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=volume&page=143",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume&page=141",
"results": [
{
"id": "jvasp-79491",
"created_at": "2022-09-04T14:36:44.640076Z",
"updated_at": "2022-09-04T14:36:44.640099Z",
"structure_string": "H3 S1\n1.0\n-0.223393 -0.128975 -3.657102\n0.216869 -3.470636 1.082455\n-2.897225 1.923133 1.082454\nH S\n3 1\ndirect\n0.306444 0.646637 0.957852 H\n0.306443 0.957855 0.646634 H\n0.576223 0.436934 0.436932 H\n0.619686 0.958587 0.958583 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"H",
"S"
],
"chemical_system": "H-S",
"density": 1.5753317846546708,
"density_atomic": 0.10814692262858536,
"volume": 36.9867204981635,
"volume_molar": 5.568480927267948,
"formula_full": "H3 S1",
"formula_reduced": "H3S",
"formula_anonymous": "AB3",
"energy_above_hull": 2.4980225,
"spacegroup": 42
},
{
"id": "jvasp-68796",
"created_at": "2022-09-04T14:36:13.096350Z",
"updated_at": "2022-09-04T14:36:13.096374Z",
"structure_string": "Li1 Be1 Zn1\n1.0\n1.286661 -2.228562 0.000000\n1.286661 2.228562 -0.000000\n0.000000 -0.000000 6.453163\nLi Be Zn\n1 1 1\ndirect\n0.333333 0.666667 0.324378 Li\n0.000000 0.000000 0.997251 Be\n0.666667 0.333333 0.678370 Zn\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Be",
"Zn"
],
"chemical_system": "Be-Li-Zn",
"density": 3.6507340435051407,
"density_atomic": 0.0810643240673273,
"volume": 37.00764836462924,
"volume_molar": 7.428842254946036,
"formula_full": "Li1 Be1 Zn1",
"formula_reduced": "LiBeZn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.4259660166666666,
"spacegroup": 156
},
{
"id": "jvasp-49772",
"created_at": "2022-09-04T14:36:45.035046Z",
"updated_at": "2022-09-04T14:36:45.035067Z",
"structure_string": "Li1 Zn1 O2\n1.0\n1.493215 0.862108 4.793756\n-1.493215 0.862108 4.793756\n-0.000000 -1.724216 4.793756\nLi Zn O\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Zn\n0.253445 0.253445 0.253445 O\n0.746555 0.746555 0.746555 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Zn",
"O"
],
"chemical_system": "Li-O-Zn",
"density": 4.679779193169676,
"density_atomic": 0.10803109968385342,
"volume": 37.02637492079375,
"volume_molar": 5.574451040138845,
"formula_full": "Li1 Zn1 O2",
"formula_reduced": "LiZnO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6155143499999999,
"spacegroup": 166
},
{
"id": "jvasp-123758",
"created_at": "2022-09-04T14:38:55.192039Z",
"updated_at": "2022-09-04T14:38:55.192066Z",
"structure_string": "Hf1 Pd1\n1.0\n1.569719 -2.718832 -0.000000\n1.569719 2.718832 -0.000000\n0.000000 0.000000 4.338457\nHf Pd\n1 1\ndirect\n0.333334 0.666667 0.750001 Hf\n0.666667 0.333334 0.250000 Pd\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Hf",
"Pd"
],
"chemical_system": "Hf-Pd",
"density": 12.775773666304028,
"density_atomic": 0.054008288486169016,
"volume": 37.031353076707475,
"volume_molar": 11.150401038059575,
"formula_full": "Hf1 Pd1",
"formula_reduced": "HfPd",
"formula_anonymous": "AB",
"energy_above_hull": null,
"spacegroup": 187
},
{
"id": "jvasp-78664",
"created_at": "2022-09-04T14:36:43.162589Z",
"updated_at": "2022-09-04T14:36:43.162599Z",
"structure_string": "Yb1 Ir1\n1.0\n3.333316 0.000000 -0.000000\n0.000000 3.333316 0.000000\n-0.000000 0.000000 3.333316\nYb Ir\n1 1\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500001 0.500001 0.500001 Ir\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Yb",
"Ir"
],
"chemical_system": "Ir-Yb",
"density": 16.376390452288742,
"density_atomic": 0.05400084240876104,
"volume": 37.0364592622637,
"volume_molar": 11.151938546467889,
"formula_full": "Yb1 Ir1",
"formula_reduced": "YbIr",
"formula_anonymous": "AB",
"energy_above_hull": 1.0220208999999998,
"spacegroup": 221
},
{
"id": "jvasp-106680",
"created_at": "2022-09-04T14:36:52.601257Z",
"updated_at": "2022-09-04T14:36:52.601277Z",
"structure_string": "Zr1 Mo1\n1.0\n2.982181 0.010148 0.000000\n-1.122461 2.762895 0.000000\n-0.000000 0.000000 4.489101\nZr Mo\n1 1\ndirect\n0.500000 0.500000 0.500000 Zr\n0.000000 0.000000 0.000000 Mo\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Zr",
"Mo"
],
"chemical_system": "Mo-Zr",
"density": 8.390999175725506,
"density_atomic": 0.05399732659135911,
"volume": 37.03887074142757,
"volume_molar": 11.15266465981612,
"formula_full": "Zr1 Mo1",
"formula_reduced": "ZrMo",
"formula_anonymous": "AB",
"energy_above_hull": 3.4617102,
