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=3649",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=3647",
"results": [
{
"id": "jvasp-18391",
"created_at": "2022-09-04T14:38:11.984471Z",
"updated_at": "2022-09-04T14:38:11.984501Z",
"structure_string": "Er1 H2\n1.0\n3.131920 -0.000000 1.808215\n1.043974 2.952803 1.808215\n0.000000 0.000000 3.616430\nEr H\n1 2\ndirect\n0.000000 0.000000 0.000000 Er\n0.749999 0.749999 0.749999 H\n0.250000 0.250000 0.250000 H\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Er",
"H"
],
"chemical_system": "Er-H",
"density": 8.40458773685752,
"density_atomic": 0.0897007466174842,
"volume": 33.44453767807602,
"volume_molar": 6.7135904516832445,
"formula_full": "Er1 H2",
"formula_reduced": "ErH2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.677696666666667,
"spacegroup": 225
},
{
"id": "jvasp-29290",
"created_at": "2022-09-04T14:37:59.037808Z",
"updated_at": "2022-09-04T14:37:59.037841Z",
"structure_string": "Ta4 Se8\n1.0\n3.490965 0.000000 -0.000000\n-1.745483 3.023265 0.000000\n-0.000000 0.000000 25.374388\nTa Se\n4 8\ndirect\n0.000000 0.000000 0.000000 Ta\n0.000000 0.000000 0.500000 Ta\n0.000000 0.000000 0.250000 Ta\n0.000000 0.000000 0.750000 Ta\n0.333333 0.666666 0.065333 Se\n0.666668 0.333333 0.565333 Se\n0.666668 0.333333 0.934668 Se\n0.333333 0.666666 0.434668 Se\n0.333333 0.666666 0.684264 Se\n0.666668 0.333333 0.184264 Se\n0.666668 0.333333 0.315736 Se\n0.333333 0.666666 0.815736 Se\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ta",
"Se"
],
"chemical_system": "Se-Ta",
"density": 8.404699823917017,
"density_atomic": 0.04480886657301368,
"volume": 267.80414051416886,
"volume_molar": 13.439618585726198,
"formula_full": "Ta4 Se8",
"formula_reduced": "TaSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.5367719777777777,
"spacegroup": 194
},
{
"id": "jvasp-96960",
"created_at": "2022-09-04T14:36:40.177835Z",
"updated_at": "2022-09-04T14:36:40.177859Z",
"structure_string": "Dy5 Sn11\n1.0\n4.353211 0.000015 -0.440998\n-0.046245 4.422507 -0.456760\n0.002444 0.008962 21.736052\nDy Sn\n5 11\ndirect\n0.807311 0.307398 0.614626 Dy\n0.617255 0.617196 0.234535 Dy\n0.000000 0.000000 0.000000 Dy\n0.192687 0.692603 0.385374 Dy\n0.382743 0.382806 0.765465 Dy\n0.439675 0.939706 0.879374 Sn\n0.131679 0.131652 0.263422 Sn\n0.249370 0.249337 0.498737 Sn\n0.560323 0.060295 0.120626 Sn\n0.320294 0.820392 0.640575 Sn\n0.750628 0.750664 0.501263 Sn\n0.059913 0.559862 0.119850 Sn\n0.940085 0.440139 0.880150 Sn\n0.868319 0.868349 0.736578 Sn\n0.499999 0.500001 -0.000000 Sn\n0.679704 0.179609 0.359424 Sn\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Dy",
"Sn"
],
"chemical_system": "Dy-Sn",
"density": 8.40535493359928,
"density_atomic": 0.03823291628922143,
"volume": 418.48756393481546,
"volume_molar": 15.751193852030987,
"formula_full": "Dy5 Sn11",
"formula_reduced": "Dy5Sn11",
"formula_anonymous": "A5B11",
"energy_above_hull": 0.872043825,
"spacegroup": 71
},
{
"id": "jvasp-10171",
"created_at": "2022-09-04T14:37:07.190302Z",
