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=-elements&page=501",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=499",
"results": [
{
"id": "jvasp-116983",
"created_at": "2022-09-04T14:38:47.762559Z",
"updated_at": "2022-09-04T14:38:47.762573Z",
"structure_string": "La6 Be2 Ga2 S14\n1.0\n9.931650 -0.000000 0.000000\n-4.965825 8.601061 0.000000\n-0.000000 -0.000000 6.457078\nLa Be Ga S\n6 2 2 14\ndirect\n0.376552 0.211560 0.727154 La\n0.788440 0.164992 0.727154 La\n0.623448 0.788440 0.227154 La\n0.835008 0.623448 0.727154 La\n0.211560 0.835008 0.227154 La\n0.164992 0.376552 0.227154 La\n0.000000 0.000000 0.337770 Be\n0.000000 0.000000 -0.162230 Be\n0.333333 0.666667 0.649713 Ga\n0.666666 0.333333 0.149712 Ga\n0.129804 0.895937 0.810583 S\n0.895937 0.766132 0.310583 S\n0.766132 0.870195 0.810583 S\n0.104063 0.233868 0.810583 S\n0.529189 0.087650 0.008499 S\n0.558461 0.470811 0.008499 S\n0.666666 0.333333 0.504812 S\n0.912349 0.441539 0.008499 S\n0.441538 0.529189 0.508499 S\n0.087650 0.558461 0.508499 S\n0.233868 0.129805 0.310583 S\n0.333333 0.666667 0.004812 S\n0.470810 0.912349 0.508499 S\n0.870195 0.104063 0.310583 S\n",
"nsites": 24,
"nelements": 4,
"elements": [
"La",
"Be",
"Ga",
"S"
],
"chemical_system": "Be-Ga-La-S",
"density": 4.334567564280828,
"density_atomic": 0.04351127155371335,
"volume": 551.5812143153005,
"volume_molar": 13.840415471576945,
"formula_full": "La6 Be2 Ga2 S14",
"formula_reduced": "La3BeGaS7",
"formula_anonymous": "ABC3D7",
"energy_above_hull": 1.90814861875,
"spacegroup": 173
},
{
"id": "jvasp-93497",
"created_at": "2022-09-04T14:35:45.828490Z",
"updated_at": "2022-09-04T14:35:45.828513Z",
"structure_string": "La1 B2 Pt2 C1\n1.0\n3.698321 -0.000000 -1.256805\n-0.427102 3.673576 -1.256805\n-0.006443 -0.007236 6.050848\nLa B Pt C\n1 2 2 1\ndirect\n0.000000 0.000000 0.000000 La\n0.362644 0.362643 0.725288 B\n0.637357 0.637357 0.274711 B\n0.250001 0.750000 0.500000 Pt\n0.750000 0.250000 0.499999 Pt\n0.500000 0.500001 -0.000001 C\n",
"nsites": 6,
"nelements": 4,
"elements": [
"La",
"B",
"Pt",
"C"
],
"chemical_system": "B-C-La-Pt",
"density": 11.37565463826699,
"density_atomic": 0.07304607322055648,
"volume": 82.13993902017846,
"volume_molar": 8.24430457995552,
"formula_full": "La1 B2 Pt2 C1",
"formula_reduced": "LaB2Pt2C",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 3.977075494444444,
"spacegroup": 139
},
{
"id": "jvasp-93304",
"created_at": "2022-09-04T14:36:22.012611Z",
"updated_at": "2022-09-04T14:36:22.012644Z",
"structure_string": "La1 B2 Pd2 C1\n1.0\n3.973180 -0.000000 0.000000\n-0.000000 3.973180 0.000000\n-1.986591 -1.986591 5.167588\nLa B Pd C\n1 2 2 1\ndirect\n0.500000 0.500000 -0.000000 La\n0.142362 0.142362 0.284724 B\n0.857639 0.857639 0.715276 B\n0.250000 0.750000 0.500000 Pd\n0.750000 0.250000 0.500000 Pd\n0.000000 0.000000 0.000000 C\n",
"nsites": 6,
"nelements": 4,
"elements": [
"La",
"B",
"Pd",
"C"
],
"chemical_system": "B-C-La-Pd",
"density": 7.844618813873861,
"density_atomic": 0.07355071314291349,
"volume": 81.5763674288465,
"volume_molar": 8.187739455766547,
"formula_full": "La1 B2 Pd2 C1",
"formula_reduced": "LaB2Pd2C",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 3.6410569277777776,
"spacegroup": 139
},
{
"id": "jvasp-15669",
