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=381",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=379",
"results": [
{
"id": "jvasp-106664",
"created_at": "2022-09-04T14:36:48.090680Z",
"updated_at": "2022-09-04T14:36:48.090699Z",
"structure_string": "Sr2 Mg1 Mo1 O6\n1.0\n4.853303 -0.000000 2.802056\n1.617768 4.575738 2.802056\n0.000000 -0.000000 5.604112\nSr Mg Mo O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750001 Sr\n0.500000 0.500000 0.500001 Mg\n0.000000 0.000000 0.000000 Mo\n0.757613 0.242386 0.242387 O\n0.242386 0.757614 0.757614 O\n0.242386 0.757614 0.242387 O\n0.757613 0.242386 0.757614 O\n0.242386 0.242386 0.757614 O\n0.757614 0.757614 0.242387 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Sr",
"Mg",
"Mo",
"O"
],
"chemical_system": "Mg-Mo-O-Sr",
"density": 5.223419050596086,
"density_atomic": 0.08035162023540778,
"volume": 124.45299759610069,
"volume_molar": 7.4947346952766,
"formula_full": "Sr2 Mg1 Mo1 O6",
"formula_reduced": "Sr2MgMoO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.918386857,
"spacegroup": 225
},
{
"id": "jvasp-106665",
"created_at": "2022-09-04T14:36:47.701087Z",
"updated_at": "2022-09-04T14:36:47.701104Z",
"structure_string": "Ba2 Sc1 U1 O6\n1.0\n5.233554 -0.000000 3.021594\n1.744518 4.934242 3.021594\n-0.000000 -0.000000 6.043188\nBa Sc U O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Sc\n0.000000 0.000000 0.000000 U\n0.747873 0.252126 0.252126 O\n0.252127 0.747873 0.747873 O\n0.252127 0.747873 0.252126 O\n0.747873 0.252126 0.747873 O\n0.252126 0.252126 0.747874 O\n0.747873 0.747873 0.252126 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Sc",
"U",
"O"
],
"chemical_system": "Ba-O-Sc-U",
"density": 6.955066451943509,
"density_atomic": 0.06407914961356218,
"volume": 156.05700232144665,
"volume_molar": 9.397972345633985,
"formula_full": "Ba2 Sc1 U1 O6",
"formula_reduced": "Ba2ScUO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.345377419,
"spacegroup": 225
},
{
"id": "jvasp-106666",
"created_at": "2022-09-04T14:36:48.642691Z",
"updated_at": "2022-09-04T14:36:48.642711Z",
"structure_string": "Rb2 Na1 V1 Cl6\n1.0\n6.203744 -0.000000 3.581733\n2.067915 5.848946 3.581733\n-0.000000 -0.000000 7.163466\nRb Na V Cl\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.749999 0.750001 0.750000 Rb\n0.499999 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 V\n0.764707 0.235293 0.235293 Cl\n0.235292 0.764708 0.764707 Cl\n0.235292 0.764708 0.235293 Cl\n0.764707 0.235293 0.764707 Cl\n0.235292 0.235293 0.764708 Cl\n0.764706 0.764708 0.235293 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Na",
"V",
"Cl"
],
"chemical_system": "Cl-Na-Rb-V",
"density": 2.923250744768558,
"density_atomic": 0.038472048902217,
"volume": 259.92896883180396,
"volume_molar": 15.653288379067762,
"formula_full": "Rb2 Na1 V1 Cl6",
"formula_reduced": "Rb2NaVCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.1048717605,
"spacegroup": 225
},
{
"id": "jvasp-106668",
"created_at": "2022-09-04T14:36:49.991186Z",
"updated_at": "2022-09-04T14:36:49.991207Z",
"structure_string": "Ho1 Ru3 C1\n1.0\n4.147293 -0.000000 0.000000\n0.000000 4.147293 0.000000\n0.000000 -0.000000 4.147293\nHo Ru C\n1 3 1\ndirect\n0.500000 0.500000 0.500000 Ho\n0.500000 0.000000 -0.000000 Ru\n-0.000000 0.500000 -0.000000 Ru\n0.000000 0.000000 0.500000 Ru\n0.000000 0.000000 0.000000 C\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ho",
"Ru",
"C"
],
"chemical_system": "C-Ho-Ru",
"density": 11.177194211268642,
"density_atomic": 0.07009319366371236,
"volume": 71.33360228938359,
"volume_molar": 8.591619878090526,
"formula_full": "Ho1 Ru3 C1",
"formula_reduced": "HoRu3C",
"formula_anonymous": "ABC3",
"energy_above_hull": 4.4062674133333335,
"spacegroup": 221
},
{
"id": "jvasp-106669",
