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=-nelements&page=602",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=600",
"results": [
{
"id": "jvasp-8371",
"created_at": "2022-09-04T14:36:42.934432Z",
"updated_at": "2022-09-04T14:36:42.934468Z",
"structure_string": "Zn1 Cu2 Ge1 S4\n1.0\n4.859781 -0.000000 -2.201939\n-0.997687 4.756269 -2.201939\n0.044466 0.054762 6.561988\nZn Cu Ge S\n1 2 1 4\ndirect\n0.000000 0.000000 0.000000 Zn\n0.750000 0.250000 0.500000 Cu\n0.250000 0.750000 0.500000 Cu\n0.500000 0.500000 -0.000000 Ge\n0.870639 0.870640 0.254843 S\n0.615797 0.129360 0.745157 S\n0.384204 0.384203 0.254843 S\n0.129360 0.615797 0.745157 S\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Zn",
"Cu",
"Ge",
"S"
],
"chemical_system": "Cu-Ge-S-Zn",
"density": 4.273887950479288,
"density_atomic": 0.05233937857636086,
"volume": 152.84858585640924,
"volume_molar": 11.505946237428022,
"formula_full": "Zn1 Cu2 Ge1 S4",
"formula_reduced": "ZnCu2GeS4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.8033296562499999,
"spacegroup": 121
},
{
"id": "jvasp-29908",
"created_at": "2022-09-04T14:36:49.299623Z",
"updated_at": "2022-09-04T14:36:49.299646Z",
"structure_string": "Zr1 P2 H2 O6\n1.0\n5.461459 -0.000009 -0.000029\n-2.730737 4.729764 0.000084\n-0.000018 0.000066 5.390100\nZr P H O\n1 2 2 6\ndirect\n0.000000 0.000000 0.000000 Zr\n0.666669 0.333347 0.695685 P\n0.333330 0.666652 0.304314 P\n0.666664 0.333353 0.435592 H\n0.333336 0.666647 0.564407 H\n0.359966 0.141533 0.779696 O\n0.781572 0.640053 0.779682 O\n0.858479 0.218448 0.779678 O\n0.640033 0.858467 0.220303 O\n0.218427 0.359947 0.220317 O\n0.141521 0.781552 0.220321 O\n",
"nsites": 11,
"nelements": 4,
"elements": [
"Zr",
"P",
"H",
"O"
],
"chemical_system": "H-O-P-Zr",
"density": 2.9956851901451165,
"density_atomic": 0.07900382654977711,
"volume": 139.23376221618005,
"volume_molar": 7.622593769183689,
"formula_full": "Zr1 P2 H2 O6",
"formula_reduced": "ZrP2(HO3)2",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 3.0830069545454544,
"spacegroup": 147
},
{
"id": "jvasp-47889",
"created_at": "2022-09-04T14:36:49.241159Z",
"updated_at": "2022-09-04T14:36:49.241183Z",
"structure_string": "Li4 Cr2 Si2 O8\n1.0\n0.000000 4.830007 0.034648\n5.620423 0.000000 0.000000\n0.000000 -4.719458 -6.265924\nLi Cr Si O\n4 2 2 8\ndirect\n0.505928 0.815234 0.001693 Li\n0.250125 0.346590 0.744779 Li\n0.505927 0.184765 0.501693 Li\n0.250126 0.653409 0.244779 Li\n0.010391 0.152653 -0.011103 Cr\n0.010390 0.847347 0.488896 Cr\n0.739082 0.666155 0.746533 Si\n0.739082 0.333844 0.246533 Si\n0.064956 0.801813 0.966832 O\n0.847496 0.389441 0.743225 O\n0.399749 0.663396 0.749125 O\n0.619271 0.821851 0.528912 O\n0.064956 0.198187 0.466832 O\n0.847496 0.610559 0.243226 O\n0.399749 0.336603 0.249126 O\n0.619272 0.178148 0.028913 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Cr",
"Si",
"O"
],
"chemical_system": "Cr-Li-O-Si",
"density": 3.100848158355476,
"density_atomic": 0.0945738274536111,
"volume": 169.17999864019538,
"volume_molar": 6.367661034924157,
"formula_full": "Li4 Cr2 Si2 O8",
"formula_reduced": "Li2CrSiO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.4717725,
"spacegroup": 7
},
{
"id": "jvasp-106318",
"created_at": "2022-09-04T14:36:39.615830Z",
"updated_at": "2022-09-04T14:36:39.615855Z",
"structure_string": "Yb2 Ti1 Cu1 O6\n1.0\n3.492508 -0.000000 0.000000\n-1.746254 3.024601 -0.000000\n-0.000000 0.000000 11.617897\nYb Ti Cu O\n2 1 1 6\ndirect\n0.666668 0.333333 0.742232 Yb\n0.666668 0.333333 0.257769 Yb\n0.000000 0.000000 0.000000 Ti\n0.333334 0.666667 0.500000 Cu\n0.000000 0.000000 0.841108 O\n0.333334 0.666667 0.346011 O\n0.666668 0.333333 0.000000 O\n0.666668 0.333333 0.500000 O\n0.333334 0.666667 0.653989 O\n0.000000 0.000000 0.158892 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Yb",