"updated_at": "2022-09-04T14:37:07.190323Z",
"structure_string": "Zn2 Bi4 O8\n1.0\n3.539047 -0.023707 -0.017502\n-1.728201 6.123957 0.106970\n-1.735892 -2.270444 9.969307\nZn Bi O\n2 4 8\ndirect\n0.359609 0.733558 0.239036 Zn\n0.620831 0.233377 0.739083 Zn\n0.666182 0.289355 0.076544 Bi\n0.707507 0.789255 0.576458 Bi\n0.272942 0.177687 0.401659 Bi\n0.314265 0.677582 0.901568 Bi\n0.679013 0.554315 0.762860 O\n0.646210 0.054510 0.262928 O\n0.334232 0.912426 0.715186 O\n0.301435 0.412623 0.215255 O\n0.107052 0.318439 0.904388 O\n0.123703 0.818520 0.404365 O\n0.873406 0.648498 0.073726 O\n0.856743 0.148416 0.573750 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Zn",
"Bi",
"O"
],
"chemical_system": "Bi-O-Zn",
"density": 8.405649183518793,
"density_atomic": 0.06473531636315154,
"volume": 216.26525962216573,
"volume_molar": 9.302713106733046,
"formula_full": "Zn2 Bi4 O8",
"formula_reduced": "Zn(BiO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.4128589999999996,
"spacegroup": 15
},
{
"id": "jvasp-113023",
"created_at": "2022-09-04T14:38:44.243137Z",
"updated_at": "2022-09-04T14:38:44.243155Z",
"structure_string": "Ho16 Mg4 Rh4\n1.0\n8.297116 -0.000000 4.790342\n2.765705 7.822596 4.790342\n-0.000000 -0.000000 9.580684\nHo Mg Rh\n16 4 4\ndirect\n0.812444 0.187557 0.187556 Ho\n0.958568 0.347144 0.347143 Ho\n0.347145 0.958568 0.347143 Ho\n0.347145 0.347144 0.958566 Ho\n0.347145 0.347144 0.347144 Ho\n0.565310 0.565310 0.934689 Ho\n0.934691 0.565310 0.934689 Ho\n0.565311 0.934691 0.565309 Ho\n0.934691 0.934691 0.565309 Ho\n0.934691 0.565310 0.565309 Ho\n0.812444 0.812444 0.187555 Ho\n0.187557 0.187557 0.812443 Ho\n0.812444 0.187557 0.812443 Ho\n0.187557 0.812444 0.187556 Ho\n0.187557 0.812444 0.812443 Ho\n0.565311 0.934691 0.934689 Ho\n0.579889 0.579889 0.579888 Mg\n0.579889 0.579889 0.260334 Mg\n0.579889 0.260335 0.579888 Mg\n0.260335 0.579889 0.579888 Mg\n0.141836 0.574494 0.141835 Rh\n0.141835 0.141835 0.141835 Rh\n0.141835 0.141835 0.574494 Rh\n0.574494 0.141835 0.141835 Rh\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Ho",
"Mg",
"Rh"
],
"chemical_system": "Ho-Mg-Rh",
"density": 8.40565563556436,
"density_atomic": 0.038595499168898005,
"volume": 621.8341650401632,
"volume_molar": 15.603220296870557,
"formula_full": "Ho16 Mg4 Rh4",
"formula_reduced": "Ho4MgRh",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.3422623861111114,
"spacegroup": 216
},
{
"id": "jvasp-111339",
"created_at": "2022-09-04T14:38:49.492237Z",
"updated_at": "2022-09-04T14:38:49.492256Z",
"structure_string": "Tb2 In3 Cu1\n1.0\n4.705418 0.000000 0.000000\n-2.352710 4.075011 0.000000\n0.000000 -0.000000 7.477942\nTb In Cu\n2 3 1\ndirect\n0.000000 0.000000 0.723177 Tb\n0.000000 0.000000 0.263032 Tb\n0.333333 0.666667 0.482067 In\n0.333333 0.666667 0.052903 In\n0.666667 0.333333 0.933621 In\n0.666667 0.333333 0.545199 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tb",
"In",
"Cu"
],
"chemical_system": "Cu-In-Tb",
"density": 8.405959827935403,
"density_atomic": 0.041844864232459554,
"volume": 143.38677183102746,
