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=-density&page=4123",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=4121",
"results": [
{
"id": "jvasp-11475",
"created_at": "2022-09-04T14:38:04.627758Z",
"updated_at": "2022-09-04T14:38:04.627783Z",
"structure_string": "K3 Na1 Fe2 O8\n1.0\n2.897186 -5.018074 -0.000000\n2.897186 5.018074 0.000000\n-0.000000 -0.000000 7.515532\nK Na Fe O\n3 1 2 8\ndirect\n0.000000 0.000000 0.500000 K\n0.333334 0.666668 0.156829 K\n0.666668 0.333334 0.843171 K\n0.000000 0.000000 0.000000 Na\n0.666668 0.333334 0.279546 Fe\n0.333334 0.666668 0.720454 Fe\n0.178769 0.821232 0.802353 O\n0.642464 0.821232 0.802353 O\n0.178769 0.357537 0.802353 O\n0.821232 0.178769 0.197647 O\n0.821232 0.642464 0.197647 O\n0.357537 0.178769 0.197647 O\n0.333334 0.666668 0.502791 O\n0.666668 0.333334 0.497209 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"K",
"Na",
"Fe",
"O"
],
"chemical_system": "Fe-K-Na-O",
"density": 2.8873211598435575,
"density_atomic": 0.06406559624321201,
"volume": 218.52602365319206,
"volume_molar": 9.399960529732942,
"formula_full": "K3 Na1 Fe2 O8",
"formula_reduced": "K3Na(FeO4)2",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 1.885564428571428,
"spacegroup": 164
},
{
"id": "jvasp-43820",
"created_at": "2022-09-04T14:35:46.804520Z",
"updated_at": "2022-09-04T14:35:46.804541Z",
"structure_string": "Li4 Cr2 P4 O14\n1.0\n5.189651 0.272618 -0.000421\n2.956518 6.542254 -0.000159\n0.000733 -0.000057 8.322453\nLi Cr P O\n4 2 4 14\ndirect\n0.226462 0.059742 0.150862 Li\n0.494308 0.317707 0.371084 Li\n0.505691 0.682293 0.871084 Li\n0.773538 0.940257 0.650865 Li\n0.510404 0.288930 0.001577 Cr\n0.489595 0.711070 0.501577 Cr\n0.102915 0.074200 0.784423 P\n0.118258 0.486415 0.691476 P\n0.881741 0.513585 0.191478 P\n0.897086 0.925798 0.284424 P\n0.696042 0.996427 0.429166 O\n0.857335 0.746074 0.189965 O\n0.790889 0.647002 0.686422 O\n0.749893 0.484959 0.348798 O\n0.721891 0.507532 0.041417 O\n0.278101 0.492473 0.541410 O\n0.807038 0.105180 0.162214 O\n0.209108 0.352997 0.186422 O\n0.142668 0.253925 0.689962 O\n0.303959 0.003569 0.929164 O\n0.192965 0.894816 0.662215 O\n0.780195 0.148162 0.814544 O\n0.250111 0.515036 0.848794 O\n0.219805 0.851838 0.314543 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Cr",
"P",
"O"
],
"chemical_system": "Cr-Li-O-P",
"density": 2.887250024587058,
"density_atomic": 0.08700186550498733,
"volume": 275.8561538961968,
"volume_molar": 6.921852451146331,
"formula_full": "Li4 Cr2 P4 O14",
"formula_reduced": "Li2CrP2O7",
"formula_anonymous": "AB2C2D7",
"energy_above_hull": 2.7613194083333337,
"spacegroup": 4
},
{
"id": "jvasp-106956",
"created_at": "2022-09-04T14:36:52.356538Z",
"updated_at": "2022-09-04T14:36:52.356559Z",
"structure_string": "Li3 Pm1\n1.0\n4.441355 0.000000 2.564217\n1.480452 4.187350 2.564217\n0.000000 0.000000 5.128435\nLi Pm\n3 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.749999 0.750000 0.750001 Li\n0.499999 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Pm\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"Pm"
],
"chemical_system": "Li-Pm",
"density": 2.887049692118853,
"density_atomic": 0.041939223468548274,
"volume": 95.37611021815277,
"volume_molar": 14.359209021874758,
"formula_full": "Li3 Pm1",
"formula_reduced": "Li3Pm",
"formula_anonymous": "AB3",
"energy_above_hull": 0.96037779375,
"spacegroup": 225
},
{
"id": "jvasp-101258",
"created_at": "2022-09-04T14:36:46.902681Z",
"updated_at": "2022-09-04T14:36:46.902704Z",
