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=-formula_anonymous&page=547",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=545",
"results": [
{
"id": "jvasp-9426",
"created_at": "2022-09-04T14:37:17.709004Z",
"updated_at": "2022-09-04T14:37:17.709014Z",
"structure_string": "Li2 Ta2 O6\n1.0\n4.567605 0.009650 3.078611\n1.642636 4.262025 3.078611\n0.014029 0.009650 5.508236\nLi Ta O\n2 2 6\ndirect\n0.281083 0.281083 0.281083 Li\n0.781083 0.781082 0.781084 Li\n0.999383 0.999382 0.999384 Ta\n0.499383 0.499383 0.499383 Ta\n0.613206 0.225930 0.868599 O\n0.725930 0.113206 0.368599 O\n0.113206 0.368598 0.725931 O\n0.368599 0.725930 0.113206 O\n0.868598 0.613205 0.225931 O\n0.225931 0.868597 0.613206 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Li",
"Ta",
"O"
],
"chemical_system": "Li-O-Ta",
"density": 7.330236927875943,
"density_atomic": 0.09356959821426851,
"volume": 106.87231954443823,
"volume_molar": 6.436001516443061,
"formula_full": "Li2 Ta2 O6",
"formula_reduced": "LiTaO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.53298594,
"spacegroup": 161
},
{
"id": "jvasp-22913",
"created_at": "2022-09-04T14:37:30.869390Z",
"updated_at": "2022-09-04T14:37:30.869408Z",
"structure_string": "Sr6 Ge6 O18\n1.0\n6.905969 0.003410 2.288445\n3.056843 6.192586 2.288445\n-0.020789 -0.012929 11.381826\nSr Ge O\n6 6 18\ndirect\n0.330508 0.839829 0.500659 Sr\n0.669491 0.160171 0.499343 Sr\n0.839829 0.330509 0.000658 Sr\n0.500000 -0.000000 0.000000 Sr\n-0.000000 0.500000 0.500000 Sr\n0.160171 0.669492 0.999343 Sr\n0.582222 0.679732 0.753441 Ge\n0.320268 0.417778 0.746561 Ge\n0.417778 0.320269 0.246561 Ge\n0.679731 0.582222 0.253440 Ge\n0.846419 0.153581 0.750001 Ge\n0.153580 0.846420 0.250001 Ge\n0.175359 0.367999 0.896202 O\n0.632001 0.824641 0.603800 O\n0.717668 0.531403 0.406375 O\n0.653958 0.346042 0.250001 O\n0.531402 0.717668 0.906376 O\n0.367999 0.175359 0.396202 O\n0.824641 0.632002 0.103799 O\n0.819724 0.417111 0.751127 O\n0.582889 0.180275 0.748874 O\n0.180275 0.582889 0.248874 O\n0.417111 0.819725 0.251127 O\n0.990193 0.111949 0.599441 O\n0.888051 0.009807 0.900560 O\n0.009806 0.888052 0.400560 O\n0.111948 0.990194 0.099441 O\n0.346042 0.653958 0.750001 O\n0.282332 0.468597 0.593626 O\n0.468597 0.282332 0.093626 O\n",
"nsites": 30,
"nelements": 3,
"elements": [
"Sr",
"Ge",
"O"
],
"chemical_system": "Ge-O-Sr",
"density": 4.260253605691012,
"density_atomic": 0.06159624661990482,
"volume": 487.0426632506128,
"volume_molar": 9.776798247401564,
"formula_full": "Sr6 Ge6 O18",
"formula_reduced": "SrGeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.0957045519999995,
"spacegroup": 15
},
{
"id": "jvasp-36999",
"created_at": "2022-09-04T14:37:17.230321Z",
"updated_at": "2022-09-04T14:37:17.230352Z",
"structure_string": "Tl1 Pd1 F3\n1.0\n4.302235 -0.011739 -0.002336\n0.011848 4.302294 -0.023815\n0.002395 0.024021 4.302447\nTl Pd F\n1 1 3\ndirect\n1.000000 0.998090 0.987910 Tl\n0.500000 0.497986 0.488018 Pd\n-0.000005 0.497886 0.488006 F\n0.500054 0.498054 0.988015 F\n0.499950 0.997975 0.488045 F\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Tl",
