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=chemical_system&page=3584",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=3582",
"results": [
{
"id": "jvasp-28370",
"created_at": "2022-09-04T14:36:06.872051Z",
"updated_at": "2022-09-04T14:36:06.872080Z",
"structure_string": "V1 I2\n1.0\n3.830117 -0.000007 -0.000239\n-1.915065 3.316981 -0.000002\n-0.000230 -0.000136 6.855189\nV I\n1 2\ndirect\n0.000000 0.000000 0.000000 V\n0.666610 0.333303 0.755984 I\n0.333391 0.666694 0.244016 I\n",
"nsites": 3,
"nelements": 2,
"elements": [
"V",
"I"
],
"chemical_system": "I-V",
"density": 5.810579409128563,
"density_atomic": 0.03444667096561603,
"volume": 87.09114454034004,
"volume_molar": 17.482504379047775,
"formula_full": "V1 I2",
"formula_reduced": "VI2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.0523655833333334,
"spacegroup": 164
},
{
"id": "jvasp-33827",
"created_at": "2022-09-04T14:38:05.073768Z",
"updated_at": "2022-09-04T14:38:05.073812Z",
"structure_string": "V2 I6\n1.0\n10.070668 -0.000013 0.000007\n-5.035343 8.721467 -0.000010\n0.000003 -0.000002 3.671448\nV I\n2 6\ndirect\n0.333333 0.666667 0.750002 V\n0.666668 0.333334 0.250002 V\n0.213032 0.426064 0.250001 I\n0.573937 0.786969 0.250001 I\n0.213033 0.786970 0.250001 I\n0.786978 0.573956 0.750000 I\n0.426045 0.213023 0.750001 I\n0.786978 0.213022 0.750001 I\n",
"nsites": 8,
"nelements": 2,
"elements": [
"V",
"I"
],
"chemical_system": "I-V",
"density": 4.445605283376915,
"density_atomic": 0.02480876289733141,
"volume": 322.46670392664083,
"volume_molar": 24.27424851824345,
"formula_full": "V2 I6",
"formula_reduced": "VI3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.76612825625,
"spacegroup": 194
},
{
"id": "jvasp-122903",
"created_at": "2022-09-04T14:38:52.870535Z",
"updated_at": "2022-09-04T14:38:52.870562Z",
"structure_string": "V1 I1\n1.0\n3.371855 0.000000 0.000000\n0.000000 3.371855 0.000000\n-0.000000 0.000000 3.371855\nV I\n1 1\ndirect\n0.500001 0.500001 0.500001 V\n0.000000 0.000000 0.000000 I\n",
"nsites": 2,
"nelements": 2,
"elements": [
"V",
"I"
],
"chemical_system": "I-V",
"density": 7.703471050570629,
"density_atomic": 0.05217029885260068,
"volume": 38.33598894364586,
"volume_molar": 11.543236079621954,
"formula_full": "V1 I1",
"formula_reduced": "VI",
"formula_anonymous": "AB",
"energy_above_hull": null,
"spacegroup": 221
},
{
"id": "jvasp-79584",
"created_at": "2022-09-04T14:36:48.849858Z",
"updated_at": "2022-09-04T14:36:48.849867Z",
"structure_string": "Y2 I2\n1.0\n-1.968753 -3.409963 0.000014\n-1.968738 3.409953 0.000000\n-0.000001 0.000000 -10.564155\nY I\n2 2\ndirect\n0.666662 0.333331 0.368215 Y\n0.333337 0.666668 0.631785 Y\n0.333333 0.666667 0.166736 I\n0.666667 0.333333 0.833264 I\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Y",
"I"
],
"chemical_system": "I-Y",
"density": 5.052984117549788,
"density_atomic": 0.028200487932592933,
"volume": 141.8415174078236,
"volume_molar": 21.3547395860476,
"formula_full": "Y2 I2",
"formula_reduced": "YI",
"formula_anonymous": "AB",
"energy_above_hull": 0.4146208624999998,
"spacegroup": 164
},
{
"id": "jvasp-12033",
"created_at": "2022-09-04T14:37:28.300113Z",
"updated_at": "2022-09-04T14:37:28.300142Z",
