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=351",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=349",
"results": [
{
"id": "jvasp-20799",
"created_at": "2022-09-04T14:38:08.621883Z",
"updated_at": "2022-09-04T14:38:08.621910Z",
"structure_string": "Al8 Mo3\n1.0\n3.662114 0.000000 0.000000\n-1.831057 4.546541 -0.860720\n0.000000 0.010072 10.113218\nAl Mo\n8 3\ndirect\n0.272361 0.544724 0.909889 Al\n0.727636 0.455276 0.090112 Al\n0.460357 0.920717 0.179108 Al\n0.539640 0.079282 0.820892 Al\n0.186680 0.373361 0.278262 Al\n0.813318 0.626638 0.721738 Al\n0.368695 0.737393 0.541523 Al\n0.631303 0.262607 0.458477 Al\n0.000000 0.000000 0.000000 Mo\n0.094682 0.189365 0.659684 Mo\n0.905315 0.810634 0.340316 Mo\n",
"nsites": 11,
"nelements": 2,
"elements": [
"Al",
"Mo"
],
"chemical_system": "Al-Mo",
"density": 4.96607137122633,
"density_atomic": 0.0653143290598008,
"volume": 168.41633617530647,
"volume_molar": 9.220244388465233,
"formula_full": "Al8 Mo3",
"formula_reduced": "Al8Mo3",
"formula_anonymous": "A3B8",
"energy_above_hull": 3.4329154636363635,
"spacegroup": 12
},
{
"id": "jvasp-31819",
"created_at": "2022-09-04T14:38:15.169225Z",
"updated_at": "2022-09-04T14:38:15.169253Z",
"structure_string": "Ge12 Cl32\n1.0\n10.602214 0.000000 6.121190\n3.534071 9.995862 6.121190\n0.000000 0.000000 12.242382\nGe Cl\n12 32\ndirect\n0.000000 0.000000 0.000000 Ge\n0.667814 0.667815 0.667815 Ge\n0.996555 0.667815 0.667815 Ge\n0.667814 0.667815 0.996555 Ge\n0.167815 0.167815 0.167815 Ge\n0.167815 0.496555 0.167815 Ge\n0.496555 0.167815 0.167815 Ge\n0.667814 0.996555 0.667815 Ge\n0.250000 0.250000 0.250000 Ge\n0.750000 0.750000 0.750000 Ge\n0.167815 0.167815 0.496555 Ge\n0.500000 0.500000 0.500000 Ge\n0.169812 0.293015 0.571429 Cl\n0.669811 0.071429 0.793015 Cl\n0.071429 0.669811 0.465743 Cl\n0.669811 0.793015 0.465743 Cl\n0.071429 0.465743 0.793015 Cl\n0.465743 0.793015 0.071429 Cl\n0.169812 0.965743 0.293015 Cl\n0.965743 0.169812 0.571429 Cl\n0.965743 0.293015 0.169812 Cl\n0.571429 0.169812 0.293015 Cl\n0.293015 0.965743 0.571429 Cl\n0.428760 0.428760 0.713718 Cl\n0.965743 0.571429 0.293015 Cl\n0.571429 0.293015 0.965743 Cl\n0.293015 0.571429 0.169812 Cl\n0.293015 0.169812 0.965743 Cl\n0.169812 0.571429 0.965743 Cl\n0.071429 0.793015 0.669812 Cl\n0.669811 0.465743 0.071429 Cl\n0.465743 0.669811 0.793015 Cl\n0.793015 0.071429 0.465743 Cl\n0.793015 0.669811 0.071430 Cl\n0.465743 0.071429 0.669812 Cl\n0.928760 0.928760 0.213718 Cl\n0.428760 0.713717 0.428761 Cl\n0.428760 0.428760 0.428761 Cl\n0.713717 0.428760 0.428761 Cl\n0.213717 0.928760 0.928760 Cl\n0.928760 0.213717 0.928761 Cl\n0.928760 0.928760 0.928761 Cl\n0.793015 0.465743 0.669812 Cl\n0.571429 0.965743 0.169812 Cl\n",
"nsites": 44,
"nelements": 2,
"elements": [
"Ge",
"Cl"
],
"chemical_system": "Cl-Ge",
"density": 2.5676473957495975,
"density_atomic": 0.03391329065656174,
"volume": 1297.4264410253159,
"volume_molar": 17.757465121818843,
"formula_full": "Ge12 Cl32",
"formula_reduced": "Ge3Cl8",