"Pd",
"F"
],
"chemical_system": "F-Pd-Tl",
"density": 7.668889909647012,
"density_atomic": 0.0627831996587268,
"volume": 79.63913956565935,
"volume_molar": 9.591962169393717,
"formula_full": "Tl1 Pd1 F3",
"formula_reduced": "TlPdF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-49174",
"created_at": "2022-09-04T14:37:11.642940Z",
"updated_at": "2022-09-04T14:37:11.642957Z",
"structure_string": "Ba4 Ge4 O12\n1.0\n4.658297 0.000000 0.000000\n0.000000 5.775212 0.000000\n0.000000 0.000000 12.947416\nBa Ge O\n4 4 12\ndirect\n0.276641 0.817794 0.861199 Ba\n0.776641 0.682205 0.138801 Ba\n0.723360 0.317794 0.638801 Ba\n0.223359 0.182206 0.361199 Ba\n0.827197 0.307037 0.923124 Ge\n0.327197 0.192963 0.076876 Ge\n0.172803 0.807036 0.576876 Ge\n0.672804 0.692963 0.423124 Ge\n0.783700 0.788209 0.552281 O\n0.283700 0.711791 0.447719 O\n0.741170 0.888197 0.323222 O\n0.241170 0.611802 0.676778 O\n0.258830 0.388198 0.176778 O\n0.264809 0.895403 0.087662 O\n0.735192 0.395403 0.412338 O\n0.235192 0.104597 0.587662 O\n0.716301 0.211791 0.052281 O\n0.764809 0.604597 0.912338 O\n0.758831 0.111802 0.823222 O\n0.216301 0.288209 0.947720 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Ba",
"Ge",
"O"
],
"chemical_system": "Ba-Ge-O",
"density": 4.919171951719307,
"density_atomic": 0.05741849273881709,
"volume": 348.31983645016925,
"volume_molar": 10.488155423015492,
"formula_full": "Ba4 Ge4 O12",
"formula_reduced": "BaGeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.1734824839999998,
"spacegroup": 19
},
{
"id": "jvasp-36634",
"created_at": "2022-09-04T14:37:12.032644Z",
"updated_at": "2022-09-04T14:37:12.032664Z",
"structure_string": "Mn1 Zn1 O3\n1.0\n3.704675 0.000000 0.000000\n0.000000 3.704675 0.000000\n-0.000000 0.000000 3.704675\nMn Zn O\n1 1 3\ndirect\n0.499999 0.499999 0.499999 Mn\n0.000000 0.000000 0.000000 Zn\n0.499999 0.499999 0.000000 O\n0.499999 0.000000 0.499999 O\n0.000000 0.499999 0.499999 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Mn",
"Zn",
"O"
],
"chemical_system": "Mn-O-Zn",
"density": 5.49793508273734,
"density_atomic": 0.09833761259199326,
"volume": 50.84524494961254,
"volume_molar": 6.123944441264917,
"formula_full": "Mn1 Zn1 O3",
"formula_reduced": "MnZnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.8629536282758616,
"spacegroup": 221
},
{
"id": "jvasp-11792",
"created_at": "2022-09-04T14:37:17.297451Z",
"updated_at": "2022-09-04T14:37:17.297471Z",
"structure_string": "Ni2 C2 O6\n1.0\n4.191576 -0.014090 3.647125\n1.652565 3.852082 3.647125\n-0.021455 -0.014090 5.556110\nNi C O\n2 2 6\ndirect\n0.500002 0.500000 0.499998 Ni\n0.000000 0.000000 0.000000 Ni\n0.750003 0.750000 0.749997 C\n0.250001 0.250000 0.249999 C\n0.470131 0.029871 0.749999 O\n0.750001 0.470129 0.029869 O\n0.970131 0.250000 0.529868 O\n0.529873 0.970129 0.249998 O\n0.250002 0.529870 0.970128 O\n0.029872 0.750000 0.470128 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ni",
"C",
"O"
],
"chemical_system": "C-Ni-O",
"density": 4.366973416064597,
"density_atomic": 0.11077514342943337,
"volume": 90.27295917129874,
"volume_molar": 5.436364669512939,
"formula_full": "Ni2 C2 O6",