"structure_string": "Y2 I6\n1.0\n6.648103 -0.013220 4.740498\n2.434838 6.186194 4.740498\n-0.019452 -0.013221 8.165121\nY I\n2 6\ndirect\n0.166366 0.166366 0.166366 Y\n0.833634 0.833634 0.833634 Y\n0.244137 0.583644 0.925421 I\n0.074579 0.755863 0.416356 I\n0.416356 0.074579 0.755863 I\n0.755863 0.416356 0.074579 I\n0.583644 0.925421 0.244137 I\n0.925422 0.244137 0.583644 I\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Y",
"I"
],
"chemical_system": "I-Y",
"density": 4.6293781422044225,
"density_atomic": 0.02374584621018877,
"volume": 336.9010280445341,
"volume_molar": 25.360817663411147,
"formula_full": "Y2 I6",
"formula_reduced": "YI3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1180585687499999,
"spacegroup": 148
},
{
"id": "jvasp-29624",
"created_at": "2022-09-04T14:38:02.623607Z",
"updated_at": "2022-09-04T14:38:02.623633Z",
"structure_string": "Yb1 I2\n1.0\n4.433452 0.000000 -0.000000\n-2.216726 3.839482 0.000000\n0.000000 -0.000000 6.939221\nYb I\n1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.666666 0.333333 0.745712 I\n0.333332 0.666667 0.254288 I\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Yb",
"I"
],
"chemical_system": "I-Yb",
"density": 6.000645060589942,
"density_atomic": 0.025397787717237465,
"volume": 118.12052425195685,
"volume_molar": 23.71128078967593,
"formula_full": "Yb1 I2",
"formula_reduced": "YbI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 164
},
{
"id": "jvasp-54925",
"created_at": "2022-09-04T14:38:33.195829Z",
"updated_at": "2022-09-04T14:38:33.195853Z",
"structure_string": "Zn2 I4\n1.0\n5.590322 -0.000000 0.000000\n-2.795162 4.841361 -0.000000\n0.000000 0.000000 8.194260\nZn I\n2 4\ndirect\n0.000000 0.000000 0.000000 Zn\n0.000000 0.000000 0.500000 Zn\n0.333333 0.666667 0.250000 I\n0.666667 0.333333 0.750000 I\n0.333333 0.666667 0.750000 I\n0.666667 0.333333 0.250000 I\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Zn",
"I"
],
"chemical_system": "I-Zn",
"density": 4.780269181593755,
"density_atomic": 0.027054357181989133,
"volume": 221.77573688553107,
"volume_molar": 22.259411744623204,
"formula_full": "Zn2 I4",
"formula_reduced": "ZnI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.3001133333333333,
"spacegroup": 191
},
{
"id": "jvasp-29649",
"created_at": "2022-09-04T14:38:13.343116Z",
"updated_at": "2022-09-04T14:38:13.343143Z",
"structure_string": "Zn1 I2\n1.0\n3.893923 -0.013005 6.053153\n1.769095 3.468878 6.053153\n-0.021310 -0.013005 7.197419\nZn I\n1 2\ndirect\n0.000000 0.000000 0.000000 Zn\n0.746925 0.746930 0.746927 I\n0.253072 0.253074 0.253072 I\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Zn",
"I"
],
"chemical_system": "I-Zn",
"density": 5.408836868658385,
"density_atomic": 0.030611791726550413,
"volume": 98.0014507742133,
"volume_molar": 19.67261770821745,
"formula_full": "Zn1 I2",
"formula_reduced": "ZnI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 166
},
{
"id": "jvasp-14322",
"created_at": "2022-09-04T14:37:13.465351Z",
"updated_at": "2022-09-04T14:37:13.465368Z",
"structure_string": "Zr2 I6\n1.0\n3.664276 -6.346713 0.000000\n3.664276 6.346713 0.000000\n0.000000 -0.000000 6.554641\nZr I\n2 6\ndirect\n0.000000 0.000000 0.000000 Zr\n0.000000 0.000000 0.500000 Zr\n0.330089 0.000000 0.750000 I\n0.000001 0.669912 0.250000 I\n0.330089 0.330089 0.250000 I\n0.669912 0.669912 0.750000 I\n0.000000 0.330089 0.750000 I\n0.669912 0.000001 0.250000 I\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Zr",
"I"
],
"chemical_system": "I-Zr",
"density": 5.140999410932522,
"density_atomic": 0.026240617043189505,
