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=nsites&page=3563",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nsites&page=3561",
"results": [
{
"id": "jvasp-10166",
"created_at": "2022-09-04T14:37:16.626182Z",
"updated_at": "2022-09-04T14:37:16.626217Z",
"structure_string": "Mg2 Sn4 O8\n1.0\n3.199064 0.011789 0.087853\n-1.575329 6.605857 -0.126846\n-1.350047 -1.698483 9.174733\nMg Sn O\n2 4 8\ndirect\n0.541677 0.178294 0.779768 Mg\n0.493681 0.854772 0.242118 Mg\n0.285227 0.629766 0.886878 Sn\n0.193025 0.238373 0.442155 Sn\n0.842345 0.794691 0.579732 Sn\n0.750198 0.403296 0.135006 Sn\n0.360147 0.548182 0.249627 O\n0.362011 0.873891 0.788202 O\n0.673375 0.159170 0.233679 O\n0.675271 0.484882 0.772257 O\n0.876352 0.707413 0.050208 O\n0.957254 0.118915 0.642661 O\n0.159063 0.325652 0.971676 O\n0.078112 0.914151 0.379225 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mg",
"Sn",
"O"
],
"chemical_system": "Mg-O-Sn",
"density": 5.564921352782878,
"density_atomic": 0.0720211548153508,
"volume": 194.3873301656085,
"volume_molar": 8.361627601556346,
"formula_full": "Mg2 Sn4 O8",
"formula_reduced": "Mg(SnO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.299388064285714,
"spacegroup": 2
},
{
"id": "jvasp-42446",
"created_at": "2022-09-04T14:37:29.295305Z",
"updated_at": "2022-09-04T14:37:29.295332Z",
"structure_string": "Li4 Fe2 F8\n1.0\n4.888565 0.113154 0.059211\n0.270623 5.893052 0.095586\n0.289130 2.317463 5.418777\nLi Fe F\n4 2 8\ndirect\n0.927262 0.941065 0.941029 Li\n0.415479 0.054508 0.054495 Li\n0.384876 0.787799 0.787920 Li\n0.825795 0.211887 0.211636 Li\n0.838099 0.575895 0.575834 Fe\n0.243888 0.415859 0.415837 Fe\n0.759381 0.781616 0.781838 F\n0.736726 0.884783 0.273392 F\n0.247833 0.620996 0.621012 F\n0.736705 0.273346 0.884645 F\n0.247650 0.731192 0.110453 F\n0.687860 0.391783 0.391647 F\n0.247656 0.110406 0.731071 F\n0.200792 0.218992 0.218755 F\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Li",
"Fe",
"F"
],
"chemical_system": "F-Fe-Li",
"density": 3.1263345735865458,
"density_atomic": 0.09044059420843537,
"volume": 154.79774455854056,
"volume_molar": 6.658670050443251,
"formula_full": "Li4 Fe2 F8",
"formula_reduced": "Li2FeF4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.3166323757142856,
"spacegroup": 8
},
{
"id": "jvasp-59889",
"created_at": "2022-09-04T14:37:16.987688Z",
"updated_at": "2022-09-04T14:37:16.987731Z",
"structure_string": "Li2 Mn4 S8\n1.0\n6.873765 -0.010862 -0.009338\n-3.427665 5.927331 -0.002016\n-3.432447 -1.943318 5.596811\nLi Mn S\n2 4 8\ndirect\n0.000003 0.999997 0.000004 Li\n0.500005 0.500007 0.500013 Li\n0.000001 0.999999 0.500004 Mn\n0.500003 0.000002 0.000007 Mn\n0.500003 0.000000 0.500005 Mn\n0.000001 0.499998 0.500004 Mn\n0.014772 0.757179 0.272374 S\n0.016613 0.756564 0.743432 S\n0.485230 0.227634 0.742821 S\n0.516612 0.243426 0.256570 S\n0.514773 0.772365 0.257187 S\n0.983391 0.243435 0.256576 S\n0.483393 0.756577 0.743443 S\n0.985231 0.242819 0.727635 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Li",
"Mn",
"S"
],
"chemical_system": "Li-Mn-S",
"density": 3.576983102577644,
"density_atomic": 0.0615266283075083,
"volume": 227.54375438921187,
"volume_molar": 9.787860842790728,
"formula_full": "Li2 Mn4 S8",
