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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=1174",
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"results": [
{
"id": "jvasp-110920",
"created_at": "2022-09-04T14:38:38.438169Z",
"updated_at": "2022-09-04T14:38:38.438186Z",
"structure_string": "Zn7 Tc1\n1.0\n4.743552 -0.000000 2.738691\n1.581184 4.472264 2.738691\n-0.000000 -0.000000 5.477382\nZn Tc\n7 1\ndirect\n0.500000 0.000000 0.000000 Zn\n-0.000000 0.500000 0.500000 Zn\n-0.000000 0.500000 0.000000 Zn\n0.500000 0.000000 0.500000 Zn\n0.000000 0.000000 0.500000 Zn\n0.500000 0.500000 0.000000 Zn\n0.500000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Tc\n",
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{
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"structure_string": "La1 N1\n1.0\n3.173697 -0.000000 -0.000000\n0.000000 3.173697 0.000000\n0.000000 0.000000 3.173697\nLa N\n1 1\ndirect\n0.000000 0.000000 0.000000 La\n0.500001 0.500001 0.500001 N\n",
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{
"id": "jvasp-59605",
"created_at": "2022-09-04T14:36:41.415071Z",
"updated_at": "2022-09-04T14:36:41.415100Z",
"structure_string": "Er4 Mn4 Si4\n1.0\n4.091643 -0.000000 0.000000\n0.000000 6.895521 0.000000\n0.000000 0.000000 7.418129\nEr Mn Si\n4 4 4\ndirect\n0.250000 0.005082 0.812136 Er\n0.749999 0.994918 0.187865 Er\n0.250000 0.505082 0.687865 Er\n0.749999 0.494918 0.312136 Er\n0.749999 0.857178 0.561445 Mn\n0.250000 0.142822 0.438556 Mn\n0.749999 0.357178 0.938556 Mn\n0.250000 0.642822 0.061444 Mn\n0.250000 0.290148 0.108782 Si\n0.749999 0.709852 0.891218 Si\n0.250000 0.790148 0.391218 Si\n0.749999 0.209852 0.608782 Si\n",
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"density_atomic": 0.0573352941842214,
"volume": 209.29516750090008,
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"formula_full": "Er4 Mn4 Si4",
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"formula_anonymous": "ABC",
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"spacegroup": 62
},
{
"id": "jvasp-40293",
"created_at": "2022-09-04T14:37:52.132302Z",
"updated_at": "2022-09-04T14:37:52.132322Z",
"structure_string": "Ce1 Zn2 Ag1\n1.0\n-0.000001 3.408401 3.408396\n3.408398 -0.000010 3.408405\n3.408399 3.408411 -0.000011\nCe Zn Ag\n1 2 1\ndirect\n0.749999 0.750001 0.750000 Ce\n-0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Zn\n0.249999 0.249999 0.249999 Ag\n",
"nsites": 4,
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"elements": [
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"density": 7.94287788749585,
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"volume": 79.19243635915146,
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"formula_full": "Ce1 Zn2 Ag1",
"formula_reduced": "CeZn2Ag",
"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-23344",
"created_at": "2022-09-04T14:37:59.021761Z",
"updated_at": "2022-09-04T14:37:59.021788Z",
"structure_string": "Zr4 In2 Ni4\n1.0\n7.198312 0.000000 -0.000000\n0.000000 7.198312 -0.000000\n0.000000 -0.000000 3.345992\nZr In Ni\n4 2 4\ndirect\n0.168815 0.668814 0.500000 Zr\n0.668814 0.831185 0.500000 Zr\n0.331185 0.168815 0.500000 Zr\n0.831185 0.331185 0.500000 Zr\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.000000 In\n0.124808 0.375192 0.000000 Ni\n0.375192 0.875191 0.000000 Ni\n0.624808 0.124808 0.000000 Ni\n0.875191 0.624808 0.000000 Ni\n",
"nsites": 10,
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"elements": [
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"density": 7.9428701743511665,
"density_atomic": 0.057678474913082166,
"volume": 173.3749031171398,
"volume_molar": 10.44088070822779,
"formula_full": "Zr4 In2 Ni4",
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"formula_anonymous": "AB2C2",
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"spacegroup": 127
},
{
"id": "jvasp-86256",
"created_at": "2022-09-04T14:36:03.215282Z",
"updated_at": "2022-09-04T14:36:03.215309Z",
"structure_string": "Ti8 Mn2 Bi4\n1.0\n4.756501 -0.000000 1.595918\n2.378250 7.440992 0.797960\n0.011300 -0.000000 7.852456\nTi Mn Bi\n8 2 4\ndirect\n0.691346 0.888065 0.729242 Ti\n0.308654 0.111934 0.270759 Ti\n0.579412 0.729241 0.111935 Ti\n0.079412 0.111934 0.729242 Ti\n0.808654 0.270759 0.111935 Ti\n0.420588 0.270759 0.888066 Ti\n0.920588 0.888065 0.270759 Ti\n0.191346 0.729241 0.888066 Ti\n0.250000 0.000000 0.000000 Mn\n0.750000 0.000000 0.000000 Mn\n0.139596 0.500000 0.220809 Bi\n0.360404 0.779191 0.500000 Bi\n0.860404 0.500000 0.779192 Bi\n0.639596 0.220809 0.500000 Bi\n",
"nsites": 14,
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"elements": [
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"Mn",
"Bi"
],
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"density": 7.942785684542226,
"density_atomic": 0.0503980619393331,
"volume": 277.78845973983215,
