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=updated_at&page=3445",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=updated_at&page=3443",
"results": [
{
"id": "jvasp-44231",
"created_at": "2022-09-04T14:38:08.931809Z",
"updated_at": "2022-09-04T14:38:08.931837Z",
"structure_string": "Na4 Ni4 O6\n1.0\n0.000000 5.741578 -0.057673\n5.393984 0.000000 0.000000\n0.000000 -2.939537 -5.376154\nNa Ni O\n4 4 6\ndirect\n0.151844 0.344855 0.892431 Na\n0.151845 0.155145 0.392431 Na\n0.848154 0.844854 0.607568 Na\n0.848155 0.655145 0.107568 Na\n0.341055 0.640966 0.589065 Ni\n0.658944 0.140967 0.910933 Ni\n0.341055 0.859033 0.089066 Ni\n0.658944 0.359033 0.410933 Ni\n-0.000000 0.500000 0.500000 O\n0.000000 0.000000 0.000000 O\n0.340732 0.930554 0.766310 O\n0.340733 0.569445 0.266310 O\n0.659266 0.430555 0.733688 O\n0.659267 0.069445 0.233689 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Na",
"Ni",
"O"
],
"chemical_system": "Na-Ni-O",
"density": 4.192951873155848,
"density_atomic": 0.08362510850951403,
"volume": 167.41383359050852,
"volume_molar": 7.20135479323756,
"formula_full": "Na4 Ni4 O6",
"formula_reduced": "Na2Ni2O3",
"formula_anonymous": "A2B2C3",
"energy_above_hull": 1.1346204714285717,
"spacegroup": 14
},
{
"id": "jvasp-36997",
"created_at": "2022-09-04T14:38:08.933922Z",
"updated_at": "2022-09-04T14:38:08.933938Z",
"structure_string": "Rb4 Sn4 Br12\n1.0\n4.510942 -0.000000 0.000000\n0.000000 9.368838 0.000000\n0.000000 0.000000 16.271703\nRb Sn Br\n4 4 12\ndirect\n0.750000 0.091053 0.329706 Rb\n0.250000 0.908947 0.670294 Rb\n0.750000 0.591053 0.170294 Rb\n0.250000 0.408947 0.829706 Rb\n0.250000 0.160905 0.062984 Sn\n0.750000 0.839095 0.937015 Sn\n0.250000 0.660905 0.437016 Sn\n0.750000 0.339095 0.562984 Sn\n0.750000 0.692793 0.788439 Br\n0.250000 0.307207 0.211561 Br\n0.750000 0.470648 0.376340 Br\n0.250000 0.529352 0.623660 Br\n0.750000 0.970648 0.123660 Br\n0.250000 0.660243 0.004392 Br\n0.250000 0.160243 0.495608 Br\n0.750000 0.839758 0.504392 Br\n0.250000 0.807207 0.288439 Br\n0.750000 0.339757 0.995608 Br\n0.250000 0.029352 0.876340 Br\n0.750000 0.192793 0.711561 Br\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Rb",
"Sn",
"Br"
],
"chemical_system": "Br-Rb-Sn",
"density": 4.287442149405144,
"density_atomic": 0.02908332218153855,
"volume": 687.6793467802505,
"volume_molar": 20.70650912027761,
"formula_full": "Rb4 Sn4 Br12",
"formula_reduced": "RbSnBr3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-46779",
"created_at": "2022-09-04T14:38:08.937650Z",
"updated_at": "2022-09-04T14:38:08.937682Z",
"structure_string": "Li3 Co2 Si2 O8\n1.0\n5.194369 -0.014040 0.001589\n-0.151051 5.193202 0.009547\n-0.080167 -0.092207 6.360960\nLi Co Si O\n3 2 2 8\ndirect\n0.826514 0.173181 0.494747 Li\n0.316020 0.316001 0.736714 Li\n0.173097 0.826422 0.494739 Li\n0.813096 0.191821 0.004923 Co\n0.191728 0.813018 0.004984 Co\n0.685997 0.686085 0.740606 Si\n0.329316 0.329241 0.259473 Si\n0.820697 0.820849 0.959436 O\n0.715693 0.366698 0.757616 O\n0.813297 0.813484 0.540623 O\n0.638981 0.274724 0.245390 O\n0.366512 0.715495 0.757635 O\n0.204638 0.204478 0.467177 O\n0.274494 0.638783 0.245403 O\n0.196506 0.196343 0.033460 O\n",
"nsites": 15,
"nelements": 4,
"elements": [