"formula_anonymous": "A3B8",
"energy_above_hull": 0.2790454899999999,
"spacegroup": 219
},
{
"id": "jvasp-59575",
"created_at": "2022-09-04T14:37:56.702247Z",
"updated_at": "2022-09-04T14:37:56.702266Z",
"structure_string": "W3 O8\n1.0\n3.818527 0.000000 0.000000\n0.000000 5.482356 -2.750718\n0.000000 0.042745 6.133583\nW O\n3 8\ndirect\n0.000000 0.684648 0.315352 W\n0.000000 0.315352 0.684647 W\n0.000000 0.000000 0.000000 W\n0.000001 0.960479 0.663545 O\n0.000001 0.039520 0.336454 O\n0.000000 0.663546 0.960478 O\n0.000000 0.500000 0.500000 O\n0.499999 0.000000 0.000000 O\n0.000000 0.336455 0.039521 O\n0.499999 0.690478 0.309523 O\n0.499999 0.309523 0.690477 O\n",
"nsites": 11,
"nelements": 2,
"elements": [
"W",
"O"
],
"chemical_system": "O-W",
"density": 8.756993121568385,
"density_atomic": 0.08536884789880653,
"volume": 128.85262330164096,
"volume_molar": 7.054260316524889,
"formula_full": "W3 O8",
"formula_reduced": "W3O8",
"formula_anonymous": "A3B8",
"energy_above_hull": 4.523557090909091,
"spacegroup": 65
},
{
"id": "jvasp-57874",
"created_at": "2022-09-04T14:37:57.269921Z",
"updated_at": "2022-09-04T14:37:57.269943Z",
"structure_string": "U3 O8\n1.0\n4.162867 0.000000 0.000000\n0.000000 6.097631 -3.424054\n0.000000 -0.205561 6.775357\nU O\n3 8\ndirect\n0.000000 0.681666 0.363331 U\n0.000000 0.318334 0.636670 U\n0.000000 0.000000 0.000000 U\n0.000002 0.332717 0.295171 O\n0.000002 0.667283 0.704830 O\n0.999999 0.037546 0.704829 O\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.000000 O\n0.500000 0.314128 0.628256 O\n0.500000 0.685872 0.371746 O\n0.999999 0.962454 0.295172 O\n",
"nsites": 11,
"nelements": 2,
"elements": [
"U",
"O"
],
"chemical_system": "O-U",
"density": 8.271424832088828,
"density_atomic": 0.06506831598439995,
"volume": 169.0530918709689,
"volume_molar": 9.255104683274423,
"formula_full": "U3 O8",
"formula_reduced": "U3O8",
"formula_anonymous": "A3B8",
"energy_above_hull": 3.7824014545454543,
"spacegroup": 65
},
{
"id": "jvasp-30644",
"created_at": "2022-09-04T14:37:31.370582Z",
"updated_at": "2022-09-04T14:37:31.370612Z",
"structure_string": "Mo3 O8\n1.0\n4.459067 -0.424794 -2.181276\n-0.889866 5.288795 -2.849075\n-0.791787 -0.061977 6.604609\nMo O\n3 8\ndirect\n0.499999 0.999998 -0.000000 Mo\n0.999999 0.708949 -0.000000 Mo\n0.999999 0.291052 -0.000000 Mo\n-0.027497 0.370867 0.741736 O\n0.027495 0.629131 0.258264 O\n0.020789 0.890897 0.781797 O\n0.979209 0.109101 0.218201 O\n0.465288 0.334127 0.211462 O\n0.465287 0.877334 0.211462 O\n0.534712 0.122664 0.788538 O\n0.534712 0.665872 0.788538 O\n",
"nsites": 11,
"nelements": 2,
"elements": [
"Mo",
"O"
],
"chemical_system": "Mo-O",
"density": 4.853621827503214,
"density_atomic": 0.07732308303363407,
"volume": 142.26023547477033,
"volume_molar": 7.788283296180111,
"formula_full": "Mo3 O8",
"formula_reduced": "Mo3O8",
"formula_anonymous": "A3B8",
"energy_above_hull": 3.926616881818181,
"spacegroup": 12
},
{
"id": "jvasp-12067",
"created_at": "2022-09-04T14:38:00.020480Z",
