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=spacegroup&page=56",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=spacegroup&page=54",
"results": [
{
"id": "jvasp-9282",
"created_at": "2022-09-04T14:38:16.663779Z",
"updated_at": "2022-09-04T14:38:16.663806Z",
"structure_string": "Mg1 Sb4 O8\n1.0\n3.241546 -0.162246 -0.227687\n1.171968 6.528591 0.425570\n0.789337 3.375903 9.183706\nMg Sb O\n1 4 8\ndirect\n0.585396 0.855249 0.801521 Mg\n0.345306 0.733513 0.522384 Sb\n0.988749 0.280407 0.867350 Sb\n0.126287 0.628296 0.107254 Sb\n0.727421 0.226846 0.443017 Sb\n0.205971 0.324790 0.279282 O\n0.604563 0.718802 0.197518 O\n0.502635 0.243983 0.750138 O\n0.884314 0.623107 0.711290 O\n0.800395 -0.049403 0.398738 O\n0.068949 0.896399 0.911925 O\n0.297493 0.989414 0.593393 O\n0.640138 0.537948 0.007402 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Mg",
"Sb",
"O"
],
"chemical_system": "Mg-O-Sb",
"density": 5.539248806763955,
"density_atomic": 0.06782864090147807,
"volume": 191.65944986104998,
"volume_molar": 8.878462961903118,
"formula_full": "Mg1 Sb4 O8",
"formula_reduced": "Mg(SbO2)4",
"formula_anonymous": "AB4C8",
"energy_above_hull": 2.2271685730769235,
"spacegroup": 1
},
{
"id": "jvasp-44634",
"created_at": "2022-09-04T14:38:16.773926Z",
"updated_at": "2022-09-04T14:38:16.773950Z",
"structure_string": "Li4 V1 Fe3 O8\n1.0\n-5.043156 0.010679 0.012088\n0.011880 -5.531707 0.022585\n0.022670 0.061460 6.402490\nLi V Fe O\n4 1 3 8\ndirect\n0.991442 0.083309 0.618951 Li\n0.501184 0.424751 0.127714 Li\n0.993656 0.573853 0.875127 Li\n0.499547 0.909377 0.376863 Li\n0.501620 0.919278 0.876133 V\n0.989602 0.085544 0.129321 Fe\n0.503622 0.420257 0.622101 Fe\n-0.004722 0.580923 0.374630 Fe\n0.377921 0.071438 0.104217 O\n0.392430 0.079982 0.651016 O\n0.885184 0.415046 0.124047 O\n0.883141 0.416143 0.623688 O\n0.377759 0.576758 0.378152 O\n0.393417 0.612299 0.869567 O\n0.885137 0.913123 0.371598 O\n0.855469 0.917921 0.876885 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"V",
"Fe",
"O"
],
"chemical_system": "Fe-Li-O-V",
"density": 3.4790852104066707,
"density_atomic": 0.08957580844518508,
"volume": 178.61965499078943,
"volume_molar": 6.722954405357315,
"formula_full": "Li4 V1 Fe3 O8",
"formula_reduced": "Li4VFe3O8",
"formula_anonymous": "AB3C4D8",
"energy_above_hull": 2.74429679375,
"spacegroup": 1
},
{
"id": "jvasp-97751",
"created_at": "2022-09-04T14:38:16.829051Z",
"updated_at": "2022-09-04T14:38:16.829073Z",
"structure_string": "C16 Se8 N16\n1.0\n6.710461 0.000000 0.000000\n0.000000 8.437974 0.000000\n0.000000 0.000000 12.600302\nC Se N\n16 8 16\ndirect\n0.725920 0.686751 0.636368 C\n0.842374 0.485409 0.624059 C\n0.157626 0.514590 0.375941 C\n0.842374 0.985409 0.875941 C\n0.657626 0.985409 0.375941 C\n0.157626 0.014590 0.124059 C\n0.657626 0.485409 0.124059 C\n0.342374 0.514590 0.875941 C\n0.274080 0.813248 0.136368 C\n0.774080 0.686751 0.136368 C\n0.588199 0.893753 0.888662 C\n0.225920 0.813248 0.636368 C\n0.342374 0.014590 0.624059 C\n0.911800 0.893753 0.388662 C\n0.774080 0.186751 0.363632 C\n0.411801 0.106247 0.111338 C\n0.225920 0.313249 0.863632 Se\n0.725920 0.186751 0.863632 Se\n0.274080 0.313249 0.363632 Se\n0.911800 0.393753 0.111338 Se\n0.088199 0.606246 0.888662 Se\n0.411801 0.606246 0.388662 Se\n0.088199 