"volume_molar": 14.391588718140838,
"formula_full": "Tb2 In3 Cu1",
"formula_reduced": "Tb2In3Cu",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.1520982695833335,
"spacegroup": 156
},
{
"id": "jvasp-36171",
"created_at": "2022-09-04T14:37:30.652536Z",
"updated_at": "2022-09-04T14:37:30.652557Z",
"structure_string": "Cr1 Co2 As1\n1.0\n2.891584 2.891584 0.000000\n2.891584 -0.000000 -2.891584\n0.000000 2.891584 -2.891584\nCr Co As\n1 2 1\ndirect\n0.749999 0.749999 0.749999 Cr\n0.000000 0.000000 0.000000 Co\n0.499999 0.499999 0.499999 Co\n0.250000 0.250000 0.250000 As\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cr",
"Co",
"As"
],
"chemical_system": "As-Co-Cr",
"density": 8.406105761101202,
"density_atomic": 0.08272229155790724,
"volume": 48.35455987337973,
"volume_molar": 7.279949148633514,
"formula_full": "Cr1 Co2 As1",
"formula_reduced": "CrCo2As",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.4347752375,
"spacegroup": 225
},
{
"id": "jvasp-85362",
"created_at": "2022-09-04T14:35:52.677953Z",
"updated_at": "2022-09-04T14:35:52.677980Z",
"structure_string": "Fe13 Ge3\n1.0\n5.712608 0.000155 -0.000007\n-0.000057 5.713287 -0.000051\n-0.000037 0.000121 5.712959\nFe Ge\n13 3\ndirect\n0.252811 0.252865 0.747200 Fe\n0.252855 0.252807 0.252792 Fe\n0.252781 0.747146 0.747177 Fe\n0.747165 0.747214 0.252846 Fe\n0.747144 0.252782 0.252818 Fe\n0.499981 -0.000001 0.500047 Fe\n0.500001 0.499995 0.500001 Fe\n0.747197 0.252832 0.747186 Fe\n0.252831 0.747193 0.252825 Fe\n-0.000001 0.499978 0.499951 Fe\n0.747213 0.747161 0.747153 Fe\n0.500013 0.500026 0.000003 Fe\n0.000013 -0.000007 -0.000002 Fe\n0.500002 0.999974 0.999943 Ge\n0.000011 0.000033 0.500003 Ge\n-0.000025 0.499999 0.000056 Ge\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Fe",
"Ge"
],
"chemical_system": "Fe-Ge",
"density": 8.406124386066116,
"density_atomic": 0.085810100493508,
"volume": 186.45823636123683,
"volume_molar": 7.01798590767949,
"formula_full": "Fe13 Ge3",
"formula_reduced": "Fe13Ge3",
"formula_anonymous": "A3B13",
"energy_above_hull": 3.665659959375,
"spacegroup": 221
},
{
"id": "jvasp-123456",
"created_at": "2022-09-04T14:38:54.725386Z",
"updated_at": "2022-09-04T14:38:54.725414Z",
"structure_string": "Yb1 Zr1\n1.0\n1.637957 -2.837022 -0.000000\n1.637957 2.837022 -0.000000\n-0.000000 0.000000 5.616762\nYb Zr\n1 1\ndirect\n0.666668 0.333334 0.250000 Yb\n0.333334 0.666668 0.750000 Zr\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Yb",
"Zr"
],
"chemical_system": "Yb-Zr",
"density": 8.406319346620517,
"density_atomic": 0.0383132310086539,
"volume": 52.20128784096166,
"volume_molar": 15.718175161577381,
"formula_full": "Yb1 Zr1",
"formula_reduced": "YbZr",
"formula_anonymous": "AB",
"energy_above_hull": 1.3002826,
"spacegroup": 187
},
{
"id": "jvasp-25896",
"created_at": "2022-09-04T14:38:19.552764Z",
"updated_at": "2022-09-04T14:38:19.552778Z",
