\n0.666667 0.333333 0.622875 Se\n0.333333 0.666667 0.377125 Se\n0.666667 0.333333 0.877125 Se\n",
"nsites": 6,
"nelements": 2,
"elements": [
"W",
"Se"
],
"chemical_system": "Se-W",
"density": 8.939421879964188,
"density_atomic": 0.04725637016570593,
"volume": 126.9670095049792,
"volume_molar": 12.743553385254046,
"formula_full": "W2 Se4",
"formula_reduced": "WSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.036485577777777,
"spacegroup": 194
},
{
"id": "jvasp-98176",
"created_at": "2022-09-04T14:35:54.162420Z",
"updated_at": "2022-09-04T14:35:54.162442Z",
"structure_string": "La2 Au2\n1.0\n-3.988147 -0.000000 0.000000\n-0.000000 -0.000000 -4.841414\n1.994073 -5.755818 0.000000\nLa Au\n2 2\ndirect\n0.865017 0.749999 0.730031 La\n0.134985 0.250000 0.269969 La\n0.590073 0.749999 0.180145 Au\n0.409929 0.250000 0.819855 Au\n",
"nsites": 4,
"nelements": 2,
"elements": [
"La",
"Au"
],
"chemical_system": "Au-La",
"density": 10.03696735214384,
"density_atomic": 0.035992296589489464,
"volume": 111.13489215823164,
"volume_molar": 16.731749098107276,
"formula_full": "La2 Au2",
"formula_reduced": "LaAu",
"formula_anonymous": "AB",
"energy_above_hull": 0.295591285,
"spacegroup": 63
},
{
"id": "jvasp-61913",
"created_at": "2022-09-04T14:35:45.298747Z",
"updated_at": "2022-09-04T14:35:45.298774Z",
"structure_string": "K1 Au5\n1.0\n2.887484 -5.001268 -0.000000\n2.887484 5.001268 0.000000\n0.000000 0.000000 4.536076\nK Au\n1 5\ndirect\n0.000000 0.000000 0.000000 K\n0.333332 0.666666 0.000000 Au\n0.666666 0.333332 0.000000 Au\n0.500000 -0.000000 0.500000 Au\n-0.000000 0.500000 0.500000 Au\n0.499999 0.499999 0.500000 Au\n",
"nsites": 6,
"nelements": 2,
"elements": [
"K",
"Au"
],
"chemical_system": "Au-K",
"density": 12.978061227900705,
"density_atomic": 0.04579744170199575,
"volume": 131.0116848675094,
"volume_molar": 13.149513457948393,
"formula_full": "K1 Au5",
"formula_reduced": "KAu5",
"formula_anonymous": "AB5",
"energy_above_hull": 0.183330975,
"spacegroup": 191
},
{
"id": "jvasp-89916",
"created_at": "2022-09-04T14:35:54.164230Z",
"updated_at": "2022-09-04T14:35:54.164255Z",
"structure_string": "Ta6 N3\n1.0\n-0.000028 0.000048 -4.967997\n-2.658516 -4.604606 0.000032\n-2.658446 4.604565 -0.000064\nTa N\n6 3\ndirect\n0.246455 0.333233 0.333239 Ta\n0.246456 0.666769 0.000006 Ta\n0.246472 0.000000 0.666775 Ta\n0.753545 0.666769 0.666763 Ta\n0.753544 0.333233 0.999996 Ta\n0.753527 0.000000 0.333227 Ta\n0.500000 0.666654 0.333328 N\n0.500000 0.333348 0.666674 N\n0.000000 0.000000 0.000000 N\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Ta",
"N"
],
"chemical_system": "N-Ta",
"density": 15.396077806596228,
"density_atomic": 0.07399580284891645,
"volume": 121.62852017939542,
"volume_molar": 8.138489655009106,
"formula_full": "Ta6 N3",
"formula_reduced": "Ta2N",
"formula_anonymous": "AB2",
"energy_above_hull": 5.165840549999999,
"spacegroup": 162
},
{
"id": "jvasp-52389",
"created_at": "2022-09-04T14:36:04.314766Z",
"updated_at": "2022-09-04T14:36:04.314789Z",
"structure_string": "Mn6 O12\n1.0\n2.871446 -0.000053 0.000344\n-1.435655 6.949656 -0.036787\n-0.001455 -0.178923 8.846535\nMn O\n6 12\ndirect\n0.342693 0.679798 0.742974 Mn\n0.342683 0.679799 0.242975 Mn\n0.661745 0.317913 0.755293 Mn\n0.661734 0.317914 0.255293 Mn\n0.002216 0.998858 0.999136 Mn\n0.002217 0.998857 0.499134 Mn\n0.226906 0.448211 0.357558 O\n0.226918 0.448213 0.857558 O\n0.896544 0.787492 0.355905 O\n0.896554 0.787496 0.855903 O\n0.107878 0.210220 0.142361 O\n0.444759 0.883911 0.603575 O\n0.444758 0.883911 0.103575 O\n0.777520 0.549498 0.640710 O\n0.559668 0.113793 0.394686 O\n0.559673 0.113799 0.894692 O\n0.107885 0.210216 0.642364 O\n0.777510 0.549501 0.140710 O\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Mn",
"O"
],
"chemical_system": "Mn-O",