"created_at": "2022-09-04T14:36:46.839192Z",
"updated_at": "2022-09-04T14:36:46.839218Z",
"structure_string": "La1 B2 Ir2 C1\n1.0\n3.685517 -0.000000 -1.287191\n-0.449560 3.657996 -1.287191\n0.002738 0.003095 5.927670\nLa B Ir C\n1 2 2 1\ndirect\n0.000000 0.000000 0.000000 La\n0.356138 0.356139 0.712276 B\n0.643863 0.643863 0.287725 B\n0.250001 0.750001 0.500001 Ir\n0.750001 0.250001 0.500001 Ir\n0.500000 0.500001 0.000000 C\n",
"nsites": 6,
"nelements": 4,
"elements": [
"La",
"B",
"Ir",
"C"
],
"chemical_system": "B-C-Ir-La",
"density": 11.569041331130483,
"density_atomic": 0.07505264980661652,
"volume": 79.94387960264994,
"volume_molar": 8.023888264460847,
"formula_full": "La1 B2 Ir2 C1",
"formula_reduced": "LaB2Ir2C",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 4.727398727777777,
"spacegroup": 139
},
{
"id": "jvasp-86545",
"created_at": "2022-09-04T14:35:43.676899Z",
"updated_at": "2022-09-04T14:35:43.676926Z",
"structure_string": "La2 B4 Cl2 O8\n1.0\n4.257664 0.001656 0.055199\n2.035360 6.257138 0.908575\n-0.001792 0.001461 8.154298\nLa B Cl O\n2 4 2 8\ndirect\n0.213967 0.030638 0.222506 La\n0.786033 0.969363 0.777494 La\n0.166131 0.350616 0.853124 B\n0.437431 0.436238 0.193654 B\n0.833868 0.649385 0.146875 B\n0.562568 0.563763 0.806346 B\n0.145245 0.205318 0.541713 Cl\n0.854754 0.794683 0.458286 Cl\n0.900185 0.536031 0.823893 O\n0.477249 0.375686 0.818774 O\n0.635213 0.235332 0.209418 O\n0.522750 0.624315 0.181226 O\n0.364786 0.764668 0.790581 O\n0.099814 0.463969 0.176106 O\n0.838081 0.845402 0.079647 O\n0.161918 0.154598 0.920353 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"La",
"B",
"Cl",
"O"
],
"chemical_system": "B-Cl-La-O",
"density": 3.975088487944328,
"density_atomic": 0.07366326680132351,
"volume": 217.20459456615527,
"volume_molar": 8.175229013725739,
"formula_full": "La2 B4 Cl2 O8",
"formula_reduced": "LaB2ClO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.633736029270833,
"spacegroup": 2
},
{
"id": "jvasp-109730",
"created_at": "2022-09-04T14:38:19.075269Z",
"updated_at": "2022-09-04T14:38:19.075295Z",
"structure_string": "La2 Al3 Ga1 Pd4\n1.0\n4.456220 -0.000000 0.000000\n0.000000 4.456220 0.000000\n0.000000 0.000000 10.018521\nLa Al Ga Pd\n2 3 1 4\ndirect\n0.500000 0.000000 0.249369 La\n-0.000000 0.500000 0.750631 La\n0.000000 0.000000 0.500000 Al\n0.500000 0.000000 0.879955 Al\n-0.000000 0.500000 0.120045 Al\n0.500000 0.500000 0.500000 Ga\n0.500000 0.500000 -0.000000 Pd\n0.000000 0.000000 0.000000 Pd\n0.500000 0.000000 0.630555 Pd\n-0.000000 0.500000 0.369445 Pd\n",
"nsites": 10,
"nelements": 4,
"elements": [
"La",
"Al",
"Ga",
"Pd"
],
"chemical_system": "Al-Ga-La-Pd",
"density": 7.129363085404706,
"density_atomic": 0.050264705250280324,
"volume": 198.94675498856586,
"volume_molar": 11.980853622863759,
"formula_full": "La2 Al3 Ga1 Pd4",
"formula_reduced": "La2Al3GaPd4",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 1.7130053525000002,
"spacegroup": 115
},
{
"id": "jvasp-99973",
"created_at": "2022-09-04T14:38:40.530312Z",
"updated_at": "2022-09-04T14:38:40.530339Z",
"structure_string": "La1 Al1 Cu1 Ni3\n1.0\n4.080876 0.000000 0.000000\n0.000000 4.408808 2.379255\n0.000000 -0.042910 5.141562\nLa Al Cu Ni\n1 1 1 3\ndirect\n0.000000 0.500000 0.499999 La\n0.500000 0.000000 0.000000 Al\n0.500000 -0.000000 0.500000 Cu\n0.000000 0.172337 0.155280 Ni\n0.000000 0.827663 0.844719 Ni\n0.500000 0.500000 -0.000001 Ni\n",