"Li",
"Co",
"Si",
"O"
],
"chemical_system": "Co-Li-O-Si",
"density": 3.124550458730618,
"density_atomic": 0.08742213204687393,
"volume": 171.5812649359468,
"volume_molar": 6.8885768614874925,
"formula_full": "Li3 Co2 Si2 O8",
"formula_reduced": "Li3Co2(SiO4)2",
"formula_anonymous": "A2B2C3D8",
"energy_above_hull": 2.6922924666666668,
"spacegroup": 8
},
{
"id": "jvasp-10271",
"created_at": "2022-09-04T14:38:08.938269Z",
"updated_at": "2022-09-04T14:38:08.938280Z",
"structure_string": "K6 Sb2 Se8\n1.0\n7.981181 -0.045513 -0.173419\n-0.176236 7.979365 -0.173419\n-0.044773 -0.045513 7.982940\nK Sb Se\n6 2 8\ndirect\n0.465206 0.520097 -0.000043 K\n-0.000043 0.465206 0.520097 K\n0.520097 -0.000042 0.465206 K\n0.020096 0.965207 0.499957 K\n0.499958 0.020097 0.965206 K\n0.965206 0.499958 0.020096 K\n0.001030 0.001030 0.001030 Sb\n0.501030 0.501030 0.501030 Sb\n0.200261 0.821400 0.167542 Se\n0.313007 0.313008 0.313007 Se\n0.321400 0.700262 0.667542 Se\n0.167543 0.200262 0.821400 Se\n0.821400 0.167543 0.200261 Se\n0.700261 0.667543 0.321400 Se\n0.667542 0.321400 0.700261 Se\n0.813007 0.813008 0.813007 Se\n",
"nsites": 16,
"nelements": 3,
"elements": [
"K",
"Sb",
"Se"
],
"chemical_system": "K-Sb-Se",
"density": 3.626222330607478,
"density_atomic": 0.03148361437024576,
"volume": 508.2008632122343,
"volume_molar": 19.12785707885988,
"formula_full": "K6 Sb2 Se8",
"formula_reduced": "K3SbSe4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.5246741958333334,
"spacegroup": 161
},
{
"id": "jvasp-44783",
"created_at": "2022-09-04T14:38:08.939646Z",
"updated_at": "2022-09-04T14:38:08.939671Z",
"structure_string": "Li4 Ti2 V3 Cr3 O16\n1.0\n5.819213 0.001316 -0.000446\n-2.909545 -5.040913 0.005644\n-0.048175 0.017256 -9.463685\nLi Ti V Cr O\n4 2 3 3 16\ndirect\n0.659706 0.329859 0.103751 Li\n0.001270 0.000640 0.005410 Li\n0.004019 0.002046 0.505126 Li\n0.328117 0.664065 0.607425 Li\n0.669425 0.334745 0.505439 Ti\n0.335250 0.667621 0.002489 Ti\n0.172868 0.821171 0.283211 V\n0.348967 0.174472 0.780811 V\n0.172855 0.351723 0.283207 V\n0.662777 0.831407 0.286702 Cr\n0.827331 0.658566 0.785616 Cr\n0.827330 0.168773 0.785615 Cr\n0.666356 0.833181 0.903832 O\n0.167465 0.833968 0.902214 O\n0.335011 0.667522 0.401262 O\n0.479576 0.519772 0.160758 O\n0.479575 0.959824 0.160755 O\n0.334581 0.167313 0.400849 O\n0.515497 0.034868 0.657926 O\n0.957286 0.478645 0.661979 O\n0.837214 0.169935 0.403409 O\n0.005174 0.002602 0.193865 O\n0.003656 0.001832 0.693348 O\n0.659245 0.329629 0.897567 O\n0.029257 0.514640 0.156025 O\n0.837219 0.667328 0.403419 O\n0.515495 0.480632 0.657929 O\n0.167463 0.333495 0.902217 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Li",
"Ti",
"V",
"Cr",
"O"
],
"chemical_system": "Cr-Li-O-Ti-V",
"density": 4.117667422673557,
"density_atomic": 0.10087456469082524,
"volume": 277.57244936638284,
"volume_molar": 5.969929861365466,
"formula_full": "Li4 Ti2 V3 Cr3 O16",
"formula_reduced": "Li4Ti2V3Cr3O16",
"formula_anonymous": "A2B3C3D4E16",
"energy_above_hull": 3.412855623809524,
"spacegroup": 8
},
{
"id": "jvasp-20602",
"created_at": "2022-09-04T14:38:08.939949Z",
"updated_at": "2022-09-04T14:38:08.939979Z",