"updated_at": "2022-09-04T14:38:00.020507Z",
"structure_string": "Cr6 O16\n1.0\n5.629474 0.000000 0.000000\n-2.814737 4.875267 -0.000000\n-0.000000 -0.000000 8.870815\nCr O\n6 16\ndirect\n0.665863 0.832933 0.250074 Cr\n0.832933 0.167069 0.750074 Cr\n0.167068 0.334138 0.250074 Cr\n0.832931 0.665864 0.750074 Cr\n0.334138 0.167069 0.750074 Cr\n0.167068 0.832933 0.250074 Cr\n0.970358 0.485180 0.856668 O\n0.333333 0.666666 0.131778 O\n0.000000 0.000000 0.867632 O\n0.000000 0.000000 0.367632 O\n0.514819 0.029641 0.856668 O\n0.485180 0.970361 0.356667 O\n0.029640 0.514820 0.356667 O\n0.304906 0.152453 0.145170 O\n0.152453 0.847548 0.645169 O\n0.485179 0.514820 0.356667 O\n0.847546 0.695094 0.145170 O\n0.152453 0.304907 0.645169 O\n0.695093 0.847548 0.645169 O\n0.847547 0.152453 0.145170 O\n0.514819 0.485180 0.856668 O\n0.666666 0.333334 0.631778 O\n",
"nsites": 22,
"nelements": 2,
"elements": [
"Cr",
"O"
],
"chemical_system": "Cr-O",
"density": 3.8738469229592347,
"density_atomic": 0.09036347747984258,
"volume": 243.46119265836742,
"volume_molar": 6.6643525990280335,
"formula_full": "Cr6 O16",
"formula_reduced": "Cr3O8",
"formula_anonymous": "A3B8",
"energy_above_hull": 3.5688336545454544,
"spacegroup": 186
},
{
"id": "jvasp-97632",
"created_at": "2022-09-04T14:37:52.260047Z",
"updated_at": "2022-09-04T14:37:52.260069Z",
"structure_string": "U12 O32\n1.0\n6.978941 0.000000 -0.058116\n0.000000 8.320537 0.000000\n0.096910 0.000000 11.630198\nU O\n12 32\ndirect\n0.498727 0.250000 0.180958 U\n0.503960 0.250000 0.499999 U\n0.001272 0.750000 0.319041 U\n0.496040 0.750000 0.500001 U\n0.501275 0.750000 0.180963 U\n-0.001272 0.250000 0.680959 U\n0.498725 0.250000 0.819036 U\n-0.001275 0.250000 0.319039 U\n0.501273 0.750000 0.819042 U\n0.001275 0.750000 0.680961 U\n0.003965 0.250000 -0.000001 U\n0.996035 0.750000 0.000001 U\n0.308931 0.250000 0.358179 O\n0.808928 0.250000 0.858185 O\n0.320454 0.750000 0.346944 O\n-0.000014 -0.000014 0.315300 O\n0.500010 0.499988 0.184701 O\n0.975845 0.250000 0.499988 O\n0.320458 0.750000 0.653054 O\n0.179548 0.250000 0.153054 O\n0.000000 0.000000 0.000000 O\n0.820458 0.750000 0.153059 O\n0.500010 0.000013 0.184701 O\n-0.000014 0.500014 0.315300 O\n0.500000 0.000000 0.500000 O\n0.679542 0.250000 0.346946 O\n0.475844 0.250000 -0.000010 O\n0.308938 0.250000 0.641818 O\n0.000014 0.499986 0.684700 O\n0.691062 0.750000 0.358182 O\n0.499989 -0.000013 0.815299 O\n0.191055 0.750000 0.858180 O\n0.808945 0.250000 0.141820 O\n0.191072 0.750000 0.141815 O\n0.499989 0.500013 0.815299 O\n0.179542 0.250000 0.846941 O\n0.820452 0.750000 0.846946 O\n0.024155 0.750000 0.500012 O\n0.679546 0.250000 0.653056 O\n0.500000 0.500000 0.500000 O\n0.524156 0.750000 0.000009 O\n0.000014 0.000014 0.684700 O\n0.691069 0.750000 0.641820 O\n0.000000 0.500000 0.000000 O\n",
"nsites": 44,
"nelements": 2,
"elements": [
"U",
"O"
],
"chemical_system": "O-U",
"density": 8.281429543757223,
"density_atomic": 0.06514701944279885,
"volume": 675.3954421296801,