"structure_string": "Ba2 Nd4 Pt2 O10\n1.0\n6.807319 0.000000 -0.000000\n0.000000 6.807319 0.000000\n0.000000 0.000000 5.975401\nBa Nd Pt O\n2 4 2 10\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.000000 Ba\n0.173371 0.326629 0.500000 Nd\n0.673371 0.173371 0.500000 Nd\n0.326629 0.826629 0.500000 Nd\n0.826629 0.673371 0.500000 Nd\n0.500000 0.000000 0.000000 Pt\n0.000000 0.500000 0.000000 Pt\n0.139883 0.639918 0.746784 O\n0.860118 0.360082 0.746784 O\n0.500000 0.500000 0.500000 O\n0.360082 0.139883 0.253216 O\n0.000000 0.000000 0.500000 O\n0.860082 0.360118 0.253216 O\n0.139918 0.639883 0.253216 O\n0.360118 0.139918 0.746784 O\n0.639883 0.860082 0.746784 O\n0.639918 0.860118 0.253216 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Ba",
"Nd",
"Pt",
"O"
],
"chemical_system": "Ba-Nd-O-Pt",
"density": 8.406417114152573,
"density_atomic": 0.06500597017739554,
"volume": 276.897644183751,
"volume_molar": 9.26398105214969,
"formula_full": "Ba2 Nd4 Pt2 O10",
"formula_reduced": "BaNd2PtO5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 2.012345318888889,
"spacegroup": 127
},
{
"id": "jvasp-106711",
"created_at": "2022-09-04T14:37:00.815797Z",
"updated_at": "2022-09-04T14:37:00.815815Z",
"structure_string": "Ti1 Co1 Ni1 Sn1\n1.0\n3.722021 -0.000000 2.148910\n1.240674 3.509155 2.148910\n-0.000000 -0.000000 4.297820\nTi Co Ni Sn\n1 1 1 1\ndirect\n0.499999 0.500001 0.500000 Ti\n0.250000 0.250000 0.250000 Co\n0.749999 0.750001 0.750000 Ni\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 4,
"nelements": 4,
"elements": [
"Ti",
"Co",
"Ni",
"Sn"
],
"chemical_system": "Co-Ni-Sn-Ti",
"density": 8.407155329627024,
"density_atomic": 0.07125746991862571,
"volume": 56.13446568574358,
"volume_molar": 8.451241346173443,
"formula_full": "Ti1 Co1 Ni1 Sn1",
"formula_reduced": "TiCoNiSn",
"formula_anonymous": "ABCD",
"energy_above_hull": 2.0449083333333333,
"spacegroup": 216
},
{
"id": "jvasp-49224",
"created_at": "2022-09-04T14:38:35.134056Z",
"updated_at": "2022-09-04T14:38:35.134082Z",
"structure_string": "Lu4 Sn4 O14\n1.0\n6.331065 -0.000000 3.655242\n2.110355 5.968986 3.655242\n0.000000 0.000000 7.310485\nLu Sn O\n4 4 14\ndirect\n0.500001 0.500000 0.499999 Lu\n0.000000 0.500000 0.499999 Lu\n0.500000 0.000000 0.499999 Lu\n0.500001 0.500000 -0.000001 Lu\n0.000000 0.000000 0.000000 Sn\n0.000000 0.000000 0.500000 Sn\n0.500000 0.000000 -0.000000 Sn\n0.000000 0.500000 -0.000000 Sn\n0.093035 0.656965 0.093034 O\n0.656965 0.093035 0.656964 O\n0.656965 0.093035 0.093034 O\n0.625001 0.625000 0.624999 O\n0.906966 0.343035 0.343034 O\n0.343036 0.906966 0.343034 O\n0.343035 0.343035 0.906964 O\n0.906966 0.906966 0.343033 O\n0.906966 0.343035 0.906963 O\n0.093035 0.656965 0.656964 O\n0.343036 0.906966 0.906963 O\n0.375000 0.375000 0.374999 O\n0.656966 0.656965 0.093034 O\n0.093035 0.093035 0.656964 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Lu",
"Sn",
"O"
],
"chemical_system": "Lu-O-Sn",
"density": 8.407173791368008,
"density_atomic": 0.0796341149753487,
"volume": 276.2635085077577,
"volume_molar": 7.562262432205339,
"formula_full": "Lu4 Sn4 O14",
"formula_reduced": "Lu2Sn2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 1.9885308545454543,
"spacegroup": 227
}
]
}