0.106247 0.611338 Se\n0.588199 0.393753 0.611338 Se\n0.344403 0.687483 0.143354 N\n0.564337 0.671313 0.396180 N\n0.655597 0.312517 0.856646 N\n0.435663 0.828686 0.896180 N\n0.064337 0.328686 0.103820 N\n0.655597 0.812516 0.643354 N\n0.844403 0.312517 0.356646 N\n0.155597 0.687483 0.643354 N\n0.064337 0.828686 0.396180 N\n0.935663 0.171314 0.603820 N\n0.844403 0.812516 0.143354 N\n0.344403 0.187483 0.356646 N\n0.155597 0.187483 0.856646 N\n0.435663 0.328686 0.603820 N\n0.564337 0.171314 0.103820 N\n0.935663 0.671313 0.896180 N\n",
"nsites": 40,
"nelements": 3,
"elements": [
"C",
"Se",
"N"
],
"chemical_system": "C-N-Se",
"density": 2.439055298602398,
"density_atomic": 0.05606457025272548,
"volume": 713.463062673801,
"volume_molar": 10.74143747620583,
"formula_full": "C16 Se8 N16",
"formula_reduced": "C2SeN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 5.193919973333333,
"spacegroup": 1
},
{
"id": "jvasp-25633",
"created_at": "2022-09-04T14:38:17.080451Z",
"updated_at": "2022-09-04T14:38:17.080472Z",
"structure_string": "K1 Au1 I4 O12\n1.0\n5.630000 -0.018352 0.031332\n-2.718931 6.678775 -0.030636\n-0.467908 -2.477140 7.699279\nK Au I O\n1 1 4 12\ndirect\n0.201934 0.100963 0.885005 K\n0.397761 0.096620 0.374809 Au\n0.504889 0.780094 0.580474 I\n0.886059 0.410969 0.234321 I\n0.820656 0.444467 0.742436 I\n0.516819 0.747542 0.063209 I\n0.299398 0.898372 0.133151 O\n0.690376 0.438946 0.945206 O\n0.655808 0.763780 0.277700 O\n0.225916 0.499462 0.004676 O\n0.857785 0.151628 0.110883 O\n0.250887 0.855891 0.473188 O\n0.825388 0.700260 0.747358 O\n0.531835 0.337880 0.274740 O\n0.472024 0.299546 0.613708 O\n0.349030 0.769926 0.772626 O\n0.764184 0.044458 0.662243 O\n0.027251 0.419941 0.447890 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"K",
"Au",
"I",
"O"
],
"chemical_system": "Au-I-K-O",
"density": 5.37618211803116,
"density_atomic": 0.062283369402507206,
"volume": 289.00170579524575,
"volume_molar": 9.668938623217098,
"formula_full": "K1 Au1 I4 O12",
"formula_reduced": "KAu(IO3)4",
"formula_anonymous": "ABC4D12",
"energy_above_hull": 1.881835069222222,
"spacegroup": 1
},
{
"id": "jvasp-13272",
"created_at": "2022-09-04T14:38:17.379008Z",
"updated_at": "2022-09-04T14:38:17.379028Z",
"structure_string": "Li7 Os1 O6\n1.0\n5.304765 -0.004606 0.002790\n-2.643068 4.703320 -0.005795\n-2.529389 -1.527985 4.987132\nLi Os O\n7 1 6\ndirect\n0.383792 0.857081 0.622111 Li\n0.742694 0.359008 0.045289 Li\n0.851345 0.761115 0.345788 Li\n0.149992 0.256699 0.626670 Li\n0.292329 0.633977 0.996964 Li\n0.594742 0.103994 0.359540 Li\n0.700163 0.506967 0.617288 Li\n0.003643 0.010027 0.001405 Os\n0.152284 0.780033 0.229752 O\n0.545008 0.632195 0.794962 O\n0.116286 0.901181 0.739742 O\n0.855084 0.090276 0.238663 O\n0.470972 0.373434 0.223858 O\n0.839651 0.235004 0.758972 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Li",
"Os",
"O"
],
"chemical_system": "Li-O-Os",
"density": 4.470451198932205,
"density_atomic": 0.1125712440003228,
"volume": 124.36568614236737,
"volume_molar": 5.349626197595126,
"formula_full": "Li7 Os1 O6",
"formula_reduced": "Li7OsO6",
"formula_anonymous": "AB6C7",
"energy_above_hull": 2.097089,
"spacegroup": 1
},
{
"id": "jvasp-108718",
"created_at": "2022-09-04T14:38:17.400584Z",
"updated_at": "2022-09-04T14:38:17.400605Z",
