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=1064",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume&page=1062",
"results": [
{
"id": "jvasp-10359",
"created_at": "2022-09-04T14:36:34.859429Z",
"updated_at": "2022-09-04T14:36:34.859462Z",
"structure_string": "Bi4 O10\n1.0\n10.083326 0.000000 0.000000\n0.000000 5.553368 -2.134861\n0.000000 0.000000 4.269722\nBi O\n4 10\ndirect\n0.188096 0.773531 0.886765 Bi\n0.311904 0.226469 0.613235 Bi\n0.688096 0.226469 0.613235 Bi\n0.811904 0.773531 0.886765 Bi\n0.000000 0.940808 0.970404 O\n0.122577 0.407408 0.703704 O\n0.213800 0.868417 0.434208 O\n0.286200 0.131581 0.065791 O\n0.377423 0.592593 0.796296 O\n0.500000 0.059193 0.529596 O\n0.622578 0.592593 0.796296 O\n0.877423 0.407408 0.703704 O\n0.713800 0.131581 0.065791 O\n0.786201 0.868417 0.434208 O\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Bi",
"O"
],
"chemical_system": "Bi-O",
"density": 6.916904374305708,
"density_atomic": 0.05855556484092937,
"volume": 239.08914614745945,
"volume_molar": 10.284489230630088,
"formula_full": "Bi4 O10",
"formula_reduced": "Bi2O5",
"formula_anonymous": "A2B5",
"energy_above_hull": 2.161256585714286,
"spacegroup": 63
},
{
"id": "jvasp-87069",
"created_at": "2022-09-04T14:36:19.562851Z",
"updated_at": "2022-09-04T14:36:19.562861Z",
"structure_string": "Sr2 Sb4 Pd4\n1.0\n4.720009 -0.000000 -0.000000\n0.000000 4.720009 0.000000\n0.000000 -0.000000 10.731142\nSr Sb Pd\n2 4 4\ndirect\n0.250000 0.250000 0.759302 Sr\n0.750000 0.750000 0.240698 Sr\n0.750000 0.250000 0.500000 Sb\n0.250000 0.750000 0.500000 Sb\n0.250000 0.250000 0.125652 Sb\n0.750000 0.750000 0.874348 Sb\n0.750000 0.250000 0.000000 Pd\n0.250000 0.750000 0.000000 Pd\n0.250000 0.250000 0.371853 Pd\n0.750000 0.750000 0.628147 Pd\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Sr",
"Sb",
"Pd"
],
"chemical_system": "Pd-Sb-Sr",
"density": 7.556669541618387,
"density_atomic": 0.041828125732707964,
"volume": 239.07358565149357,
"volume_molar": 14.397347847912107,
"formula_full": "Sr2 Sb4 Pd4",
"formula_reduced": "Sr(SbPd)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.1221199820000003,
"spacegroup": 129
},
{
"id": "jvasp-85332",
"created_at": "2022-09-04T14:36:08.337788Z",
"updated_at": "2022-09-04T14:36:08.337813Z",
"structure_string": "Li2 Eu4 Si6\n1.0\n4.122574 -0.000416 -1.224386\n-0.550781 7.427260 -1.857321\n0.071809 -0.030981 7.794647\nLi Eu Si\n2 4 6\ndirect\n0.213232 0.240694 0.426459 Li\n0.786768 0.759306 0.573541 Li\n0.618158 0.931657 0.236399 Eu\n0.385461 0.564935 0.770860 Eu\n0.381841 0.068343 0.763601 Eu\n0.614539 0.435064 0.229140 Eu\n0.790074 0.270942 0.580145 Si\n0.950991 0.852276 0.901855 Si\n0.049008 0.147723 0.098144 Si\n0.954093 0.349487 0.908030 Si\n0.209925 0.729058 0.419855 Si\n0.045906 0.650513 0.091969 Si\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Li",
"Eu",
"Si"
],
"chemical_system": "Eu-Li-Si",
"density": 5.489158272948773,
"density_atomic": 0.050196431946365846,
"volume": 239.06081637080948,
"volume_molar": 11.997149053212725,
"formula_full": "Li2 Eu4 Si6",
"formula_reduced": "LiEu2Si3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.3185492999999995,