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"formula_full": "Ti8 Mn2 Bi4",
"formula_reduced": "Ti4MnBi2",
"formula_anonymous": "AB2C4",
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"spacegroup": 140
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{
"id": "jvasp-86858",
"created_at": "2022-09-04T14:35:40.821999Z",
"updated_at": "2022-09-04T14:35:40.822013Z",
"structure_string": "Ti8 Mn2 Bi4\n1.0\n4.756501 -0.000000 1.595918\n2.378250 7.440992 0.797960\n0.011300 -0.000000 7.852456\nTi Mn Bi\n8 2 4\ndirect\n0.691346 0.888065 0.729242 Ti\n0.308654 0.111934 0.270759 Ti\n0.579412 0.729241 0.111935 Ti\n0.079412 0.111934 0.729242 Ti\n0.808654 0.270759 0.111935 Ti\n0.420588 0.270759 0.888066 Ti\n0.920588 0.888065 0.270759 Ti\n0.191346 0.729241 0.888066 Ti\n0.250000 0.000000 0.000000 Mn\n0.750000 0.000000 0.000000 Mn\n0.139596 0.500000 0.220809 Bi\n0.360404 0.779191 0.500000 Bi\n0.860404 0.500000 0.779192 Bi\n0.639596 0.220809 0.500000 Bi\n",
"nsites": 14,
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"density": 7.942785684542226,
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"volume": 277.78845973983215,
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"formula_full": "Ti8 Mn2 Bi4",
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"formula_anonymous": "AB2C4",
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"spacegroup": 140
},
{
"id": "jvasp-17325",
"created_at": "2022-09-04T14:38:31.711452Z",
"updated_at": "2022-09-04T14:38:31.711480Z",
"structure_string": "Nb4 N4\n1.0\n1.506591 -2.609494 0.000000\n1.506591 2.609494 0.000000\n0.000000 0.000000 11.371188\nNb N\n4 4\ndirect\n0.333333 0.666666 0.377561 Nb\n0.666666 0.333333 0.877561 Nb\n0.666666 0.333333 0.622439 Nb\n0.333333 0.666666 0.122439 Nb\n0.666666 0.333333 0.250000 N\n0.333333 0.666666 0.750000 N\n0.000000 0.000000 0.500000 N\n0.000000 0.000000 0.000000 N\n",
"nsites": 8,
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"volume": 89.41029068030966,
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"formula_full": "Nb4 N4",
"formula_reduced": "NbN",
"formula_anonymous": "AB",
"energy_above_hull": 3.032501325,
"spacegroup": 194
},
{
"id": "jvasp-37140",
"created_at": "2022-09-04T14:38:04.052925Z",
"updated_at": "2022-09-04T14:38:04.052948Z",
"structure_string": "Nb2 N2\n1.0\n1.478615 -2.561036 -0.000000\n1.478615 2.561036 0.000000\n0.000000 0.000000 5.902984\nNb N\n2 2\ndirect\n0.000000 0.000000 0.500000 Nb\n0.000000 0.000000 0.000000 Nb\n0.333331 0.666666 0.250000 N\n0.666666 0.333331 0.750000 N\n",
"nsites": 4,
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},
{
"id": "jvasp-106145",
"created_at": "2022-09-04T14:36:10.843143Z",
"updated_at": "2022-09-04T14:36:10.843161Z",
"structure_string": "Ag1 Bi1 Te3 Pb1\n1.0\n5.787206 -0.008114 -5.101683\n-0.588802 4.238142 -6.419538\n0.004353 0.008114 7.714850\nAg Bi Te Pb\n1 1 3 1\ndirect\n0.002116 0.002116 0.000000 Ag\n0.327863 0.327863 0.000000 Bi\n0.492963 0.992962 0.500000 Te\n0.155562 0.655561 0.499999 Te\n0.847478 0.347478 0.500001 Te\n0.674022 0.674022 0.000001 Pb\n",
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],
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"volume": 189.60543825901254,
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"formula_full": "Ag1 Bi1 Te3 Pb1",
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"formula_anonymous": "ABCD3",
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"spacegroup": 44
},
{
"id": "jvasp-37457",
"created_at": "2022-09-04T14:38:07.484320Z",
"updated_at": "2022-09-04T14:38:07.484349Z",
"structure_string": "Y8 Au4\n1.0\n4.936040 -0.000000 0.000000\n0.000000 7.099355 0.000000\n0.000000 0.000000 8.944623\nY Au\n8 4\ndirect\n0.750000 0.850494 0.082021 Y\n0.250000 0.511964 0.175650 Y\n0.250000 0.011964 0.324350 Y\n0.750000 0.350494 0.417978 Y\n0.250000 0.649505 0.582021 Y\n0.750000 0.988035 0.675650 Y\n0.750000 0.488036 0.824349 Y\n0.250000 0.149505 0.917978 Y\n0.750000 0.258137 0.098288 Au\n0.750000 0.758136 0.401712 Au\n0.250000 0.241863 0.598288 Au\n0.250000 0.741863 0.901711 Au\n",
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"volume": 313.44374267582316,
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"formula_full": "Y8 Au4",
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{
"id": "jvasp-16530",
"created_at": "2022-09-04T14:37:56.230429Z",
"updated_at": "2022-09-04T14:37:56.230452Z",
"structure_string": "Tb2 Ga2\n1.0\n4.056274 0.000000 -0.000000\n0.000000 4.033225 -1.602190\n-0.000000 -0.011332 5.849030\nTb Ga\n2 2\ndirect\n0.749999 0.139414 0.278827 Tb\n0.250000 0.860585 0.721173 Tb\n0.749999 0.422981 0.845963 Ga\n0.250000 0.577018 0.154037 Ga\n",
"nsites": 4,
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"density": 7.941781937656251,
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"formula_full": "Tb2 Ga2",
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}
]
}