"formula_reduced": "NiCO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.80983058,
"spacegroup": 167
},
{
"id": "jvasp-36640",
"created_at": "2022-09-04T14:37:19.076416Z",
"updated_at": "2022-09-04T14:37:19.076453Z",
"structure_string": "Hf1 Cd1 O3\n1.0\n4.087776 -0.000000 0.000000\n-0.000000 4.087776 0.000000\n-0.000000 -0.000000 4.087776\nHf Cd O\n1 1 3\ndirect\n0.500001 0.500001 0.500001 Hf\n0.000000 0.000000 0.000000 Cd\n0.500001 0.500001 0.000000 O\n0.500001 0.000000 0.500001 O\n0.000000 0.500001 0.500001 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Hf",
"Cd",
"O"
],
"chemical_system": "Cd-Hf-O",
"density": 8.238693997914906,
"density_atomic": 0.07319960470717611,
"volume": 68.30637979537921,
"volume_molar": 8.227012678675873,
"formula_full": "Hf1 Cd1 O3",
"formula_reduced": "HfCdO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.81229265,
"spacegroup": 221
},
{
"id": "jvasp-34213",
"created_at": "2022-09-04T14:37:11.982065Z",
"updated_at": "2022-09-04T14:37:11.982080Z",
"structure_string": "Ca2 C2 O6\n1.0\n3.728431 -0.000018 -0.000000\n-0.000025 5.166463 -1.464983\n0.000001 -0.298181 5.361827\nCa C O\n2 2 6\ndirect\n0.750005 0.805998 0.193995 Ca\n0.250000 0.193996 0.806003 Ca\n-0.000004 0.357714 0.357713 C\n0.499997 0.642287 0.642289 C\n0.749998 0.414699 0.585304 O\n0.250000 0.585302 0.414699 O\n0.668990 0.866852 0.650227 O\n0.331010 0.650225 0.866852 O\n0.168987 0.133150 0.349776 O\n0.831008 0.349774 0.133147 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ca",
"C",
"O"
],
"chemical_system": "C-Ca-O",
"density": 3.2698444766843107,
"density_atomic": 0.0983718334202898,
"volume": 101.6551146025244,
"volume_molar": 6.121814091103334,
"formula_full": "Ca2 C2 O6",
"formula_reduced": "CaCO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.3063061840000003,
"spacegroup": 20
},
{
"id": "jvasp-33897",
"created_at": "2022-09-04T14:37:17.777180Z",
"updated_at": "2022-09-04T14:37:17.777206Z",
"structure_string": "In1 Sn1 Cl3\n1.0\n-0.200902 0.088439 5.564390\n5.568436 0.051704 -0.082133\n0.210184 5.561173 0.189000\nIn Sn Cl\n1 1 3\ndirect\n0.070705 0.068747 0.943126 In\n0.506888 0.504842 0.507308 Sn\n0.458658 0.012072 0.554187 Cl\n0.459446 0.457833 0.000372 Cl\n0.014303 0.456508 0.555006 Cl\n",
"nsites": 5,
"nelements": 3,
"elements": [
"In",
"Sn",
"Cl"
],
"chemical_system": "Cl-In-Sn",
"density": 3.2801520526165624,
"density_atomic": 0.029058977515889498,
"volume": 172.06386553917775,
"volume_molar": 20.72385635973283,
"formula_full": "In1 Sn1 Cl3",
"formula_reduced": "InSnCl3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0073619999999999,
"spacegroup": 160
},
{
"id": "jvasp-50167",
"created_at": "2022-09-04T14:37:10.938201Z",
"updated_at": "2022-09-04T14:37:10.938219Z",
"structure_string": "Cd2 Bi2 O6\n1.0\n5.893724 0.000045 0.000082\n2.946881 5.104144 -0.000003\n2.946692 1.701558 4.967907\nCd Bi O\n2 2 6\ndirect\n0.363683 0.363670 0.908972 Cd\n0.632378 0.632383 0.102851 Cd\n0.138350 0.138350 0.584952 Bi\n0.851130 0.851128 0.446606 Bi\n0.043366 0.484709 0.735442 O\n0.484703 0.736487 0.735456 O\n0.736485 0.043359 0.735447 O\n0.218553 0.965619 0.250094 O\n0.565741 0.218551 0.250088 O\n0.965609 0.565737 0.250096 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Cd",