"volume": 304.87087963033713,
"volume_molar": 22.949691884486334,
"formula_full": "Zr2 I6",
"formula_reduced": "ZrI3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.5903433312500002,
"spacegroup": 193
},
{
"id": "jvasp-86898",
"created_at": "2022-09-04T14:35:44.813707Z",
"updated_at": "2022-09-04T14:35:44.813726Z",
"structure_string": "Zr4 I12\n1.0\n6.554816 -0.000000 0.000000\n0.000000 7.329835 0.000000\n0.000000 0.000000 12.696272\nZr I\n4 12\ndirect\n0.500064 0.249828 0.750000 Zr\n-0.000064 0.249828 0.750000 Zr\n0.499936 0.750171 0.250000 Zr\n0.000064 0.750171 0.250000 Zr\n0.250000 0.414876 0.914993 I\n0.250000 0.919804 0.750000 I\n0.250000 0.915157 0.084963 I\n0.250000 0.915157 0.415036 I\n0.750000 0.084842 0.584963 I\n0.750000 0.585124 0.414993 I\n0.750000 0.579896 0.750000 I\n0.750000 0.084842 0.915036 I\n0.750000 0.585124 0.085007 I\n0.750000 0.080195 0.250000 I\n0.250000 0.420103 0.250000 I\n0.250000 0.414876 0.585007 I\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Zr",
"I"
],
"chemical_system": "I-Zr",
"density": 5.138810134998581,
"density_atomic": 0.026229442571692338,
"volume": 610.0015261958986,
"volume_molar": 22.959469091040802,
"formula_full": "Zr4 I12",
"formula_reduced": "ZrI3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.5903983312500002,
"spacegroup": 193
},
{
"id": "jvasp-86295",
"created_at": "2022-09-04T14:35:43.487603Z",
"updated_at": "2022-09-04T14:35:43.487631Z",
"structure_string": "Zr4 I12\n1.0\n6.554240 -0.000000 0.000000\n0.000000 7.329765 0.000000\n0.000000 0.000000 12.694960\nZr I\n4 12\ndirect\n0.499875 0.249792 0.750000 Zr\n0.000125 0.249792 0.750000 Zr\n0.500125 0.750207 0.250000 Zr\n-0.000125 0.750207 0.250000 Zr\n0.250000 0.414871 0.915038 I\n0.250000 0.919696 0.750000 I\n0.250000 0.915155 0.084967 I\n0.250000 0.915155 0.415033 I\n0.750000 0.084844 0.584967 I\n0.750000 0.585128 0.415038 I\n0.750000 0.579823 0.750000 I\n0.750000 0.084844 0.915033 I\n0.750000 0.585128 0.084962 I\n0.750000 0.080303 0.250000 I\n0.250000 0.420176 0.250000 I\n0.250000 0.414871 0.584962 I\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Zr",
"I"
],
"chemical_system": "I-Zr",
"density": 5.139841962612958,
"density_atomic": 0.02623470921172071,
"volume": 609.8790678743939,
"volume_molar": 22.954859958232465,
"formula_full": "Zr4 I12",
"formula_reduced": "ZrI3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.5904258312500001,
"spacegroup": 193
},
{
"id": "jvasp-29630",
"created_at": "2022-09-04T14:37:06.794111Z",
"updated_at": "2022-09-04T14:37:06.794130Z",
"structure_string": "Zr4 I8\n1.0\n3.773592 0.000000 0.000000\n0.000000 6.882684 0.000000\n0.000000 0.000000 14.989308\nZr I\n4 8\ndirect\n0.000000 0.491478 0.007146 Zr\n0.000000 0.884449 0.500236 Zr\n0.500000 0.115550 0.000236 Zr\n0.500000 0.508521 0.507146 Zr\n0.000000 0.883102 0.113529 I\n0.500000 0.778602 0.356614 I\n0.000000 0.221397 0.856614 I\n0.500000 0.724924 0.894102 I\n0.500000 0.116898 0.613529 I\n0.500000 0.384150 0.150674 I\n0.000000 0.275076 0.394102 I\n0.000000 0.615850 0.650674 I\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Zr",
"I"
],
"chemical_system": "I-Zr",
"density": 5.886745912518347,
"density_atomic": 0.03082385048435477,
"volume": 389.3089218717443,
"volume_molar": 19.537276055295724,
"formula_full": "Zr4 I8",
"formula_reduced": "ZrI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.777069016666667,
"spacegroup": 31
}
]
}