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=4589",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=4587",
"results": [
{
"id": "jvasp-100785",
"created_at": "2022-09-04T14:36:35.925046Z",
"updated_at": "2022-09-04T14:36:35.925079Z",
"structure_string": "Yb2 Ni1 Sb2\n1.0\n4.308971 -0.008343 6.403838\n1.947743 3.843643 6.403838\n-0.013610 -0.008343 7.718561\nYb Ni Sb\n2 1 2\ndirect\n0.993943 0.993945 0.993945 Yb\n0.506314 0.506315 0.506315 Yb\n0.375159 0.375159 0.375159 Ni\n0.746285 0.746286 0.746286 Sb\n0.253296 0.253296 0.253296 Sb\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Yb",
"Ni",
"Sb"
],
"chemical_system": "Ni-Sb-Yb",
"density": 8.38256773431424,
"density_atomic": 0.03893376274054293,
"volume": 128.42324111646536,
"volume_molar": 15.46765669717548,
"formula_full": "Yb2 Ni1 Sb2",
"formula_reduced": "Yb2NiSb2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.4231671999999999,
"spacegroup": 160
},
{
"id": "jvasp-100784",
"created_at": "2022-09-04T14:36:46.553355Z",
"updated_at": "2022-09-04T14:36:46.553367Z",
"structure_string": "Yb1 Ho2 Se4\n1.0\n4.090354 0.000000 0.000000\n-0.000000 6.638962 2.168743\n-0.000000 0.020949 7.094120\nYb Ho Se\n1 2 4\ndirect\n0.000000 0.500000 0.500000 Yb\n0.000000 0.000000 0.000000 Ho\n0.499999 0.500000 -0.000000 Ho\n0.499999 0.757212 0.245478 Se\n0.000000 0.256529 0.236487 Se\n0.499999 0.242788 0.754522 Se\n0.000000 0.743471 0.763513 Se\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Yb",
"Ho",
"Se"
],
"chemical_system": "Ho-Se-Yb",
"density": 7.06406983058019,
"density_atomic": 0.03637119565855083,
"volume": 192.45999129957963,
"volume_molar": 16.557445118206342,
"formula_full": "Yb1 Ho2 Se4",
"formula_reduced": "Yb(HoSe2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.9489736142857144,
"spacegroup": 10
},
{
"id": "jvasp-100783",
"created_at": "2022-09-04T14:36:45.825328Z",
"updated_at": "2022-09-04T14:36:45.825360Z",
"structure_string": "Zr2 Cu3 Sb3\n1.0\n4.232980 -0.000000 0.000000\n0.000000 4.232980 0.000000\n-0.000000 -0.000000 8.797763\nZr Cu Sb\n2 3 3\ndirect\n0.500000 0.500000 0.759057 Zr\n0.000000 0.000000 0.266172 Zr\n0.500000 0.000000 0.475879 Cu\n-0.000000 0.500000 0.475879 Cu\n0.500000 0.500000 0.328734 Cu\n0.500000 0.000000 0.017088 Sb\n-0.000000 0.500000 0.017088 Sb\n0.000000 0.000000 0.660103 Sb\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Zr",
"Cu",
"Sb"
],
"chemical_system": "Cu-Sb-Zr",
"density": 7.777787907281239,
"density_atomic": 0.05074874368024529,
"volume": 157.639370353795,
"volume_molar": 11.866580969854054,
"formula_full": "Zr2 Cu3 Sb3",
"formula_reduced": "Zr2(CuSb)3",
"formula_anonymous": "A2B3C3",
"energy_above_hull": 1.7480148312500003,
"spacegroup": 99
},
{
"id": "jvasp-100782",
"created_at": "2022-09-04T14:36:35.087282Z",
"updated_at": "2022-09-04T14:36:35.087314Z",
"structure_string": "Yb1 Al1 Cu4\n1.0\n5.139100 -0.000000 0.000000\n-2.569550 4.450592 0.000000\n-0.000000 0.000000 4.032766\nYb Al Cu\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Yb\n0.333333 0.666666 -0.000000 Al\n0.666667 0.333333 -0.000000 Cu\n0.997812 0.498906 0.500001 Cu\n0.501094 0.498906 0.500001 Cu\n0.501094 0.002188 0.500001 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Yb",
"Al",
"Cu"
],
"chemical_system": "Al-Cu-Yb",
"density": 8.176993428896246,
"density_atomic": 0.06504941211136378,
"volume": 92.23757456451835,
"volume_molar": 9.257794289808755,
"formula_full": "Yb1 Al1 Cu4",