"volume_molar": 9.243923684471289,
"formula_full": "U12 O32",
"formula_reduced": "U3O8",
"formula_anonymous": "A3B8",
"energy_above_hull": 3.7801014545454543,
"spacegroup": 63
},
{
"id": "jvasp-30122",
"created_at": "2022-09-04T14:38:13.870960Z",
"updated_at": "2022-09-04T14:38:13.870995Z",
"structure_string": "Mo6 O16\n1.0\n2.987804 -5.353174 -0.107298\n2.619433 5.353174 -1.441199\n2.241433 5.307494 8.116426\nMo O\n6 16\ndirect\n0.764682 0.777479 0.272253 Mo\n0.773502 0.226496 0.801035 Mo\n0.222520 0.235316 0.272254 Mo\n0.777480 0.764682 0.727743 Mo\n0.235317 0.222517 0.727744 Mo\n0.226498 0.773501 0.198967 Mo\n0.856154 0.143844 0.636848 O\n0.143847 0.856152 0.363156 O\n0.397886 0.602112 0.642284 O\n0.148397 0.388663 0.355999 O\n0.611335 0.851602 0.355998 O\n0.388661 0.148395 0.644000 O\n0.851603 0.611337 0.644000 O\n0.119139 0.354524 0.864543 O\n0.880857 0.645470 0.135457 O\n0.632792 0.367206 0.869132 O\n0.354529 0.119141 0.135457 O\n0.105317 0.894681 0.876631 O\n0.894681 0.105317 0.123368 O\n0.645473 0.880859 0.864543 O\n0.602109 0.397889 0.357713 O\n0.367207 0.632791 0.130868 O\n",
"nsites": 22,
"nelements": 2,
"elements": [
"Mo",
"O"
],
"chemical_system": "Mo-O",
"density": 4.869901313433991,
"density_atomic": 0.07758243163702905,
"volume": 283.5693537285276,
"volume_molar": 7.762248015342836,
"formula_full": "Mo6 O16",
"formula_reduced": "Mo3O8",
"formula_anonymous": "A3B8",
"energy_above_hull": 3.927094154545454,
"spacegroup": 12
},
{
"id": "jvasp-5743",
"created_at": "2022-09-04T14:38:11.198292Z",
"updated_at": "2022-09-04T14:38:11.198319Z",
"structure_string": "Nb6 Cl16\n1.0\n3.396649 -5.883168 0.000000\n3.396649 5.883168 0.000000\n0.000000 0.000000 12.282825\nNb Cl\n6 16\ndirect\n0.527895 0.055791 0.746319 Nb\n0.944209 0.472105 0.746319 Nb\n0.527895 0.472105 0.746319 Nb\n0.472105 0.944209 0.253682 Nb\n0.472105 0.527895 0.253682 Nb\n0.055791 0.527895 0.253682 Nb\n0.167863 0.832137 0.118677 Cl\n0.832137 0.664274 0.881324 Cl\n0.832137 0.167863 0.881324 Cl\n0.335727 0.167863 0.881324 Cl\n0.835834 0.671668 0.364327 Cl\n0.328332 0.164166 0.364327 Cl\n0.835834 0.164166 0.364327 Cl\n0.671668 0.835834 0.635673 Cl\n0.164166 0.835834 0.635673 Cl\n0.664274 0.832137 0.118677 Cl\n0.666667 0.333333 0.142824 Cl\n0.333333 0.666667 0.857176 Cl\n0.333333 0.666667 0.404646 Cl\n0.666667 0.333333 0.595354 Cl\n0.164166 0.328332 0.635673 Cl\n0.167863 0.335727 0.118677 Cl\n",
"nsites": 22,
"nelements": 2,
"elements": [
"Nb",
"Cl"
],
"chemical_system": "Cl-Nb",
"density": 3.804436275425047,
"density_atomic": 0.044815938980023826,
"volume": 490.8967769214038,
"volume_molar": 13.437497678413697,
"formula_full": "Nb6 Cl16",
"formula_reduced": "Nb3Cl8",
"formula_anonymous": "A3B8",
"energy_above_hull": 1.778399158181818,
"spacegroup": 164
},
{
"id": "jvasp-60621",
"created_at": "2022-09-04T14:35:59.482334Z",
"updated_at": "2022-09-04T14:35:59.482355Z",