"Bi",
"O"
],
"chemical_system": "Bi-Cd-O",
"density": 8.208840238989978,
"density_atomic": 0.06691416246238835,
"volume": 149.44519414138793,
"volume_molar": 8.999799950249654,
"formula_full": "Cd2 Bi2 O6",
"formula_reduced": "CdBiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.09574491,
"spacegroup": 146
},
{
"id": "jvasp-4429",
"created_at": "2022-09-04T14:37:09.355717Z",
"updated_at": "2022-09-04T14:37:09.355748Z",
"structure_string": "Ca8 Si8 O24\n1.0\n7.170113 0.000000 0.000000\n0.000000 7.170113 -0.000000\n0.000000 -0.000000 7.261941\nCa Si O\n8 8 24\ndirect\n0.500000 0.000000 0.999967 Ca\n0.000000 0.500000 0.500032 Ca\n0.000000 0.000000 0.500000 Ca\n0.500000 0.000000 0.499967 Ca\n0.000000 0.000000 0.000000 Ca\n0.000000 0.500000 0.000032 Ca\n0.500000 0.500000 0.500000 Ca\n0.500000 0.500000 0.000000 Ca\n0.750000 0.250000 0.750000 Si\n0.250000 0.250000 0.250000 Si\n0.750000 0.250000 0.250000 Si\n0.750000 0.750000 0.250000 Si\n0.250000 0.750000 0.750000 Si\n0.250000 0.750000 0.250000 Si\n0.250000 0.250000 0.750000 Si\n0.750000 0.750000 0.750000 Si\n0.750047 0.750047 0.000000 O\n0.500000 0.723792 0.750044 O\n0.723791 0.000000 0.749957 O\n0.000000 0.223792 0.749956 O\n0.500000 0.223792 0.249957 O\n0.776208 0.500000 0.750042 O\n0.500000 0.776208 0.249957 O\n0.750047 0.249953 0.000000 O\n0.250047 0.749952 0.500000 O\n0.723792 0.500000 0.249956 O\n0.500000 0.276208 0.750044 O\n0.000000 0.723791 0.250043 O\n0.749952 0.250047 0.500000 O\n0.000000 0.776208 0.749956 O\n0.276208 0.000000 0.749957 O\n0.249953 0.750047 0.000000 O\n0.749952 0.749952 0.500000 O\n0.000000 0.276208 0.250043 O\n0.249953 0.249953 0.000000 O\n0.223792 0.500000 0.750042 O\n0.776208 0.000000 0.250044 O\n0.250047 0.250047 0.500000 O\n0.276208 0.500000 0.249956 O\n0.223792 0.000000 0.250044 O\n",
"nsites": 40,
"nelements": 3,
"elements": [
"Ca",
"Si",
"O"
],
"chemical_system": "Ca-O-Si",
"density": 4.133303799065376,
"density_atomic": 0.10714089622662361,
"volume": 373.3401661620629,
"volume_molar": 5.62076757997433,
"formula_full": "Ca8 Si8 O24",
"formula_reduced": "CaSiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.506373904,
"spacegroup": 140
},
{
"id": "jvasp-36451",
"created_at": "2022-09-04T14:37:18.411637Z",
"updated_at": "2022-09-04T14:37:18.411660Z",
"structure_string": "Sr3 As1 P1\n1.0\n5.749956 0.000000 -0.000000\n0.000000 5.749956 0.000000\n-0.000000 0.000000 5.749956\nSr As P\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Sr\n0.500000 0.000000 0.500000 Sr\n0.500000 0.500000 0.000000 Sr\n0.500000 0.500000 0.500000 As\n0.000000 0.000000 0.000000 P\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"As",
"P"
],
"chemical_system": "As-P-Sr",
"density": 3.2210233812138274,
"density_atomic": 0.026301253077947315,
"volume": 190.10501078339593,
"volume_molar": 22.896782682378568,
"formula_full": "Sr3 As1 P1",
"formula_reduced": "Sr3AsP",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.634833236,
"spacegroup": 221
}
]
}