"formula_reduced": "Li(MnS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.614794926108374,
"spacegroup": 74
},
{
"id": "jvasp-58257",
"created_at": "2022-09-04T14:37:16.987516Z",
"updated_at": "2022-09-04T14:37:16.987537Z",
"structure_string": "Fe2 Rh4 S8\n1.0\n6.019812 -0.000000 3.475540\n2.006604 5.675533 3.475540\n-0.000000 -0.000000 6.951080\nFe Rh S\n2 4 8\ndirect\n0.874999 0.875000 0.875001 Fe\n0.125000 0.125000 0.125000 Fe\n0.500000 0.500000 0.000000 Rh\n0.500000 0.500000 0.500000 Rh\n-0.000000 0.500000 0.500000 Rh\n0.500000 0.000000 0.500000 Rh\n0.743059 0.743059 0.743060 S\n0.256940 0.256940 0.729180 S\n0.256940 0.729180 0.256941 S\n0.729180 0.256940 0.256940 S\n0.743059 0.270820 0.743060 S\n0.270819 0.743059 0.743060 S\n0.256940 0.256940 0.256940 S\n0.743059 0.743059 0.270820 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Fe",
"Rh",
"S"
],
"chemical_system": "Fe-Rh-S",
"density": 5.452658282358876,
"density_atomic": 0.05895032005027966,
"volume": 237.48810842857475,
"volume_molar": 10.215620127021568,
"formula_full": "Fe2 Rh4 S8",
"formula_reduced": "Fe(RhS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.668320214285714,
"spacegroup": 227
},
{
"id": "jvasp-11597",
"created_at": "2022-09-04T14:37:14.777981Z",
"updated_at": "2022-09-04T14:37:14.778005Z",
"structure_string": "Al5 Cu1 S8\n1.0\n7.079127 0.000000 0.000000\n3.539564 6.130704 0.000000\n3.539564 2.043568 5.780083\nAl Cu S\n5 1 8\ndirect\n0.019659 0.493447 0.493447 Al\n0.493447 0.493447 0.019660 Al\n0.493447 0.019660 0.493447 Al\n0.493447 0.493447 0.493447 Al\n0.875000 0.875000 0.875000 Al\n0.125000 0.125000 0.125000 Cu\n0.256929 0.256929 0.256929 S\n0.256929 0.729213 0.256929 S\n0.256928 0.256929 0.729212 S\n0.729213 0.256929 0.256929 S\n0.274885 0.741705 0.741704 S\n0.741705 0.741705 0.274885 S\n0.741705 0.274886 0.741704 S\n0.741705 0.741705 0.741704 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"Cu",
"S"
],
"chemical_system": "Al-Cu-S",
"density": 3.0116968649485947,
"density_atomic": 0.05580895736495781,
"volume": 250.85578840773212,
"volume_molar": 10.790634773229565,
"formula_full": "Al5 Cu1 S8",
"formula_reduced": "Al5CuS8",
"formula_anonymous": "AB5C8",
"energy_above_hull": 1.9630310321428572,
"spacegroup": 216
},
{
"id": "jvasp-11606",
"created_at": "2022-09-04T14:37:14.769852Z",
"updated_at": "2022-09-04T14:37:14.769878Z",
"structure_string": "Al4 Ni2 O8\n1.0\n5.754153 0.001938 0.006516\n-2.875470 -4.983650 0.059828\n-2.872240 1.599837 -4.722386\nAl Ni O\n4 2 8\ndirect\n0.499997 -0.000003 -0.000003 Al\n0.499999 0.499999 -0.000003 Al\n-0.000005 0.499996 0.499997 Al\n0.000001 0.500000 0.000002 Al\n0.749982 0.875003 0.624960 Ni\n0.250025 0.125005 0.375049 Ni\n0.028497 0.735775 0.764227 O\n0.971503 0.264224 0.235776 O\n0.028502 0.292729 0.764274 O\n0.971494 0.707265 0.235727 O\n0.471481 0.735722 0.207242 O\n0.471501 0.735770 0.764221 O\n0.528496 0.264229 0.235778 O\n0.528518 0.264280 0.792753 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"Ni",
"O"
],
"chemical_system": "Al-Ni-O",
"density": 4.354769218438912,
"density_atomic": 0.10391791429239647,
"volume": 134.72171853457186,
"volume_molar": 5.795093946030662,
"formula_full": "Al4 Ni2 O8",
"formula_reduced": "Al2NiO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.9302174285714284,