"structure_string": "Au6 F16\n1.0\n0.000000 5.260150 0.072684\n10.830694 0.000000 0.000000\n0.000000 -5.131250 -5.799724\nAu F\n6 16\ndirect\n0.638833 0.320024 0.955434 Au\n0.361167 0.820024 0.544565 Au\n0.361167 0.679975 0.044566 Au\n0.638833 0.179976 0.455435 Au\n0.500000 0.000000 0.000000 Au\n0.500000 0.500000 0.500000 Au\n0.919135 0.231916 0.250235 F\n0.080866 0.731916 0.249765 F\n0.080865 0.768083 0.749765 F\n0.919134 0.268083 0.750235 F\n0.448974 0.156148 0.799602 F\n0.551025 0.656148 0.700398 F\n0.551026 0.843851 0.200398 F\n0.673771 0.902995 0.856682 F\n0.326229 0.402995 0.643318 F\n0.673771 0.597005 0.356682 F\n0.841619 0.022202 0.608233 F\n0.158380 0.522202 0.891766 F\n0.158381 0.977798 0.391767 F\n0.841620 0.477798 0.108234 F\n0.448975 0.343851 0.299602 F\n0.326229 0.097005 0.143318 F\n",
"nsites": 22,
"nelements": 2,
"elements": [
"Au",
"F"
],
"chemical_system": "Au-F",
"density": 7.559309651630034,
"density_atomic": 0.06740669039586487,
"volume": 326.37709804173403,
"volume_molar": 8.934040114762011,
"formula_full": "Au6 F16",
"formula_reduced": "Au3F8",
"formula_anonymous": "A3B8",
"energy_above_hull": 0.1744608354545454,
"spacegroup": 14
},
{
"id": "jvasp-22453",
"created_at": "2022-09-04T14:38:31.153167Z",
"updated_at": "2022-09-04T14:38:31.153194Z",
"structure_string": "Ir3 Se8\n1.0\n6.056862 -0.006231 -0.039707\n-0.039927 6.056734 -0.039707\n-0.006196 -0.006231 6.056989\nIr Se\n3 8\ndirect\n0.499999 0.000000 0.500000 Ir\n-0.000001 0.500000 0.500000 Ir\n0.500000 0.500000 -0.000000 Ir\n0.379560 0.115765 0.879052 Se\n0.115764 0.879051 0.379560 Se\n0.879051 0.379561 0.115764 Se\n0.373438 0.373439 0.373439 Se\n0.626560 0.626561 0.626561 Se\n0.120947 0.620439 0.884235 Se\n0.884234 0.120948 0.620439 Se\n0.620439 0.884234 0.120947 Se\n",
"nsites": 11,
"nelements": 2,
"elements": [
"Ir",
"Se"
],
"chemical_system": "Ir-Se",
"density": 9.030272577595428,
"density_atomic": 0.04950607891419228,
"volume": 222.19493527382852,
"volume_molar": 12.164447057982587,
"formula_full": "Ir3 Se8",
"formula_reduced": "Ir3Se8",
"formula_anonymous": "A3B8",
"energy_above_hull": 2.72385093030303,
"spacegroup": 148
},
{
"id": "jvasp-30634",
"created_at": "2022-09-04T14:37:28.044885Z",
"updated_at": "2022-09-04T14:37:28.044906Z",
"structure_string": "W3 O8\n1.0\n4.611859 -0.396860 -2.177143\n-0.897274 5.332827 -2.872794\n-0.785637 -0.134174 6.522553\nW O\n3 8\ndirect\n0.500001 1.000000 0.000002 W\n1.000000 0.720617 0.000002 W\n1.000000 0.279384 0.000001 W\n-0.032326 0.372335 0.744669 O\n0.032327 0.627666 0.255332 O\n0.022776 0.890563 0.781124 O\n0.977225 0.109437 0.218877 O\n0.457998 0.332481 0.211245 O\n0.457999 0.878764 0.211246 O\n0.542003 0.121237 0.788756 O\n0.542004 0.667520 0.788756 O\n",
"nsites": 11,
"nelements": 2,
"elements": [
"W",
"O"
],
"chemical_system": "O-W",
"density": 7.726510089767404,
"density_atomic": 0.07532303103189053,
"volume": 146.037670673964,
"volume_molar": 7.995085536919411,
"formula_full": "W3 O8",
"formula_reduced": "W3O8",
"formula_anonymous": "A3B8",
"energy_above_hull": 4.555870727272727,
"spacegroup": 12
}
]
}