"spacegroup": 65
},
{
"id": "jvasp-118645",
"created_at": "2022-09-04T14:38:26.600013Z",
"updated_at": "2022-09-04T14:38:26.600039Z",
"structure_string": "Na1 Al1 O2\n1.0\n3.043256 0.000000 -0.000000\n0.000000 3.043256 0.000000\n0.000000 0.000000 3.999560\nNa Al O\n1 1 2\ndirect\n0.500001 0.500001 0.502502 Na\n0.000000 0.000000 0.002539 Al\n0.000000 0.000000 0.502457 O\n0.500001 0.500001 0.002502 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Al",
"O"
],
"chemical_system": "Al-Na-O",
"density": 3.6746452099332094,
"density_atomic": 0.10798683216238278,
"volume": 37.04155330702812,
"volume_molar": 5.57673619959917,
"formula_full": "Na1 Al1 O2",
"formula_reduced": "NaAlO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9023122,
"spacegroup": 123
},
{
"id": "jvasp-114670",
"created_at": "2022-09-04T14:38:42.560572Z",
"updated_at": "2022-09-04T14:38:42.560596Z",
"structure_string": "Mg1 H1 C2\n1.0\n2.990061 0.000000 0.000000\n0.000000 2.990061 -0.000000\n-0.000000 0.000000 4.144981\nMg H C\n1 1 2\ndirect\n0.500000 0.500000 0.407481 Mg\n0.000000 0.000000 -0.013023 H\n0.000000 0.000000 0.723709 C\n0.500000 0.500000 0.891834 C\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"H",
"C"
],
"chemical_system": "C-H-Mg",
"density": 2.2106285725455113,
"density_atomic": 0.10793874154633491,
"volume": 37.058056659692646,
"volume_molar": 5.579220837418113,
"formula_full": "Mg1 H1 C2",
"formula_reduced": "MgHC2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.8159822625,
"spacegroup": 99
},
{
"id": "jvasp-42464",
"created_at": "2022-09-04T14:37:13.053306Z",
"updated_at": "2022-09-04T14:37:13.053339Z",
"structure_string": "Ni2 Mo1\n1.0\n-1.835672 -1.309968 3.854358\n1.835672 1.309968 3.854358\n-1.835672 1.309968 -3.854358\nNi Mo\n2 1\ndirect\n0.669070 0.669070 0.000000 Ni\n0.330930 0.330930 -0.000000 Ni\n0.000000 0.000000 0.000000 Mo\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ni",
"Mo"
],
"chemical_system": "Mo-Ni",
"density": 9.554912279348677,
"density_atomic": 0.08091954697990379,
"volume": 37.07386054379474,
"volume_molar": 7.442133557044734,
"formula_full": "Ni2 Mo1",
"formula_reduced": "Ni2Mo",
"formula_anonymous": "AB2",
"energy_above_hull": 2.350083566666666,
"spacegroup": 71
},
{
"id": "jvasp-74562",
"created_at": "2022-09-04T14:35:47.609114Z",
"updated_at": "2022-09-04T14:35:47.609144Z",
"structure_string": "Be1 V1 Rh1\n1.0\n1.344765 -2.329200 0.000000\n1.344765 2.329200 -0.000000\n0.000000 -0.000000 5.918900\nBe V Rh\n1 1 1\ndirect\n0.000000 0.000000 0.990774 Be\n0.333335 0.666669 0.326304 V\n0.666669 0.333335 0.682923 Rh\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"V",
"Rh"
],
"chemical_system": "Be-Rh-V",
"density": 7.293519855644224,
"density_atomic": 0.08090904549991497,
"volume": 37.0786724953164,
"volume_molar": 7.443099498691193,
"formula_full": "Be1 V1 Rh1",
"formula_reduced": "BeVRh",
"formula_anonymous": "ABC",
"energy_above_hull": 2.6582677666666665,
"spacegroup": 156
},
{
"id": "jvasp-54457",
"created_at": "2022-09-04T14:37:48.573955Z",
"updated_at": "2022-09-04T14:37:48.573976Z",
"structure_string": "Zr1 Zn1\n1.0\n3.186993 -0.761881 0.619741\n0.609333 3.177628 0.807730\n-0.767602 -0.654042 3.177941\nZr Zn\n1 1\ndirect\n0.499999 0.499992 0.499998 Zr\n0.000000 0.000008 0.000002 Zn\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Zr",
"Zn"
],
"chemical_system": "Zn-Zr",
"density": 7.014571679935899,
"density_atomic": 0.05393849066580074,
"volume": 37.079272617987506,
"volume_molar": 11.164829949196722,
"formula_full": "Zr1 Zn1",
"formula_reduced": "ZrZn",
"formula_anonymous": "AB",
"energy_above_hull": 0.8848381666666669,
"spacegroup": 221
},
{
"id": "jvasp-74748",
"created_at": "2022-09-04T14:35:55.600504Z",
"updated_at": "2022-09-04T14:35:55.600530Z",
"structure_string": "Be1 V1 Ru1\n1.0\n1.366451 -2.366763 -0.000000\n1.366451 2.366763 0.000000\n-0.000000 0.000000 5.735706\nBe V Ru\n1 1 1\ndirect\n0.000000 0.000000 0.991522 Be\n0.666666 0.333333 0.327748 V\n0.333333 0.666666 0.680732 Ru\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"V",
"Ru"
],
"chemical_system": "Be-Ru-V",
"density": 7.207308943031631,
"density_atomic": 0.08086406005312174,
"volume": 37.09929971397949,
"volume_molar": 7.447240165833741,
"formula_full": "Be1 V1 Ru1",
"formula_reduced": "BeVRu",
"formula_anonymous": "ABC",
"energy_above_hull": 3.177400266666667,
"spacegroup": 156
}
]
}