"Ti",
"Cu",
"O"
],
"chemical_system": "Cu-O-Ti-Yb",
"density": 7.489026763519792,
"density_atomic": 0.08148299378616648,
"volume": 122.72499493873184,
"volume_molar": 7.390671942913307,
"formula_full": "Yb2 Ti1 Cu1 O6",
"formula_reduced": "Yb2TiCuO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.7011771183333333,
"spacegroup": 187
},
{
"id": "jvasp-101382",
"created_at": "2022-09-04T14:36:42.923685Z",
"updated_at": "2022-09-04T14:36:42.923711Z",
"structure_string": "Rb2 Li1 Ce1 Cl6\n1.0\n6.420403 0.000000 3.706822\n2.140134 6.053215 3.706822\n0.000000 0.000000 7.413644\nRb Li Ce Cl\n2 1 1 6\ndirect\n0.749999 0.749999 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Ce\n0.740208 0.259792 0.259792 Cl\n0.259791 0.259792 0.740208 Cl\n0.259791 0.740208 0.740208 Cl\n0.259791 0.740208 0.259792 Cl\n0.740208 0.259792 0.740208 Cl\n0.740208 0.740208 0.259792 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Li",
"Ce",
"Cl"
],
"chemical_system": "Ce-Cl-Li-Rb",
"density": 3.058628587050398,
"density_atomic": 0.03470722440844933,
"volume": 288.1244516218226,
"volume_molar": 17.35126004064426,
"formula_full": "Rb2 Li1 Ce1 Cl6",
"formula_reduced": "Rb2LiCeCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-107519",
"created_at": "2022-09-04T14:36:57.233289Z",
"updated_at": "2022-09-04T14:36:57.233317Z",
"structure_string": "Tb3 Mn3 Ga2 Ge1\n1.0\n6.946356 0.000000 0.000000\n-3.473178 6.015720 0.000000\n-0.000000 -0.000000 4.155404\nTb Mn Ga Ge\n3 3 2 1\ndirect\n0.246067 0.331842 0.500000 Tb\n0.085775 0.753933 0.500000 Tb\n0.668158 0.914225 0.500000 Tb\n0.888100 0.328250 -0.000000 Mn\n0.440151 0.111900 -0.000000 Mn\n0.671750 0.559849 -0.000000 Mn\n0.333333 0.666667 -0.000000 Ga\n0.666667 0.333333 0.500000 Ga\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Tb",
"Mn",
"Ga",
"Ge"
],
"chemical_system": "Ga-Ge-Mn-Tb",
"density": 8.163649663015942,
"density_atomic": 0.051830405299051786,
"volume": 173.643249518727,
"volume_molar": 11.61893434028418,
"formula_full": "Tb3 Mn3 Ga2 Ge1",
"formula_reduced": "Tb3Mn3Ga2Ge",
"formula_anonymous": "AB2C3D3",
"energy_above_hull": 2.1878752804597705,
"spacegroup": 174
},
{
"id": "jvasp-47811",
"created_at": "2022-09-04T14:37:00.734174Z",
"updated_at": "2022-09-04T14:37:00.734202Z",
"structure_string": "Li3 Fe3 Si3 O12\n1.0\n2.749404 -4.762108 0.000000\n2.749404 4.762108 -0.000000\n0.000000 -0.000000 11.437591\nLi Fe Si O\n3 3 3 12\ndirect\n0.000000 0.000000 0.833333 Li\n0.000000 0.000000 0.500000 Li\n0.000000 0.000000 0.166667 Li\n0.500000 -0.000001 0.500000 Fe\n0.499999 0.499999 0.166667 Fe\n-0.000001 0.500000 0.833333 Fe\n0.500000 -0.000001 0.000000 Si\n0.499999 0.499999 0.666667 Si\n-0.000001 0.500000 0.333333 Si\n0.393522 0.221544 0.582954 O\n0.393523 0.171978 0.083713 O\n0.778455 0.606476 0.750379 O\n0.828020 0.606476 0.249621 O\n0.171978 0.393523 0.249621 O\n0.221543 0.828021 0.916287 O\n0.606476 0.828020 0.083713 O\n0.606476 0.778455 0.582954 O\n0.778455 0.171978 0.916287 O\n0.171978 0.778455 0.417046 O\n0.221544 0.393522 0.750379 O\n0.828021 0.221543 0.417046 O\n",
"nsites": 21,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Si",
"O"
],
"chemical_system": "Fe-Li-O-Si",
"density": 2.575922353560678,
"density_atomic": 0.07011596828375441,
"volume": 299.5038150940806,
"volume_molar": 8.58882920311222,
"formula_full": "Li3 Fe3 Si3 O12",
"formula_reduced": "LiFeSiO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.4451483,