"spacegroup": 227
},
{
"id": "jvasp-10164",
"created_at": "2022-09-04T14:37:14.758159Z",
"updated_at": "2022-09-04T14:37:14.758179Z",
"structure_string": "Zn2 Sb4 O8\n1.0\n3.315330 -0.002165 -0.002015\n-1.653570 6.382929 -0.585428\n-1.653171 -2.005513 9.917621\nZn Sb O\n2 4 8\ndirect\n0.490340 0.733674 0.238913 Zn\n0.490076 0.233264 0.739201 Zn\n0.694619 0.302983 0.078060 Sb\n0.694061 0.802750 0.577713 Sb\n0.286331 0.164184 0.400400 Sb\n0.285839 0.663960 0.900053 Sb\n0.668072 0.562904 0.765453 O\n0.668525 0.063335 0.265671 O\n0.311901 0.903607 0.712444 O\n0.312406 0.404027 0.212659 O\n0.119394 0.340690 0.890190 O\n0.119546 0.840820 0.390240 O\n0.861145 0.626256 0.087931 O\n0.860860 0.126113 0.587870 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Zn",
"Sb",
"O"
],
"chemical_system": "O-Sb-Zn",
"density": 6.0147397431415826,
"density_atomic": 0.06798958981831167,
"volume": 205.91387648332852,
"volume_molar": 8.8574453472847,
"formula_full": "Zn2 Sb4 O8",
"formula_reduced": "Zn(SbO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.6382909428571426,
"spacegroup": 12
},
{
"id": "jvasp-11599",
"created_at": "2022-09-04T14:37:06.333004Z",
"updated_at": "2022-09-04T14:37:06.333030Z",
"structure_string": "Al4 Cu2 O8\n1.0\n4.991425 0.000000 2.881800\n1.663808 4.705960 2.881800\n0.000000 0.000000 5.763602\nAl Cu O\n4 2 8\ndirect\n0.500000 -0.000000 0.500000 Al\n0.000000 0.500000 0.500000 Al\n0.500000 0.500000 0.000000 Al\n0.500000 0.500000 0.500000 Al\n0.125000 0.125000 0.125000 Cu\n0.874999 0.875000 0.875000 Cu\n0.735331 0.735331 0.735331 O\n0.264669 0.264669 0.705993 O\n0.264669 0.705993 0.264669 O\n0.705992 0.264669 0.264669 O\n0.735331 0.294007 0.735331 O\n0.294007 0.735331 0.735331 O\n0.264669 0.264669 0.264669 O\n0.735331 0.735331 0.294007 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"Cu",
"O"
],
"chemical_system": "Al-Cu-O",
"density": 4.452510320254815,
"density_atomic": 0.1034096982809808,
"volume": 135.38382020958755,
"volume_molar": 5.8235744423476365,
"formula_full": "Al4 Cu2 O8",
"formula_reduced": "Al2CuO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.6946100071428571,
"spacegroup": 227
},
{
"id": "jvasp-52380",
"created_at": "2022-09-04T14:37:06.751485Z",
"updated_at": "2022-09-04T14:37:06.751522Z",
"structure_string": "Li6 Bi2 S6\n1.0\n5.433545 3.136901 2.693035\n-5.433383 3.137158 2.693076\n-0.000200 -6.274029 2.692996\nLi Bi S\n6 2 6\ndirect\n0.299821 0.899673 0.527988 Li\n0.399676 0.799819 0.027988 Li\n0.799818 0.027992 0.399673 Li\n0.527991 0.299818 0.899673 Li\n0.899675 0.527990 0.299821 Li\n0.027993 0.399672 0.799823 Li\n0.492531 0.492534 0.492534 Bi\n0.992534 0.992532 0.992535 Bi\n0.073083 0.717238 0.705603 S\n0.217239 0.573085 0.205603 S\n0.205605 0.217239 0.573086 S\n0.717243 0.705605 0.073087 S\n0.573084 0.205604 0.217240 S\n0.705601 0.073084 0.717238 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Li",
"Bi",
"S"
],
"chemical_system": "Bi-Li-S",
"density": 3.931037560745575,
"density_atomic": 0.05083240614765751,
"volume": 275.4148595550037,
"volume_molar": 11.847050368827595,
"formula_full": "Li6 Bi2 S6",
"formula_reduced": "Li3BiS3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 1.2601234714285714,