"created_at": "2022-09-04T14:36:48.884550Z",
"updated_at": "2022-09-04T14:36:48.884583Z",
"structure_string": "K2 Co1 F6\n1.0\n4.913326 -0.000000 2.836710\n1.637775 4.632328 2.836710\n-0.000000 -0.000000 5.673420\nK Co F\n2 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750001 0.750000 0.749999 K\n0.000000 0.000000 0.000000 Co\n0.774400 0.225601 0.225600 F\n0.225602 0.774399 0.774398 F\n0.225602 0.774399 0.225600 F\n0.774400 0.225601 0.774399 F\n0.225601 0.225601 0.774399 F\n0.774400 0.774399 0.225600 F\n",
"nsites": 9,
"nelements": 3,
"elements": [
"K",
"Co",
"F"
],
"chemical_system": "Co-F-K",
"density": 3.229319030416138,
"density_atomic": 0.06969838109571819,
"volume": 129.12781987920377,
"volume_molar": 8.640287859383237,
"formula_full": "K2 Co1 F6",
"formula_reduced": "K2CoF6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.0260086146296296,
"spacegroup": 225
},
{
"id": "jvasp-10667",
"created_at": "2022-09-04T14:37:19.183901Z",
"updated_at": "2022-09-04T14:37:19.183924Z",
"structure_string": "Pr2 Zn6 P6\n1.0\n2.032517 -3.520423 0.000000\n2.032517 3.520423 0.000000\n0.000000 0.000000 20.210043\nPr Zn P\n2 6 6\ndirect\n0.000000 0.000000 0.500000 Pr\n0.000000 0.000000 0.000000 Pr\n0.333334 0.666668 0.750000 Zn\n0.666668 0.333334 0.250000 Zn\n0.666668 0.333334 0.629607 Zn\n0.333334 0.666668 0.129607 Zn\n0.333334 0.666668 0.370393 Zn\n0.666668 0.333334 0.870392 Zn\n0.666668 0.333334 0.750000 P\n0.333334 0.666668 0.250000 P\n0.666668 0.333334 0.088234 P\n0.333334 0.666668 0.588234 P\n0.333334 0.666668 0.911766 P\n0.666668 0.333334 0.411766 P\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Pr",
"Zn",
"P"
],
"chemical_system": "P-Pr-Zn",
"density": 4.938303415779964,
"density_atomic": 0.0484062864022067,
"volume": 289.2186333748953,
"volume_molar": 12.440823718560381,
"formula_full": "Pr2 Zn6 P6",
"formula_reduced": "Pr(ZnP)3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 0.8694025071428572,
"spacegroup": 194
},
{
"id": "jvasp-106671",
"created_at": "2022-09-04T14:36:44.483277Z",
"updated_at": "2022-09-04T14:36:44.483304Z",
"structure_string": "Ba2 Pu1 Zn1 O6\n1.0\n5.147008 -0.000000 2.971626\n1.715669 4.852645 2.971626\n-0.000000 -0.000000 5.943252\nBa Pu Zn O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750001 0.750000 Ba\n0.500000 0.500000 0.500000 Pu\n0.000000 0.000000 0.000000 Zn\n0.746977 0.253024 0.253024 O\n0.253023 0.746977 0.746977 O\n0.253023 0.746977 0.253024 O\n0.746977 0.253024 0.746977 O\n0.253024 0.253024 0.746976 O\n0.746977 0.746977 0.253024 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Pu",
"Zn",
"O"
],
"chemical_system": "Ba-O-Pu-Zn",
"density": 7.607438247669375,
"density_atomic": 0.0673662682499569,
"volume": 148.4422435705632,
"volume_molar": 8.939400855121367,
"formula_full": "Ba2 Pu1 Zn1 O6",
"formula_reduced": "Ba2PuZnO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.150557334,
"spacegroup": 225
},
{
"id": "jvasp-106673",
"created_at": "2022-09-04T14:36:51.131520Z",
"updated_at": "2022-09-04T14:36:51.131556Z",
"structure_string": "Ce4 Y2 Si4\n1.0\n7.551592 0.000000 0.000000\n0.000000 7.551592 0.000000\n0.000000 0.000000 4.337987\nCe Y Si\n4 2 4\ndirect\n0.677980 0.177980 0.500000 Ce\n0.322019 0.822019 0.500000 Ce\n0.177980 0.322019 0.500000 Ce\n0.822019 0.677980 0.500000 Ce\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 -0.000000 Y\n0.116317 0.616317 -0.000000 Si\n0.883683 0.383683 -0.000000 Si\n0.616317 0.883683 -0.000000 Si\n0.383683 0.116317 -0.000000 Si\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ce",
"Y",
"Si"
],
"chemical_system": "Ce-Si-Y",
"density": 5.709764962943778,
"density_atomic": 0.04042357492119708,
"volume": 247.38039669906232,
"volume_molar": 14.897595701863926,
"formula_full": "Ce4 Y2 Si4",