"spacegroup": 181
},
{
"id": "jvasp-102099",
"created_at": "2022-09-04T14:36:42.978413Z",
"updated_at": "2022-09-04T14:36:42.978448Z",
"structure_string": "Li2 Ti2 Sb2 O1\n1.0\n3.940672 -0.018035 -6.869871\n-0.295373 3.929629 -6.869871\n0.016807 0.018035 7.919832\nLi Ti Sb O\n2 2 2 1\ndirect\n0.668158 0.668159 0.000001 Li\n0.331842 0.331843 0.000001 Li\n0.500000 0.000000 0.500000 Ti\n0.000001 0.500000 0.500000 Ti\n0.859920 0.859921 0.000002 Sb\n0.140080 0.140081 0.000000 Sb\n0.500000 0.500001 0.000001 O\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Li",
"Ti",
"Sb",
"O"
],
"chemical_system": "Li-O-Sb-Ti",
"density": 4.960054114508771,
"density_atomic": 0.056643445320004586,
"volume": 123.58005344579264,
"volume_molar": 10.631663956841232,
"formula_full": "Li2 Ti2 Sb2 O1",
"formula_reduced": "Li2Ti2Sb2O",
"formula_anonymous": "AB2C2D2",
"energy_above_hull": 2.2159503380952383,
"spacegroup": 139
},
{
"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-100556",
"created_at": "2022-09-04T14:36:53.584879Z",
"updated_at": "2022-09-04T14:36:53.584907Z",
"structure_string": "La1 Mn1 Fe1 Ge2\n1.0\n3.863569 0.007034 -4.704889\n-0.489711 3.832414 -4.704889\n-0.006181 -0.007034 6.087948\nLa Mn Fe Ge\n1 1 1 2\ndirect\n0.000000 0.000000 0.000000 La\n0.250000 0.749999 0.500000 Mn\n0.750000 0.249999 0.500000 Fe\n0.630961 0.630959 -0.000001 Ge\n0.369040 0.369039 -0.000001 Ge\n",
"nsites": 5,
"nelements": 4,
"elements": [
"La",
"Mn",
"Fe",
"Ge"
],
"chemical_system": "Fe-Ge-La-Mn",
"density": 7.294743859804608,
"density_atomic": 0.05561199523343059,
"volume": 89.90866051492252,
"volume_molar": 10.828852183278348,
"formula_full": "La1 Mn1 Fe1 Ge2",
"formula_reduced": "LaMnFeGe2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 2.284485928275862,
"spacegroup": 119
},
{
"id": "jvasp-101938",
"created_at": "2022-09-04T14:36:37.230027Z",
"updated_at": "2022-09-04T14:36:37.230053Z",
"structure_string": "Hf1 H2 C3 O4\n1.0\n4.300829 -0.147544 0.882540\n1.623148 4.199019 0.420271\n0.041891 -0.104852 5.830978\nHf H C O\n1 2 3 4\ndirect\n0.715430 0.182644 0.554120 Hf\n0.224373 0.693096 0.035947 H\n0.783817 0.774711 0.106218 H\n0.053837 0.471246 0.352255 C\n0.025807 0.591950 0.098052 C\n0.055484 0.355325 0.921473 C\n-0.017791 0.757824 0.480928 O\n0.387954 0.294675 0.357971 O\n0.331747 0.144629 0.841090 O\n0.795331 0.372269 0.849286 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Hf",
"H",
"C",
"O"
],
"chemical_system": "C-H-Hf-O",
"density": 4.370759550167006,
"density_atomic": 0.09382527966084046,
"volume": 106.58108386298439,
"volume_molar": 6.418462893762565,
"formula_full": "Hf1 H2 C3 O4",
"formula_reduced": "HfH2C3O4",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 4.477141699999999,
"spacegroup": 1
},
{
"id": "jvasp-101526",
"created_at": "2022-09-04T14:36:43.030476Z",
"updated_at": "2022-09-04T14:36:43.030492Z",
"structure_string": "Sr2 Cu1 S1 O2\n1.0\n3.888771 -0.000000 0.000000\n0.000000 3.888771 0.000000\n-0.000000 -0.000000 6.813731\nSr Cu S O\n2 1 1 2\ndirect\n0.000000 0.000000 0.249463 Sr\n0.000000 0.000000 0.750537 Sr\n0.500000 0.500000 -0.000000 Cu\n0.500000 0.500000 0.500000 S\n-0.000000 0.500000 -0.000000 O\n0.500000 0.000000 -0.000000 O\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Sr",
"Cu",
"S",
"O"
],
"chemical_system": "Cu-O-S-Sr",
"density": 4.880526394984223,
"density_atomic": 0.05822929440992992,
"volume": 103.04091885023446,
"volume_molar": 10.342115289264155,
"formula_full": "Sr2 Cu1 S1 O2",
"formula_reduced": "Sr2CuSO2",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 0.608780011666667,
"spacegroup": 123
}
]
}