"formula_reduced": "YbAlCu4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.03488545,
"spacegroup": 187
},
{
"id": "jvasp-100781",
"created_at": "2022-09-04T14:36:34.872224Z",
"updated_at": "2022-09-04T14:36:34.872242Z",
"structure_string": "Zr1 Mn1 Cu2 Se4\n1.0\n6.103653 -0.201583 2.733085\n4.262977 4.372899 2.733085\n0.158330 0.063709 6.170647\nZr Mn Cu Se\n1 1 2 4\ndirect\n0.493094 0.493095 0.160871 Zr\n0.247020 0.247021 0.762457 Mn\n0.036431 0.036431 0.384705 Cu\n0.705000 0.705001 0.546100 Cu\n0.740653 0.740655 0.896816 Se\n0.250257 0.250258 0.346762 Se\n0.493205 0.493206 0.577734 Se\n0.002265 0.002265 0.022052 Se\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Zr",
"Mn",
"Cu",
"Se"
],
"chemical_system": "Cu-Mn-Se-Zr",
"density": 5.833070785277296,
"density_atomic": 0.04770385800674382,
"volume": 167.70132090509435,
"volume_molar": 12.62401200160511,
"formula_full": "Zr1 Mn1 Cu2 Se4",
"formula_reduced": "ZrMn(CuSe2)2",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.865125763505747,
"spacegroup": 8
},
{
"id": "jvasp-100780",
"created_at": "2022-09-04T14:36:34.382975Z",
"updated_at": "2022-09-04T14:36:34.383000Z",
"structure_string": "Zr1 Ti1 N2\n1.0\n3.006102 -0.002633 4.501315\n1.362912 2.679389 4.501315\n-0.004298 -0.002633 5.412806\nZr Ti N\n1 1 2\ndirect\n0.499998 0.500001 0.500001 Zr\n0.000000 0.000000 0.000000 Ti\n0.255240 0.255241 0.255241 N\n0.744757 0.744762 0.744762 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Ti",
"N"
],
"chemical_system": "N-Ti-Zr",
"density": 6.3514313176603,
"density_atomic": 0.09155764524606343,
"volume": 43.688323233411055,
"volume_molar": 6.577430801999492,
"formula_full": "Zr1 Ti1 N2",
"formula_reduced": "ZrTiN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.137304833333333,
"spacegroup": 166
},
{
"id": "jvasp-100779",
"created_at": "2022-09-04T14:36:41.545379Z",
"updated_at": "2022-09-04T14:36:41.545398Z",
"structure_string": "Ca1 Bi1 Au4\n1.0\n4.922492 -0.000000 2.842002\n1.640831 4.640970 2.842002\n-0.000000 -0.000000 5.684004\nCa Bi Au\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Ca\n0.000000 0.000000 0.000000 Bi\n0.624534 0.624534 0.624533 Au\n0.624534 0.624534 0.126399 Au\n0.624534 0.126399 0.624533 Au\n0.126399 0.624534 0.624533 Au\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ca",
"Bi",
"Au"
],
"chemical_system": "Au-Bi-Ca",
"density": 13.260141306372793,
"density_atomic": 0.04620650235469749,
"volume": 129.85185405166297,
"volume_molar": 13.033102384101515,
"formula_full": "Ca1 Bi1 Au4",
"formula_reduced": "CaBiAu4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.3682914408333333,
"spacegroup": 216
},
{
"id": "jvasp-100777",
"created_at": "2022-09-04T14:36:40.665100Z",
"updated_at": "2022-09-04T14:36:40.665120Z",
"structure_string": "Nd2 Ni2 Sn1\n1.0\n4.970928 0.011602 -2.567894\n-1.010629 3.872409 -3.909913\n-0.019561 -0.011602 5.594982\nNd Ni Sn\n2 2 1\ndirect\n0.295930 0.795931 0.500001 Nd\n0.704070 0.204070 0.500001 Nd\n0.707839 0.500000 0.207840 Ni\n0.292161 0.500000 0.792162 Ni\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Nd",
"Ni",
"Sn"
],
"chemical_system": "Nd-Ni-Sn",
"density": 8.116967649350082,
"density_atomic": 0.046591032063740156,
"volume": 107.31678991698683,
"volume_molar": 12.925536295828868,
"formula_full": "Nd2 Ni2 Sn1",
"formula_reduced": "Nd2Ni2Sn",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.1154759000000003,
"spacegroup": 71
},
{
"id": "jvasp-100776",