"spacegroup": 12
},
{
"id": "jvasp-88011",
"created_at": "2022-09-04T14:38:12.130483Z",
"updated_at": "2022-09-04T14:38:12.130507Z",
"structure_string": "W2 Cl4 O4\n1.0\n3.889499 0.000000 0.000000\n0.000000 7.989605 0.000000\n0.000000 0.000000 7.692807\nW Cl O\n2 4 4\ndirect\n0.947930 0.000000 0.485605 W\n0.052071 0.000000 0.985605 W\n0.016746 0.714296 0.452773 Cl\n0.016746 0.285705 0.452773 Cl\n0.983255 0.714296 0.952774 Cl\n0.983255 0.285705 0.952774 Cl\n0.491884 0.000000 0.469394 O\n0.508117 0.000000 0.969394 O\n0.993736 0.000000 0.717456 O\n0.006264 0.000000 0.217455 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"W",
"Cl",
"O"
],
"chemical_system": "Cl-O-W",
"density": 3.983555152452844,
"density_atomic": 0.04183080192140285,
"volume": 239.05829055797926,
"volume_molar": 14.3964267558513,
"formula_full": "W2 Cl4 O4",
"formula_reduced": "W(ClO)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.4218430269999995,
"spacegroup": 26
},
{
"id": "jvasp-90722",
"created_at": "2022-09-04T14:35:46.839091Z",
"updated_at": "2022-09-04T14:35:46.839107Z",
"structure_string": "Pb4 S4\n1.0\n0.000000 -4.025132 0.000000\n-5.923085 0.000000 0.085413\n-0.830947 0.000000 -10.014820\nPb S\n4 4\ndirect\n0.250000 0.262662 0.386577 Pb\n0.750000 0.737340 0.613423 Pb\n0.250000 0.734782 0.100784 Pb\n0.750000 0.265219 0.899216 Pb\n0.250000 0.242338 0.092014 S\n0.750000 0.757663 0.907986 S\n0.750000 0.570052 0.341988 S\n0.250000 0.429949 0.658012 S\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pb",
"S"
],
"chemical_system": "Pb-S",
"density": 6.648102514845417,
"density_atomic": 0.033465662880191094,
"volume": 239.05099470584037,
"volume_molar": 17.994984236707317,
"formula_full": "Pb4 S4",
"formula_reduced": "PbS",
"formula_anonymous": "AB",
"energy_above_hull": 0.4541954099999999,
"spacegroup": 11
},
{
"id": "jvasp-19072",
"created_at": "2022-09-04T14:37:03.170028Z",
"updated_at": "2022-09-04T14:37:03.170048Z",
"structure_string": "Na4 Zn4 F12\n1.0\n5.419848 -0.000000 0.000000\n0.000000 5.647832 0.000000\n0.000000 0.000000 7.808711\nNa Zn F\n4 4 12\ndirect\n0.017744 0.938298 0.750000 Na\n0.517744 0.561701 0.250000 Na\n0.482257 0.438298 0.750000 Na\n0.982257 0.061701 0.250000 Na\n0.500000 0.000000 0.500000 Zn\n0.000000 0.500000 0.500000 Zn\n0.000000 0.500000 0.000000 Zn\n0.500000 0.000000 0.000000 Zn\n0.612300 0.042114 0.750000 F\n0.112300 0.457886 0.250000 F\n0.693385 0.301703 0.058507 F\n0.193384 0.198297 0.941493 F\n0.806616 0.801702 0.441493 F\n0.193384 0.198297 0.558507 F\n0.306616 0.698297 0.941493 F\n0.806616 0.801702 0.058507 F\n0.387700 0.957886 0.250000 F\n0.693385 0.301703 0.441493 F\n0.306616 0.698297 0.558507 F\n0.887700 0.542114 0.750000 F\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Na",
"Zn",
"F"
],
"chemical_system": "F-Na-Zn",
"density": 4.0402411157193585,
"density_atomic": 0.08367231194522509,
"volume": 239.02769667811643,
"volume_molar": 7.1972921746710075,
"formula_full": "Na4 Zn4 F12",
"formula_reduced": "NaZnF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-64125",
"created_at": "2022-09-04T14:36:12.004176Z",
"updated_at": "2022-09-04T14:36:12.004195Z",