"formula_reduced": "Ce2YSi2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.7539907299999995,
"spacegroup": 127
},
{
"id": "jvasp-106674",
"created_at": "2022-09-04T14:36:51.785693Z",
"updated_at": "2022-09-04T14:36:51.785715Z",
"structure_string": "Tb4 C2 I2\n1.0\n3.775724 0.000000 0.000000\n-1.887862 3.269873 0.000000\n0.000000 0.000000 14.780136\nTb C I\n4 2 2\ndirect\n0.333333 0.666666 0.585928 Tb\n0.666666 0.333333 0.414072 Tb\n0.666666 0.333333 0.085928 Tb\n0.333333 0.666666 0.914072 Tb\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n0.333333 0.666666 0.250000 I\n0.666666 0.333333 0.750000 I\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Tb",
"C",
"I"
],
"chemical_system": "C-I-Tb",
"density": 8.313103405969262,
"density_atomic": 0.043840997910358684,
"volume": 182.47759816867153,
"volume_molar": 13.736322271480727,
"formula_full": "Tb4 C2 I2",
"formula_reduced": "Tb2CI",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.91926576875,
"spacegroup": 194
},
{
"id": "jvasp-106675",
"created_at": "2022-09-04T14:36:51.539697Z",
"updated_at": "2022-09-04T14:36:51.539727Z",
"structure_string": "Ta1 In1 Se2\n1.0\n3.487373 -0.000000 0.000000\n-1.743687 3.020154 0.000000\n0.000000 0.000000 8.754761\nTa In Se\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ta\n0.000000 0.000000 0.500000 In\n0.666666 0.333333 0.192165 Se\n0.666666 0.333333 0.807835 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"In",
"Se"
],
"chemical_system": "In-Se-Ta",
"density": 8.170197905435737,
"density_atomic": 0.04337986612287283,
"volume": 92.2086755332545,
"volume_molar": 13.882340583860667,
"formula_full": "Ta1 In1 Se2",
"formula_reduced": "TaInSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.080168975833333,
"spacegroup": 187
},
{
"id": "jvasp-106677",
"created_at": "2022-09-04T14:38:47.627530Z",
"updated_at": "2022-09-04T14:38:47.627553Z",
"structure_string": "Ba2 Tb1 W1 O6\n1.0\n5.190130 0.043709 2.998250\n1.687745 4.908246 2.998250\n-0.001685 -0.001213 5.994609\nTb Ba W O\n1 2 1 6\ndirect\n0.500000 0.500001 0.500000 Tb\n0.250000 0.250000 0.249973 Ba\n0.750000 0.750002 0.750027 Ba\n0.000000 0.000000 0.000000 W\n0.766242 0.766244 0.233386 O\n0.233757 0.233758 0.766613 O\n0.766053 0.233605 0.233922 O\n0.233947 0.766396 0.766077 O\n0.766396 0.233948 0.766077 O\n0.233604 0.766054 0.233923 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Tb",
"Ba",
"W",
"O"
],
"chemical_system": "Ba-O-Tb-W",
"density": 7.778205749298096,
"density_atomic": 0.06565799801686717,
"volume": 152.30436964330005,
"volume_molar": 9.171983523550239,
"formula_full": "Ba2 Tb1 W1 O6",
"formula_reduced": "Ba2TbWO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.4817761339999995,
"spacegroup": 225
},
{
"id": "jvasp-10668",
"created_at": "2022-09-04T14:37:15.828052Z",
"updated_at": "2022-09-04T14:37:15.828070Z",
"structure_string": "Pr2 Cd6 P6\n1.0\n2.159944 -3.741133 -0.000000\n2.159944 3.741133 0.000000\n-0.000000 0.000000 21.185603\nPr Cd P\n2 6 6\ndirect\n0.000000 0.000000 0.500000 Pr\n0.000000 0.000000 0.000000 Pr\n0.333332 0.666666 0.250000 Cd\n0.666666 0.333332 0.750000 Cd\n0.666666 0.333332 0.373694 Cd\n0.333332 0.666666 0.873694 Cd\n0.333332 0.666666 0.626305 Cd\n0.666666 0.333332 0.126306 Cd\n0.666666 0.333332 0.250000 P\n0.333332 0.666666 0.750000 P\n0.666666 0.333332 0.922096 P\n0.333332 0.666666 0.422096 P\n0.333332 0.666666 0.077904 P\n0.666666 0.333332 0.577904 P\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Pr",
"Cd",
"P"
],
"chemical_system": "Cd-P-Pr",
"density": 5.5391846360819335,
"density_atomic": 0.040889478422441644,
"volume": 342.38636784166675,
"volume_molar": 14.727849296054677,
"formula_full": "Pr2 Cd6 P6",
"formula_reduced": "Pr(CdP)3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 0.7296707999999996,
"spacegroup": 194
}
]
}