"nsites": 6,
"nelements": 4,
"elements": [
"La",
"Al",
"Cu",
"Ni"
],
"chemical_system": "Al-Cu-La-Ni",
"density": 7.246575775189356,
"density_atomic": 0.0645698809840604,
"volume": 92.92258106347057,
"volume_molar": 9.326547715778839,
"formula_full": "La1 Al1 Cu1 Ni3",
"formula_reduced": "LaAlCuNi3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 1.0826059083333337,
"spacegroup": 10
},
{
"id": "jvasp-102774",
"created_at": "2022-09-04T14:36:49.581749Z",
"updated_at": "2022-09-04T14:36:49.581779Z",
"structure_string": "La2 Al6 Cu1 Au1\n1.0\n4.342515 -0.000000 0.000000\n0.000000 4.342515 0.000000\n-0.000000 -0.000000 10.808892\nLa Al Cu Au\n2 6 1 1\ndirect\n0.000000 0.000000 0.997555 La\n0.499999 0.499999 0.490206 La\n0.499999 0.000000 0.243815 Al\n-0.000000 0.499999 0.755091 Al\n-0.000000 0.499999 0.243815 Al\n0.499999 0.000000 0.755091 Al\n0.000000 0.000000 0.394210 Al\n0.499999 0.499999 0.906845 Al\n0.499999 0.499999 0.131567 Cu\n0.000000 0.000000 0.627804 Au\n",
"nsites": 10,
"nelements": 4,
"elements": [
"La",
"Al",
"Cu",
"Au"
],
"chemical_system": "Al-Au-Cu-La",
"density": 5.704469652706855,
"density_atomic": 0.04906097422932367,
"volume": 203.82799479801227,
"volume_molar": 12.274808755021777,
"formula_full": "La2 Al6 Cu1 Au1",
"formula_reduced": "La2Al6CuAu",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.602588482,
"spacegroup": 99
},
{
"id": "jvasp-116548",
"created_at": "2022-09-04T14:38:42.144320Z",
"updated_at": "2022-09-04T14:38:42.144349Z",
"structure_string": "La6 Al2 Cd2 S14\n1.0\n10.240509 -0.000000 0.000000\n-5.120254 8.868541 0.000000\n-0.000000 -0.000000 6.173018\nLa Al Cd S\n6 2 2 14\ndirect\n0.236159 0.376791 0.269630 La\n0.623209 0.859368 0.269630 La\n0.140632 0.763841 0.269630 La\n0.763841 0.623209 0.769630 La\n0.376791 0.140632 0.769630 La\n0.859368 0.236159 0.769630 La\n0.333334 0.666667 0.848866 Al\n0.666667 0.333333 0.348866 Al\n0.000000 0.000000 0.496328 Cd\n0.000000 0.000000 -0.003673 Cd\n0.580542 0.101358 0.496686 S\n0.520816 0.419458 0.496686 S\n0.898642 0.479184 0.496686 S\n0.419458 0.898642 0.996686 S\n0.479184 0.580542 0.996686 S\n0.101358 0.520816 0.996686 S\n0.747287 0.903475 0.729297 S\n0.252714 0.096525 0.229297 S\n0.843812 0.747286 0.229297 S\n0.096525 0.843812 0.729297 S\n0.333334 0.666667 0.485986 S\n0.156188 0.252714 0.729297 S\n0.903475 0.156188 0.229297 S\n0.666667 0.333333 0.985987 S\n",
"nsites": 24,
"nelements": 4,
"elements": [
"La",
"Al",
"Cd",
"S"
],
"chemical_system": "Al-Cd-La-S",
"density": 4.623983939601617,
"density_atomic": 0.04280948237360091,
"volume": 560.6234569843795,
"volume_molar": 14.06730571382391,
"formula_full": "La6 Al2 Cd2 S14",
"formula_reduced": "La3AlCdS7",
"formula_anonymous": "ABC3D7",
"energy_above_hull": 1.744325629166667,
"spacegroup": 173
},
{
"id": "jvasp-85184",
"created_at": "2022-09-04T14:37:08.655872Z",
"updated_at": "2022-09-04T14:37:08.655893Z",
"structure_string": "La1 Al2 B1 Ru2\n1.0\n4.234605 0.000000 0.000000\n0.000000 4.234605 0.000000\n0.000000 0.000000 5.681263\nLa Al B Ru\n1 2 1 2\ndirect\n0.000000 0.000000 0.500000 La\n0.500001 0.500001 0.745733 Al\n0.500001 0.500001 0.254266 Al\n0.000000 0.000000 0.000000 B\n0.500001 0.000000 0.000000 Ru\n0.000000 0.500001 0.000000 Ru\n",