"created_at": "2022-09-04T14:36:39.335554Z",
"updated_at": "2022-09-04T14:36:39.335575Z",
"structure_string": "Rb1 Pa1 O3\n1.0\n4.404411 -0.000000 0.000000\n0.000000 4.404411 0.000000\n0.000000 0.000000 4.404411\nRb Pa O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Pa\n0.500000 0.000000 -0.000000 O\n-0.000000 0.500000 -0.000000 O\n0.000000 0.000000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"Pa",
"O"
],
"chemical_system": "O-Pa-Rb",
"density": 7.084110947380949,
"density_atomic": 0.05852029254187652,
"volume": 85.44044779718166,
"volume_molar": 10.290688064641198,
"formula_full": "Rb1 Pa1 O3",
"formula_reduced": "RbPaO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.68599072,
"spacegroup": 221
},
{
"id": "jvasp-100775",
"created_at": "2022-09-04T14:36:33.406579Z",
"updated_at": "2022-09-04T14:36:33.406595Z",
"structure_string": "Nb4 B4 Mo2\n1.0\n6.137948 0.000000 0.000000\n0.000000 6.137948 0.000000\n0.000000 -0.000000 3.303322\nNb B Mo\n4 4 2\ndirect\n0.679925 0.179925 0.500000 Nb\n0.320075 0.820075 0.500000 Nb\n0.179925 0.320075 0.500000 Nb\n0.820075 0.679925 0.500000 Nb\n0.106907 0.606907 -0.000000 B\n0.893093 0.393093 -0.000000 B\n0.606907 0.893093 -0.000000 B\n0.393093 0.106907 -0.000000 B\n0.000000 0.000000 0.000000 Mo\n0.500000 0.500000 -0.000000 Mo\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Nb",
"B",
"Mo"
],
"chemical_system": "B-Mo-Nb",
"density": 8.095827006888948,
"density_atomic": 0.08035310818365897,
"volume": 124.45069302289482,
"volume_molar": 7.494595910634225,
"formula_full": "Nb4 B4 Mo2",
"formula_reduced": "Nb2B2Mo",
"formula_anonymous": "AB2C2",
"energy_above_hull": 5.400219973333333,
"spacegroup": 127
},
{
"id": "jvasp-100774",
"created_at": "2022-09-04T14:36:37.079245Z",
"updated_at": "2022-09-04T14:36:37.079277Z",
"structure_string": "Zr2 H2 Br2\n1.0\n3.435344 -0.000000 0.000000\n-1.717671 2.975095 0.000000\n-0.000000 -0.000000 10.045334\nZr H Br\n2 2 2\ndirect\n0.333334 0.666668 0.646541 Zr\n0.666666 0.333334 0.353459 Zr\n0.333334 0.666668 0.441493 H\n0.666666 0.333334 0.558506 H\n0.333334 0.666668 0.162994 Br\n0.666666 0.333334 0.837006 Br\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Zr",
"H",
"Br"
],
"chemical_system": "Br-H-Zr",
"density": 5.5682047614880865,
"density_atomic": 0.05844075246419475,
"volume": 102.66808257946467,
"volume_molar": 10.304694080880669,
"formula_full": "Zr2 H2 Br2",
"formula_reduced": "ZrHBr",
"formula_anonymous": "ABC",
"energy_above_hull": 1.715179535,
"spacegroup": 164
},
{
"id": "jvasp-100773",
"created_at": "2022-09-04T14:37:11.096480Z",
"updated_at": "2022-09-04T14:37:11.096507Z",
"structure_string": "Ba2 U1 Hg1 O6\n1.0\n5.392953 -0.000000 3.113623\n1.797651 5.084525 3.113623\n-0.000000 -0.000000 6.227245\nBa U Hg O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.749999 0.750000 Ba\n0.500000 0.500000 0.500000 U\n0.000000 0.000000 0.000000 Hg\n0.735919 0.264081 0.264081 O\n0.264081 0.735919 0.735920 O\n0.264081 0.735919 0.264081 O\n0.735919 0.264081 0.735920 O\n0.264081 0.264081 0.735920 O\n0.735919 0.735919 0.264081 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"U",
"Hg",
"O"
],
"chemical_system": "Ba-Hg-O-U",
"density": 7.869899625855996,
"density_atomic": 0.05856350011636345,
"volume": 170.7548213499941,
"volume_molar": 10.283095696183178,
"formula_full": "Ba2 U1 Hg1 O6",
"formula_reduced": "Ba2UHgO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.919466354,
"spacegroup": 225
}
]
}