"spacegroup": 161
},
{
"id": "jvasp-11297",
"created_at": "2022-09-04T14:37:07.582735Z",
"updated_at": "2022-09-04T14:37:07.582776Z",
"structure_string": "Ca2 Cr2 F10\n1.0\n5.552748 0.004056 -0.009514\n1.753652 5.270795 -0.006899\n2.589769 1.867479 6.853434\nCa Cr F\n2 2 10\ndirect\n0.455462 0.543517 0.249792 Ca\n0.545933 0.453172 0.749902 Ca\n0.000700 0.998344 -0.000157 Cr\n0.000686 0.998350 0.499842 Cr\n0.924081 0.076789 0.749360 F\n0.077310 0.919878 0.250327 F\n0.797556 0.741895 0.620484 F\n0.256497 0.202342 0.880970 F\n0.278957 0.690337 0.970955 F\n0.309755 0.721017 0.528122 F\n0.722436 0.306333 0.028752 F\n0.691624 0.275692 0.471563 F\n0.744893 0.794360 0.118693 F\n0.203792 0.254821 0.379203 F\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ca",
"Cr",
"F"
],
"chemical_system": "Ca-Cr-F",
"density": 3.095416262128347,
"density_atomic": 0.0697546033052845,
"volume": 200.70360000082434,
"volume_molar": 8.633323787455002,
"formula_full": "Ca2 Cr2 F10",
"formula_reduced": "CaCrF5",
"formula_anonymous": "ABC5",
"energy_above_hull": 0.1108556046428568,
"spacegroup": 15
},
{
"id": "jvasp-54880",
"created_at": "2022-09-04T14:37:15.780279Z",
"updated_at": "2022-09-04T14:37:15.780303Z",
"structure_string": "Sm6 Te8\n1.0\n7.707780 0.000000 -2.725112\n-3.853891 6.675134 -2.725112\n0.000000 -0.000000 8.175336\nSm Te\n6 8\ndirect\n0.125000 0.750000 0.875000 Sm\n0.625000 0.375000 0.250000 Sm\n0.375000 0.250000 0.625000 Sm\n0.750000 0.874999 0.125000 Sm\n0.250000 0.625000 0.375000 Sm\n0.875000 0.125000 0.750001 Sm\n0.646805 0.646804 0.646805 Te\n-0.000000 0.853195 0.500000 Te\n0.853195 0.500000 0.000000 Te\n-0.000000 0.353195 0.500000 Te\n0.500000 -0.000000 0.853196 Te\n0.500000 -0.000000 0.353195 Te\n0.353195 0.500000 0.000000 Te\n0.146805 0.146805 0.146805 Te\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Sm",
"Te"
],
"chemical_system": "Sm-Te",
"density": 7.591444798994238,
"density_atomic": 0.03328381704973411,
"volume": 420.62483335612006,
"volume_molar": 18.093299668729273,
"formula_full": "Sm6 Te8",
"formula_reduced": "Sm3Te4",
"formula_anonymous": "A3B4",
"energy_above_hull": 1.1374896702380952,
"spacegroup": 220
},
{
"id": "jvasp-48622",
"created_at": "2022-09-04T14:37:06.895798Z",
"updated_at": "2022-09-04T14:37:06.895816Z",
"structure_string": "Li2 Fe2 Si2 O8\n1.0\n0.000000 5.029563 -0.023697\n5.402455 0.000000 0.000000\n0.000000 -4.975554 -6.266187\nLi Fe Si O\n2 2 2 8\ndirect\n0.240485 0.338834 0.756655 Li\n0.240484 0.661167 0.256655 Li\n0.991167 0.167898 0.008483 Fe\n0.991167 0.832103 0.508483 Fe\n0.737558 0.665810 0.759631 Si\n0.737558 0.334191 0.259631 Si\n0.026824 0.828647 0.973211 O\n0.876497 0.380732 0.785424 O\n0.385309 0.667859 0.733321 O\n0.652503 0.782298 0.540120 O\n0.026823 0.171354 0.473211 O\n0.876497 0.619269 0.285424 O\n0.385309 0.332142 0.233321 O\n0.652502 0.217702 0.040119 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Si",
"O"
],
"chemical_system": "Fe-Li-O-Si",
"density": 3.0095210912535277,
"density_atomic": 0.08191841850044014,
"volume": 170.90173682887664,
"volume_molar": 7.351387966514079,
"formula_full": "Li2 Fe2 Si2 O8",
"formula_reduced": "LiFeSiO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.4401225857142856,
"spacegroup": 7
}
]
}