"nsites": 6,
"nelements": 4,
"elements": [
"La",
"Al",
"B",
"Ru"
],
"chemical_system": "Al-B-La-Ru",
"density": 6.614718291857007,
"density_atomic": 0.05889528722298426,
"volume": 101.87572355803813,
"volume_molar": 10.225165788222562,
"formula_full": "La1 Al2 B1 Ru2",
"formula_reduced": "LaAl2BRu2",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 3.356662363888889,
"spacegroup": 123
},
{
"id": "jvasp-8111",
"created_at": "2022-09-04T14:37:05.684430Z",
"updated_at": "2022-09-04T14:37:05.684459Z",
"structure_string": "La2 Ag2 S2 O2\n1.0\n4.077793 -0.000000 0.000000\n0.000000 4.077793 0.000000\n0.000000 -0.000000 9.042828\nLa Ag S O\n2 2 2 2\ndirect\n0.500000 0.000000 0.863156 La\n0.000000 0.500000 0.136845 La\n0.000000 0.000000 0.500000 Ag\n0.500000 0.500000 0.500000 Ag\n0.500000 0.000000 0.305017 S\n0.000000 0.500000 0.694983 S\n0.500000 0.500000 0.000000 O\n0.000000 0.000000 0.000000 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"La",
"Ag",
"S",
"O"
],
"chemical_system": "Ag-La-O-S",
"density": 6.511904613498681,
"density_atomic": 0.053202907225290856,
"volume": 150.36772269085836,
"volume_molar": 11.319194897562436,
"formula_full": "La2 Ag2 S2 O2",
"formula_reduced": "LaAgSO",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.93523644,
"spacegroup": 129
},
{
"id": "jvasp-25918",
"created_at": "2022-09-04T14:38:16.921535Z",
"updated_at": "2022-09-04T14:38:16.921556Z",
"structure_string": "K4 Zr4 Sn4 F28\n1.0\n5.958326 0.000000 -0.000000\n0.000000 8.432195 0.000000\n-0.000000 0.000000 12.508035\nK Zr Sn F\n4 4 4 28\ndirect\n0.786667 0.750000 0.750000 K\n0.786667 0.250000 0.750000 K\n0.213334 0.250000 0.250000 K\n0.213334 0.750000 0.250000 K\n0.749747 0.000000 0.085998 Zr\n0.250253 0.000000 0.914002 Zr\n0.250253 0.500000 0.585999 Zr\n0.749747 0.500000 0.414002 Zr\n0.757294 0.500000 0.092101 Sn\n0.242707 0.500000 0.907899 Sn\n0.757294 0.000000 0.407899 Sn\n0.242707 0.000000 0.592101 Sn\n0.874890 0.000000 0.584195 F\n0.497720 0.500000 0.304096 F\n0.844934 0.733845 0.390225 F\n0.874890 0.500000 0.915805 F\n0.906982 0.000000 0.240565 F\n0.500000 0.644427 0.500000 F\n0.093018 0.500000 0.740565 F\n0.502281 0.500000 0.695905 F\n0.128247 0.500000 0.427959 F\n0.500000 0.855572 0.000000 F\n0.497720 0.000000 0.195904 F\n0.125111 0.500000 0.084195 F\n0.871753 0.500000 0.572042 F\n0.500000 0.355572 0.500000 F\n0.500000 0.144427 0.000000 F\n0.155067 0.766154 0.890225 F\n0.844934 0.766154 0.109775 F\n0.155067 0.733845 0.609775 F\n0.155067 0.233845 0.890225 F\n0.093018 0.000000 0.759436 F\n0.906982 0.500000 0.259435 F\n0.125111 0.000000 0.415805 F\n0.128247 0.000000 0.072041 F\n0.844934 0.233845 0.109775 F\n0.844934 0.266155 0.390225 F\n0.502281 0.000000 0.804096 F\n0.871753 0.000000 0.927959 F\n0.155067 0.266155 0.609775 F\n",
"nsites": 40,
"nelements": 4,
"elements": [
"K",
"Zr",
"Sn",
"F"
],
"chemical_system": "F-K-Sn-Zr",
"density": 4.037778345950951,
"density_atomic": 0.06365111283019391,
"volume": 628.4257764151041,
"volume_molar": 9.461171206960113,
"formula_full": "K4 Zr4 Sn4 F28",
"formula_reduced": "KZrSnF7",
"formula_anonymous": "ABCD7",
"energy_above_hull": 0.0,
"spacegroup": 53
}
]
}