"density": 4.906987927345052,
"density_atomic": 0.10197254805935711,
"volume": 176.51809572829734,
"volume_molar": 5.905648995349786,
"formula_full": "Mn6 O12",
"formula_reduced": "MnO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.080564747126438,
"spacegroup": 12
},
{
"id": "jvasp-14073",
"created_at": "2022-09-04T14:35:54.184368Z",
"updated_at": "2022-09-04T14:35:54.184391Z",
"structure_string": "Mn10 As8\n1.0\n3.535276 -0.000000 0.000000\n-1.767637 6.500089 -0.000000\n-0.000000 -0.000000 11.829403\nMn As\n10 8\ndirect\n0.021499 0.042998 0.290157 Mn\n0.216530 0.433061 0.178881 Mn\n0.555216 0.110432 0.125017 Mn\n0.444784 0.889568 0.625017 Mn\n0.633891 0.267782 0.517763 Mn\n0.783470 0.566940 0.678881 Mn\n0.831327 0.662651 0.374064 Mn\n0.168674 0.337349 0.874064 Mn\n0.978501 0.957002 0.790157 Mn\n0.366109 0.732218 0.017763 Mn\n0.604766 0.209529 0.734633 As\n0.004278 0.008555 0.995882 As\n0.995723 0.991445 0.495882 As\n0.273104 0.546209 0.526031 As\n0.726896 0.453791 0.026031 As\n0.346832 0.693666 0.806669 As\n0.653168 0.306334 0.306669 As\n0.395235 0.790471 0.234633 As\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Mn",
"As"
],
"chemical_system": "As-Mn",
"density": 7.017305677936124,
"density_atomic": 0.0662166262542007,
"volume": 271.8350513796843,
"volume_molar": 9.094605238390503,
"formula_full": "Mn10 As8",
"formula_reduced": "Mn5As4",
"formula_anonymous": "A4B5",
"energy_above_hull": 3.992367022988505,
"spacegroup": 36
},
{
"id": "jvasp-12148",
"created_at": "2022-09-04T14:35:51.271061Z",
"updated_at": "2022-09-04T14:35:51.271087Z",
"structure_string": "Co2 Se2\n1.0\n3.641835 0.000000 0.000000\n-0.000000 3.641835 0.000000\n0.000000 0.000000 5.441973\nCo Se\n2 2\ndirect\n0.000000 0.000000 0.000000 Co\n0.499999 0.499999 0.000000 Co\n0.499999 0.000000 0.735798 Se\n0.000000 0.499999 0.264202 Se\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Co",
"Se"
],
"chemical_system": "Co-Se",
"density": 6.344903393347655,
"density_atomic": 0.0554195605614124,
"volume": 72.17668201405993,
"volume_molar": 10.86645346696073,
"formula_full": "Co2 Se2",
"formula_reduced": "CoSe",
"formula_anonymous": "AB",
"energy_above_hull": 1.4274121333333334,
"spacegroup": 129
},
{
"id": "jvasp-14999",
"created_at": "2022-09-04T14:35:48.044853Z",
"updated_at": "2022-09-04T14:35:48.044873Z",
"structure_string": "Nb1 S2\n1.0\n3.330013 0.000000 0.479552\n1.665007 2.913641 0.239776\n0.074853 0.000002 11.277553\nNb S\n1 2\ndirect\n0.077573 0.844856 0.000000 Nb\n0.814547 0.511521 0.859331 S\n0.673930 0.511522 0.140669 S\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Nb",
"S"
],
"chemical_system": "Nb-S",
"density": 2.3854363936841616,
"density_atomic": 0.02744351418777709,
"volume": 109.3154462461718,
"volume_molar": 21.943766817888676,
"formula_full": "Nb1 S2",
"formula_reduced": "NbS2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.4050264666666665,
"spacegroup": 42
},
{
"id": "jvasp-22565",
"created_at": "2022-09-04T14:36:01.582289Z",
"updated_at": "2022-09-04T14:36:01.582309Z",
"structure_string": "Sn4 O4\n1.0\n3.852557 0.258746 0.000005\n-0.258749 3.852385 0.000066\n0.000068 0.000108 9.854297\nSn O\n4 4\ndirect\n0.499829 0.500155 0.739404 Sn\n0.000171 0.999849 0.003599 Sn\n0.500167 0.499816 0.239398 Sn\n0.999835 0.000187 0.503603 Sn\n0.000176 0.499825 0.121504 O\n0.499825 0.000177 0.621496 O\n0.999826 0.500177 0.621504 O\n0.500175 0.999826 0.121497 O\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sn",
"O"
],
"chemical_system": "O-Sn",
"density": 6.090429030149873,
"density_atomic": 0.054454137455927726,
"volume": 146.9126199359006,
"volume_molar": 11.059105958429695,
"formula_full": "Sn4 O4",
"formula_reduced": "SnO",
"formula_anonymous": "AB",
"energy_above_hull": 0.2262225999999998,
"spacegroup": 129
}
]
}