"structure_string": "Zn1 Cu2 Sn1 Se1 S3\n1.0\n5.048469 0.001295 -2.266345\n-1.004475 4.938192 -2.267540\n-0.007184 0.008771 6.782914\nZn Cu Sn Se S\n1 2 1 1 3\ndirect\n0.245914 0.763635 0.504803 Zn\n0.977505 0.980767 0.983893 Cu\n0.773393 0.246137 0.514141 Cu\n0.503694 0.506272 0.998536 Sn\n0.369721 0.358712 0.261288 Se\n0.888718 0.898307 0.257427 S\n0.106995 0.631243 0.740140 S\n0.634069 0.114921 0.739767 S\n",
"nsites": 8,
"nelements": 5,
"elements": [
"Zn",
"Cu",
"Sn",
"Se",
"S"
],
"chemical_system": "Cu-S-Se-Sn-Zn",
"density": 4.774665708561909,
"density_atomic": 0.04729559054513124,
"volume": 169.1489609875174,
"volume_molar": 12.73298565593223,
"formula_full": "Zn1 Cu2 Sn1 Se1 S3",
"formula_reduced": "ZnCu2SnSeS3",
"formula_anonymous": "ABCD2E3",
"energy_above_hull": 0.6759432958333333,
"spacegroup": 1
},
{
"id": "jvasp-90436",
"created_at": "2022-09-04T14:38:17.664261Z",
"updated_at": "2022-09-04T14:38:17.664279Z",
"structure_string": "Cr3 O5\n1.0\n4.910930 0.402765 3.006874\n2.112204 4.268385 3.063028\n0.040293 0.097781 5.203730\nCr O\n3 5\ndirect\n0.848613 0.909471 0.801507 Cr\n0.209727 0.098937 0.158751 Cr\n0.280783 0.350723 0.390456 Cr\n0.107282 0.766992 0.406084 O\n0.468167 0.048864 0.752278 O\n0.974412 0.203877 0.574184 O\n0.570074 -0.012993 0.206526 O\n0.140628 0.534991 0.008734 O\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Cr",
"O"
],
"chemical_system": "Cr-O",
"density": 3.7921579671838157,
"density_atomic": 0.07741807331364571,
"volume": 103.33504384162865,
"volume_molar": 7.778727243188236,
"formula_full": "Cr3 O5",
"formula_reduced": "Cr3O5",
"formula_anonymous": "A3B5",
"energy_above_hull": 3.6270312125,
"spacegroup": 1
},
{
"id": "jvasp-109820",
"created_at": "2022-09-04T14:38:17.882937Z",
"updated_at": "2022-09-04T14:38:17.882956Z",
"structure_string": "Li1 V2 O3 F3\n1.0\n4.465502 0.023240 -2.231829\n-2.726529 4.180388 -0.212106\n0.005445 0.014088 5.219047\nLi V O F\n1 2 3 3\ndirect\n0.583214 0.803313 0.343843 Li\n0.994448 0.488408 0.522919 V\n-0.008817 0.019888 -0.011468 V\n0.066622 0.832599 0.735631 O\n0.898261 0.250421 0.749536 O\n0.900138 0.146883 0.254499 O\n0.153190 0.764899 0.264320 F\n0.501473 0.386864 0.237287 F\n0.500429 0.636321 0.755784 F\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Li",
"V",
"O",
"F"
],
"chemical_system": "F-Li-O-V",
"density": 3.626412655169375,
"density_atomic": 0.09192371547531879,
"volume": 97.90726966879913,
"volume_molar": 6.5512373263643,
"formula_full": "Li1 V2 O3 F3",
"formula_reduced": "LiV2(OF)3",
"formula_anonymous": "AB2C3D3",
"energy_above_hull": 1.823904416388889,
"spacegroup": 1
},
{
"id": "jvasp-44136",
"created_at": "2022-09-04T14:38:18.158761Z",
"updated_at": "2022-09-04T14:38:18.158782Z",
"structure_string": "Li2 Mn1 Fe1 B2 O6\n1.0\n5.163435 -0.004354 -0.029034\n-2.563735 4.514180 0.016082\n-2.403981 -1.445578 5.194593\nLi Mn Fe B O\n2 1 1 2 6\ndirect\n0.549800 0.619267 0.315108 Li\n0.451032 0.381055 0.683005 Li\n0.833497 0.248274 0.233708 Mn\n0.161075 0.748269 0.764134 Fe\n0.179748 0.921383 0.258486 B\n0.821176 0.079503 0.742819 B\n0.940865 0.682313 0.306298 O\n0.376092 0.870951 0.179557 O\n0.234259 0.210136 0.297501 O\n0.779317 0.795868 0.706314 O\n0.610418 0.116428 0.811614 O\n0.062713 0.326556 0.701456 O\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Li",