"structure_string": "Co6 W2\n1.0\n2.553064 -4.422036 -0.000000\n2.553064 4.422036 -0.000000\n0.000000 0.000000 4.089182\nCo W\n6 2\ndirect\n0.161830 0.323661 0.750000 Co\n0.323661 0.161830 0.250000 Co\n0.838169 0.161829 0.250000 Co\n0.161829 0.838169 0.750000 Co\n0.676337 0.838169 0.750000 Co\n0.838169 0.676337 0.250000 Co\n0.666666 0.333332 0.750000 W\n0.333332 0.666666 0.250000 W\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Co",
"W"
],
"chemical_system": "Co-W",
"density": 12.97185471678446,
"density_atomic": 0.08664421577541687,
"volume": 92.33161069558437,
"volume_molar": 6.950424452579133,
"formula_full": "Co6 W2",
"formula_reduced": "Co3W",
"formula_anonymous": "AB3",
"energy_above_hull": 4.433910675,
"spacegroup": 194
},
{
"id": "jvasp-46797",
"created_at": "2022-09-04T14:38:08.940306Z",
"updated_at": "2022-09-04T14:38:08.940332Z",
"structure_string": "Mn4 Si4 O14\n1.0\n2.656087 4.098530 0.000000\n-2.656087 4.098530 0.000000\n0.000000 0.000000 12.332262\nMn Si O\n4 4 14\ndirect\n0.042912 0.957088 0.000000 Mn\n0.042912 0.957088 0.500000 Mn\n0.014504 0.928698 0.250000 Mn\n0.071302 0.985496 0.750000 Mn\n0.384795 0.298993 0.130958 Si\n0.384795 0.298993 0.369042 Si\n0.701007 0.615205 0.630958 Si\n0.701007 0.615205 0.869042 Si\n0.841604 0.243621 0.635115 O\n0.841604 0.243621 0.864885 O\n0.262140 0.176336 0.469226 O\n0.262140 0.176336 0.030774 O\n0.823664 0.737860 0.969226 O\n0.823664 0.737860 0.530774 O\n0.329423 0.755769 0.635112 O\n0.282819 0.197064 0.250000 O\n0.329423 0.755769 0.864888 O\n0.756379 0.158395 0.135115 O\n0.244231 0.670576 0.364888 O\n0.244231 0.670576 0.135112 O\n0.802936 0.717181 0.750000 O\n0.756379 0.158395 0.364885 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Mn",
"Si",
"O"
],
"chemical_system": "Mn-O-Si",
"density": 3.4391232016597684,
"density_atomic": 0.08193689980847074,
"volume": 268.4992970374211,
"volume_molar": 7.349729821456369,
"formula_full": "Mn4 Si4 O14",
"formula_reduced": "Mn2Si2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 3.269468743887147,
"spacegroup": 63
},
{
"id": "jvasp-41410",
"created_at": "2022-09-04T14:38:08.940969Z",
"updated_at": "2022-09-04T14:38:08.941002Z",
"structure_string": "Th2 Bi1 Te1\n1.0\n0.000000 3.907416 3.907416\n3.907416 -0.000000 3.907416\n3.907416 3.907416 -0.000000\nTh Bi Te\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Th\n0.500001 0.500001 0.500001 Th\n0.250001 0.250001 0.250001 Bi\n0.750001 0.750001 0.750001 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Th",
"Bi",
"Te"
],
"chemical_system": "Bi-Te-Th",
"density": 11.14285283734634,
"density_atomic": 0.033524402338048626,
"volume": 119.31607190682674,
"volume_molar": 17.963454498829805,
"formula_full": "Th2 Bi1 Te1",
"formula_reduced": "Th2BiTe",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.9211033166666671,
"spacegroup": 225
},
{
"id": "jvasp-33847",
"created_at": "2022-09-04T14:38:08.944425Z",
"updated_at": "2022-09-04T14:38:08.944451Z",
"structure_string": "Sm2 I6\n1.0\n10.491673 -0.000000 -0.000000\n-5.245835 9.086055 0.000000\n0.000000 -0.000000 4.071569\nSm I\n2 6\ndirect\n0.333334 0.666668 0.750000 Sm\n0.666667 0.333333 0.249999 Sm\n0.204525 0.409052 0.249999 I\n0.590948 0.795475 0.249999 I\n0.204525 0.795475 0.249999 I\n0.795474 0.590949 0.750000 I\n0.409052 0.204526 0.750000 I\n0.795474 0.204526 0.750000 I\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sm",