"structure_string": "Ba4 V1 Sb1\n1.0\n0.000000 4.925437 4.925437\n4.925437 0.000000 4.925437\n4.925437 4.925437 0.000000\nBa V Sb\n4 1 1\ndirect\n0.126715 0.624428 0.624428 Ba\n0.624428 0.624428 0.624428 Ba\n0.624428 0.126715 0.624428 Ba\n0.624428 0.624428 0.126715 Ba\n0.000000 0.000000 0.000000 V\n0.250000 0.250000 0.250000 Sb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"V",
"Sb"
],
"chemical_system": "Ba-Sb-V",
"density": 5.0168106331476885,
"density_atomic": 0.02510654483869315,
"volume": 238.98151014205078,
"volume_molar": 23.986338218546624,
"formula_full": "Ba4 V1 Sb1",
"formula_reduced": "Ba4VSb",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.0583256966666668,
"spacegroup": 216
},
{
"id": "jvasp-25874",
"created_at": "2022-09-04T14:38:19.941564Z",
"updated_at": "2022-09-04T14:38:19.941575Z",
"structure_string": "Nd4 V4 O12\n1.0\n5.452641 -0.000000 0.000000\n0.000000 5.632001 0.000000\n0.000000 0.000000 7.781693\nNd V O\n4 4 12\ndirect\n0.987762 0.052761 0.250000 Nd\n0.487762 0.447239 0.750000 Nd\n0.512238 0.552761 0.250000 Nd\n0.012238 0.947239 0.750000 Nd\n0.500000 0.000000 0.000000 V\n0.000000 0.500000 0.000000 V\n0.000000 0.500000 0.500000 V\n0.500000 0.000000 0.500000 V\n0.795144 0.793197 0.045393 O\n0.295144 0.706803 0.954607 O\n0.295144 0.706803 0.545393 O\n0.795144 0.793197 0.454607 O\n0.204856 0.206803 0.954607 O\n0.586188 0.023305 0.750000 O\n0.913812 0.523305 0.750000 O\n0.413812 0.976695 0.250000 O\n0.204856 0.206803 0.545393 O\n0.086188 0.476695 0.250000 O\n0.704856 0.293197 0.045393 O\n0.704856 0.293197 0.454607 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Nd",
"V",
"O"
],
"chemical_system": "Nd-O-V",
"density": 6.7592149496162115,
"density_atomic": 0.08369244862535277,
"volume": 238.9701858232099,
"volume_molar": 7.195560482353632,
"formula_full": "Nd4 V4 O12",
"formula_reduced": "NdVO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.19410324,
"spacegroup": 62
},
{
"id": "jvasp-173",
"created_at": "2022-09-04T14:36:45.754861Z",
"updated_at": "2022-09-04T14:36:45.754886Z",
"structure_string": "B2 Br6\n1.0\n3.201310 -5.544831 0.000000\n3.201309 5.544831 0.000000\n0.000000 0.000000 6.731259\nB Br\n2 6\ndirect\n0.333333 0.666667 0.250000 B\n0.666667 0.333333 0.750000 B\n0.044689 0.361042 0.250000 Br\n0.683647 0.044689 0.750000 Br\n0.361042 0.316353 0.750000 Br\n0.638958 0.683647 0.250000 Br\n0.316353 0.955311 0.250000 Br\n0.955311 0.638958 0.750000 Br\n",
"nsites": 8,
"nelements": 2,
"elements": [
"B",
"Br"
],
"chemical_system": "B-Br",
"density": 3.48164448384603,
"density_atomic": 0.03347709099003935,
"volume": 238.96938961573127,
"volume_molar": 17.988841269965203,
"formula_full": "B2 Br6",
"formula_reduced": "BBr3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.9336337245833332,
"spacegroup": 176
},
{
"id": "jvasp-25035",
"created_at": "2022-09-04T14:37:55.024693Z",
"updated_at": "2022-09-04T14:37:55.024702Z",