"structure_string": "Li1 V1 F6\n1.0\n4.713594 -0.363279 2.140344\n1.988236 4.289156 2.140344\n0.427385 0.250358 4.994001\nLi V F\n1 1 6\ndirect\n0.518597 0.518598 0.483595 Li\n0.018606 0.018607 0.983611 V\n0.196127 0.722813 0.804537 F\n0.250959 0.250960 0.628586 F\n0.314452 0.841042 0.162633 F\n0.722811 0.196127 0.804537 F\n0.786275 0.786276 0.338701 F\n0.841040 0.314452 0.162633 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Li",
"V",
"F"
],
"chemical_system": "F-Li-V",
"density": 2.8870360964931168,
"density_atomic": 0.0809255481978956,
"volume": 98.85629665969978,
"volume_molar": 7.441581668712874,
"formula_full": "Li1 V1 F6",
"formula_reduced": "LiVF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.2379119868749999,
"spacegroup": 12
},
{
"id": "jvasp-97915",
"created_at": "2022-09-04T14:35:41.052566Z",
"updated_at": "2022-09-04T14:35:41.052599Z",
"structure_string": "Ba14 Na14 Li1 N6\n1.0\n10.725912 0.000000 6.192608\n3.575304 10.112487 6.192608\n0.000000 0.000000 12.385216\nBa Na Li N\n14 14 1 6\ndirect\n0.315446 0.894851 0.894852 Ba\n0.105149 0.684554 0.105149 Ba\n0.105149 0.105149 0.684554 Ba\n0.684553 0.105149 0.105149 Ba\n0.105149 0.105149 0.105149 Ba\n0.706876 0.293124 0.293124 Ba\n0.894851 0.894851 0.315447 Ba\n0.706876 0.293124 0.706877 Ba\n0.894851 0.315447 0.894852 Ba\n0.293123 0.293124 0.706877 Ba\n0.293123 0.706877 0.293124 Ba\n0.293123 0.706877 0.706877 Ba\n0.894851 0.894851 0.894852 Ba\n0.706876 0.706877 0.293124 Ba\n-0.000000 0.500000 0.500000 Na\n-0.000000 -0.000000 0.500000 Na\n0.500000 -0.000000 0.000000 Na\n-0.000000 0.500000 0.000000 Na\n0.500000 0.500000 0.000000 Na\n0.328950 0.328951 0.328951 Na\n0.013148 0.328951 0.328951 Na\n0.328951 0.013148 0.328951 Na\n0.986852 0.671050 0.671050 Na\n0.671049 0.671050 0.671050 Na\n0.500000 -0.000000 0.500000 Na\n0.328950 0.328951 0.013148 Na\n0.671049 0.986852 0.671050 Na\n0.671049 0.671050 0.986853 Na\n0.000000 0.000000 0.000000 Li\n0.149745 0.149745 0.850255 N\n0.850254 0.149745 0.149746 N\n0.850254 0.850255 0.149746 N\n0.850254 0.149745 0.850255 N\n0.149745 0.850255 0.850255 N\n0.149745 0.850255 0.149746 N\n",
"nsites": 35,
"nelements": 4,
"elements": [
"Ba",
"Na",
"Li",
"N"
],
"chemical_system": "Ba-Li-N-Na",
"density": 2.886805686751919,
"density_atomic": 0.026053870692881943,
"volume": 1343.3704501175016,
"volume_molar": 23.114188409806154,
"formula_full": "Ba14 Na14 Li1 N6",
"formula_reduced": "Ba14Na14LiN6",
"formula_anonymous": "AB6C14D14",
"energy_above_hull": 0.6668185451428571,
"spacegroup": 225
},
{
"id": "jvasp-78795",
"created_at": "2022-09-04T14:37:08.606958Z",
"updated_at": "2022-09-04T14:37:08.606985Z",
"structure_string": "W1 S2\n1.0\n3.189597 0.000001 -0.000010\n1.594799 2.762271 -0.000011\n-0.000049 -0.000032 16.189460\nW S\n1 2\ndirect\n0.333334 0.333333 0.207623 W\n0.666666 0.666664 0.110332 S\n0.666669 0.666669 0.304914 S\n",
"nsites": 3,
"nelements": 2,
"elements": [
"W",
"S"
],
"chemical_system": "S-W",
"density": 2.88678112403567,
"density_atomic": 0.021032305050927416,
"volume": 142.63771815480183,
"volume_molar": 28.632813880447472,
"formula_full": "W1 S2",
"formula_reduced": "WS2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.1870466666666664,
"spacegroup": 187
},
{
"id": "jvasp-64923",
"created_at": "2022-09-04T14:36:10.988506Z",
"updated_at": "2022-09-04T14:36:10.988522Z",
"structure_string": "Mg1 Be2 Br1\n1.0\n-1.864355 1.864355 5.057551\n1.864355 -1.864355 5.057551\n1.864355 1.864355 -5.057551\nMg Be Br\n1 2 1\ndirect\n0.749999 0.250000 0.499999 Mg\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.499999 Be\n0.500000 0.500000 0.000000 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Be",