"Mn",
"Fe",
"B",
"O"
],
"chemical_system": "B-Fe-Li-Mn-O",
"density": 3.332717987597595,
"density_atomic": 0.09940471256696444,
"volume": 120.71862279080727,
"volume_molar": 6.058204489996546,
"formula_full": "Li2 Mn1 Fe1 B2 O6",
"formula_reduced": "Li2MnFe(BO3)2",
"formula_anonymous": "ABC2D2E6",
"energy_above_hull": 3.128136575670498,
"spacegroup": 1
},
{
"id": "jvasp-108951",
"created_at": "2022-09-04T14:38:20.126107Z",
"updated_at": "2022-09-04T14:38:20.126129Z",
"structure_string": "Li1 O8\n1.0\n4.250794 0.121262 2.553473\n1.047668 3.982537 2.724543\n0.588955 0.215087 5.902578\nLi O\n1 8\ndirect\n0.437255 0.708051 0.304197 Li\n0.784306 0.353624 0.825390 O\n0.102861 0.279900 0.706336 O\n0.110960 0.659975 0.230522 O\n0.787285 0.729959 0.369160 O\n0.785149 0.239264 0.342831 O\n0.103128 0.848526 0.692181 O\n0.108314 0.190431 0.206982 O\n0.780735 0.918847 0.810491 O\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Li",
"O"
],
"chemical_system": "Li-O",
"density": 2.4497754344208187,
"density_atomic": 0.09839911937207026,
"volume": 91.46423319063334,
"volume_molar": 6.120116519771754,
"formula_full": "Li1 O8",
"formula_reduced": "LiO8",
"formula_anonymous": "AB8",
"energy_above_hull": 2.5850875555555555,
"spacegroup": 1
},
{
"id": "jvasp-109824",
"created_at": "2022-09-04T14:38:20.197384Z",
"updated_at": "2022-09-04T14:38:20.197398Z",
"structure_string": "Li3 V1 O3 F2\n1.0\n3.660295 -0.002281 -0.031646\n1.849956 4.071917 2.632490\n0.017658 0.702204 6.447686\nLi V O F\n3 1 3 2\ndirect\n0.145023 0.705704 0.553394 Li\n0.677682 0.644027 0.914674 Li\n0.810663 0.368306 0.419070 Li\n0.013842 0.021146 0.969830 V\n0.065042 0.863631 0.795252 O\n0.523426 0.944619 0.045659 O\n0.766122 0.468540 0.715935 O\n0.234657 0.520272 0.361813 F\n0.909817 0.171228 0.230627 F\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Li",
"V",
"O",
"F"
],
"chemical_system": "F-Li-O-V",
"density": 2.9328564844719756,
"density_atomic": 0.10076012209192209,
"volume": 89.32105095892423,
"volume_molar": 5.976710463397496,
"formula_full": "Li3 V1 O3 F2",
"formula_reduced": "Li3VO3F2",
"formula_anonymous": "AB2C3D3",
"energy_above_hull": 1.4535272516666669,
"spacegroup": 1
},
{
"id": "jvasp-117307",
"created_at": "2022-09-04T14:38:26.115167Z",
"updated_at": "2022-09-04T14:38:26.115193Z",
"structure_string": "Tc1 Cl6 O6\n1.0\n5.234097 -0.500147 2.758365\n-0.188394 6.035822 1.207440\n-0.309646 0.214372 8.446478\nTc Cl O\n1 6 6\ndirect\n0.001983 0.953655 0.003931 Tc\n0.320357 0.943880 0.728613 Cl\n0.681194 0.953710 0.281598 Cl\n0.936843 0.304704 0.880127 Cl\n0.714507 0.788872 0.935440 Cl\n0.291102 0.116199 0.072006 Cl\n0.073836 0.604510 0.127997 Cl\n0.267806 0.345247 0.427105 O\n0.485522 0.417555 0.312170 O\n0.543738 0.500680 0.645120 O\n0.697944 0.366697 0.603697 O\n-0.037083 0.920757 0.510134 O\n0.086254 0.761529 0.491064 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Tc",
"Cl",
"O"
],
"chemical_system": "Cl-O-Tc",
"density": 2.502075107342663,
"density_atomic": 0.04816205927754655,
"volume": 269.92201319889745,
"volume_molar": 12.50391044389491,
"formula_full": "Tc1 Cl6 O6",
"formula_reduced": "Tc(ClO)6",
"formula_anonymous": "AB6C6",
"energy_above_hull": 1.9199951465384613,
"spacegroup": 1
}
]
}