"I"
],
"chemical_system": "I-Sm",
"density": 4.5441404282508255,
"density_atomic": 0.02061142793919211,
"volume": 388.13419543767765,
"volume_molar": 29.217484483688057,
"formula_full": "Sm2 I6",
"formula_reduced": "SmI3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-109811",
"created_at": "2022-09-04T14:38:08.956158Z",
"updated_at": "2022-09-04T14:38:08.956181Z",
"structure_string": "Ba1 La1 Co2 O6\n1.0\n3.898072 -0.000000 0.000000\n0.000000 3.898072 0.000000\n0.000000 0.000000 7.697116\nBa La Co O\n1 1 2 6\ndirect\n0.000000 0.000000 0.500001 Ba\n0.000000 0.000000 0.000000 La\n0.499999 0.499999 0.749349 Co\n0.499999 0.499999 0.250651 Co\n0.499999 0.499999 0.500001 O\n0.499999 0.000000 0.770309 O\n-0.000000 0.499999 0.770309 O\n0.499999 0.000000 0.229692 O\n0.499999 0.499999 -0.000000 O\n-0.000000 0.499999 0.229692 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"La",
"Co",
"O"
],
"chemical_system": "Ba-Co-La-O",
"density": 6.95827926573206,
"density_atomic": 0.08550120888765367,
"volume": 116.95741066234204,
"volume_molar": 7.043339899337486,
"formula_full": "Ba1 La1 Co2 O6",
"formula_reduced": "BaLa(CoO3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.494988377,
"spacegroup": 123
},
{
"id": "jvasp-109168",
"created_at": "2022-09-04T14:38:08.956878Z",
"updated_at": "2022-09-04T14:38:08.956908Z",
"structure_string": "La1 Mn1 Fe1 Si2\n1.0\n3.776199 -0.026825 -4.503857\n-0.520038 3.740315 -4.503857\n0.023521 0.026825 5.877402\nLa Mn Fe Si\n1 1 1 2\ndirect\n0.000000 0.000000 0.000000 La\n0.250000 0.750001 0.499999 Mn\n0.750000 0.250001 0.500000 Fe\n0.636054 0.636056 0.000001 Si\n0.363946 0.363947 0.000000 Si\n",
"nsites": 5,
"nelements": 4,
"elements": [
"La",
"Mn",
"Fe",
"Si"
],
"chemical_system": "Fe-La-Mn-Si",
"density": 6.057175824740639,
"density_atomic": 0.059630587979685616,
"volume": 83.84958407090255,
"volume_molar": 10.09907995884858,
"formula_full": "La1 Mn1 Fe1 Si2",
"formula_reduced": "LaMnFeSi2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 3.258312988275862,
"spacegroup": 119
},
{
"id": "jvasp-9496",
"created_at": "2022-09-04T14:38:08.961775Z",
"updated_at": "2022-09-04T14:38:08.961798Z",
"structure_string": "Sr4 Mn2 S2 O6\n1.0\n3.953105 0.000000 0.000000\n0.000000 3.953105 0.000000\n0.000000 0.000000 13.539180\nSr Mn S O\n4 2 2 6\ndirect\n0.500001 0.000000 0.138175 Sr\n0.000000 0.500001 0.861825 Sr\n0.500001 0.000000 0.400362 Sr\n0.000000 0.500001 0.599638 Sr\n0.000000 0.500001 0.276707 Mn\n0.500001 0.000000 0.723293 Mn\n0.000000 0.500001 0.092652 S\n0.500001 0.000000 0.907348 S\n0.500001 0.500001 0.272593 O\n0.000000 0.000000 0.272593 O\n0.000000 0.000000 0.727407 O\n0.500001 0.500001 0.727407 O\n0.000000 0.500001 0.416378 O\n0.500001 0.000000 0.583622 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Sr",
"Mn",
"S",
"O"
],
"chemical_system": "Mn-O-S-Sr",
"density": 4.8697825109408015,
"density_atomic": 0.06616967074485681,
"volume": 211.57729579738285,
"volume_molar": 9.101058977942827,
"formula_full": "Sr4 Mn2 S2 O6",
"formula_reduced": "Sr2MnSO3",
"formula_anonymous": "ABC2D3",
"energy_above_hull": 1.65271576591133,
"spacegroup": 129
}
]
}