"structure_string": "Te4 O4 F8\n1.0\n0.000000 5.329418 0.100999\n7.993910 0.000000 0.000000\n0.000000 -0.728147 -5.622764\nTe O F\n4 4 8\ndirect\n0.480402 0.137638 0.645044 Te\n0.884830 0.908660 0.053940 Te\n0.519598 0.637638 0.354955 Te\n0.115169 0.408660 0.946059 Te\n0.302437 0.611872 0.046540 O\n0.622742 0.856619 0.253796 O\n0.697563 0.111872 0.953459 O\n0.377258 0.356619 0.746203 O\n0.362015 0.327670 0.254648 F\n0.637984 0.827670 0.745351 F\n0.030991 0.063124 0.306041 F\n0.221438 0.764171 0.430182 F\n0.969009 0.563124 0.693959 F\n0.808580 0.558746 0.161903 F\n0.778562 0.264171 0.569817 F\n0.191419 0.058746 0.838096 F\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Te",
"O",
"F"
],
"chemical_system": "F-O-Te",
"density": 5.047706713406421,
"density_atomic": 0.06695734664605932,
"volume": 238.9580949880973,
"volume_molar": 8.993995523498578,
"formula_full": "Te4 O4 F8",
"formula_reduced": "TeOF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3056929579166666,
"spacegroup": 4
},
{
"id": "jvasp-29461",
"created_at": "2022-09-04T14:36:59.214816Z",
"updated_at": "2022-09-04T14:36:59.214827Z",
"structure_string": "Te4 O4 F8\n1.0\n5.328748 -0.111635 0.000000\n-0.716227 5.624634 0.000000\n0.000000 0.000000 7.993949\nTe O F\n4 4 8\ndirect\n0.519616 0.354992 0.137652 Te\n0.115199 0.946150 0.908654 Te\n0.480384 0.645008 0.637652 Te\n0.884801 0.053850 0.408654 Te\n0.697521 0.953400 0.611860 O\n0.377245 0.746194 0.856628 O\n0.302479 0.046601 0.111860 O\n0.622755 0.253806 0.356628 O\n0.637870 0.745369 0.327626 F\n0.362130 0.254631 0.827626 F\n0.968995 0.694111 0.063128 F\n0.778558 0.569782 0.764183 F\n0.031005 0.305889 0.563128 F\n0.191332 0.838033 0.558771 F\n0.221441 0.430218 0.264183 F\n0.808668 0.161967 0.058771 F\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Te",
"O",
"F"
],
"chemical_system": "F-O-Te",
"density": 5.047718624854641,
"density_atomic": 0.0669575046502804,
"volume": 238.95753110227346,
"volume_molar": 8.993974299749805,
"formula_full": "Te4 O4 F8",
"formula_reduced": "TeOF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3056929579166666,
"spacegroup": 4
},
{
"id": "jvasp-56662",
"created_at": "2022-09-04T14:38:35.036771Z",
"updated_at": "2022-09-04T14:38:35.036797Z",
"structure_string": "Ca4 Mn2 Sb2 O12\n1.0\n0.000000 5.520622 -0.042725\n7.699176 0.000000 0.000000\n0.000000 -0.318724 -5.619225\nCa Mn Sb O\n4 2 2 12\ndirect\n0.479522 0.750000 0.437316 Ca\n0.520478 0.250000 0.562682 Ca\n0.996254 0.750000 0.959726 Ca\n0.003747 0.250000 0.040272 Ca\n0.500000 0.500000 -0.000000 Mn\n0.500000 0.000000 -0.000000 Mn\n0.000000 0.500000 0.500000 Sb\n0.000000 0.000000 0.500000 Sb\n0.301718 0.548993 0.704875 O\n0.581014 0.750000 0.031890 O\n0.698282 0.048993 0.295124 O\n0.105805 0.250000 0.461896 O\n0.186931 0.949569 0.215896 O\n0.813069 0.050432 0.784103 O\n0.186931 0.550432 0.215896 O\n0.301718 0.951007 0.704875 O\n0.894195 0.750000 0.538102 O\n0.698282 0.451007 0.295124 O\n0.813069 0.449568 0.784103 O\n0.418987 0.250000 0.968108 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Ca",
"Mn",
"Sb",
"O"
],
"chemical_system": "Ca-Mn-O-Sb",
"density": 4.904226072706395,
"density_atomic": 0.08370101315560537,
"volume": 238.94573370120096,
"volume_molar": 7.194824211750539,
"formula_full": "Ca4 Mn2 Sb2 O12",
"formula_reduced": "Ca2MnSbO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.0892915181379306,
"spacegroup": 11
}
]
}