"Br"
],
"chemical_system": "Be-Br-Mg",
"density": 2.88656522880894,
"density_atomic": 0.056885621267255125,
"volume": 70.31653888787721,
"volume_molar": 10.586402373470262,
"formula_full": "Mg1 Be2 Br1",
"formula_reduced": "MgBe2Br",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.84995883875,
"spacegroup": 119
},
{
"id": "jvasp-11696",
"created_at": "2022-09-04T14:38:12.283456Z",
"updated_at": "2022-09-04T14:38:12.283474Z",
"structure_string": "K3 Cr1 O8\n1.0\n5.596339 0.005226 -2.368556\n-3.140446 5.027084 -1.339816\n0.003265 -0.005226 6.076928\nK Cr O\n3 1 8\ndirect\n0.499999 0.250000 0.749999 K\n0.499999 0.750000 0.249999 K\n-0.000001 0.499999 0.499999 K\n0.000000 0.000000 0.000000 Cr\n0.585472 0.807504 0.807503 O\n-0.000001 0.192494 0.777968 O\n-0.000001 0.777968 0.192494 O\n0.414526 0.222031 0.222031 O\n0.268436 0.317727 0.317727 O\n-0.000002 0.682271 0.950708 O\n-0.000002 0.950708 0.682271 O\n0.731563 0.049291 0.049290 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"K",
"Cr",
"O"
],
"chemical_system": "Cr-K-O",
"density": 2.886462133805824,
"density_atomic": 0.07016544168224038,
"volume": 171.02436345152128,
"volume_molar": 8.582773250787172,
"formula_full": "K3 Cr1 O8",
"formula_reduced": "K3CrO8",
"formula_anonymous": "AB3C8",
"energy_above_hull": 2.0546441166666667,
"spacegroup": 121
},
{
"id": "jvasp-119011",
"created_at": "2022-09-04T14:38:32.435959Z",
"updated_at": "2022-09-04T14:38:32.435980Z",
"structure_string": "Mg8 O8\n1.0\n5.686084 0.006645 -5.824014\n-0.413358 4.027715 -7.060976\n-0.027951 -0.006645 8.139405\nMg O\n8 8\ndirect\n0.738050 0.070469 0.667580 Mg\n0.261950 0.929533 0.332419 Mg\n0.597112 0.429533 0.167581 Mg\n0.402888 0.570469 0.832419 Mg\n0.025172 0.689819 0.335353 Mg\n0.974827 0.310182 0.664647 Mg\n0.645535 0.810182 0.835353 Mg\n0.354465 0.189819 0.164647 Mg\n0.024623 0.190127 0.834494 O\n0.975376 0.809874 0.165506 O\n0.644367 0.309873 0.334495 O\n0.355633 0.690128 0.665505 O\n0.741820 0.570446 0.171375 O\n0.258179 0.429555 0.828625 O\n0.600929 0.929556 0.671374 O\n0.399070 0.070445 0.328625 O\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Mg",
"O"
],
"chemical_system": "Mg-O",
"density": 2.8864456859061,
"density_atomic": 0.08625649915457533,
"volume": 185.4932689921407,
"volume_molar": 6.981666099395092,
"formula_full": "Mg8 O8",
"formula_reduced": "MgO",
"formula_anonymous": "AB",
"energy_above_hull": 0.0561399999999998,
"spacegroup": 72
},
{
"id": "jvasp-97877",
"created_at": "2022-09-04T14:36:16.593682Z",
"updated_at": "2022-09-04T14:36:16.593708Z",
"structure_string": "Ca8 P12 O38\n1.0\n6.770229 0.012847 -1.182146\n-0.816717 8.613245 -3.067863\n-0.032167 0.004632 12.829987\nCa P O\n8 12 38\ndirect\n0.810872 0.991017 0.365319 Ca\n0.645211 0.126664 0.878682 Ca\n0.354788 0.873337 0.121318 Ca\n0.903462 0.351101 0.665760 Ca\n0.973649 0.814826 0.851649 Ca\n0.096537 0.648900 0.334240 Ca\n0.026350 0.185174 0.148351 Ca\n0.189127 0.008984 0.634681 Ca\n0.534635 0.241998 0.150785 P\n0.465365 0.758003 0.849216 P\n0.376598 0.332278 0.583833 P\n0.274623 0.051785 0.375581 P\n0.203663 0.630676 0.619707 P\n0.715298 0.535786 0.908502 P\n0.623401 0.667723 0.416167 P\n0.725376 0.948216 0.624420 P\n0.796336 0.369325 0.380293 P\n0.875249 0.813365 0.120227 P\n0.124751 0.186636 0.879773 P\n0.284702 0.464215 0.091498 P\n0.001296 0.116932 0.944222 O\n0.651777 0.865764 0.880526 O\n0.757880 0.649120 0.036119 O\n0.951096 0.405915 0.320758 O\n0.391394 0.726545 0.716801 O\n0.710576 0.913106 0.163013 O\n0.439420 0.970253 0.319513 O\n0.560579 0.029748 0.680487 O\n0.998703 0.883068 0.055778 O\n0.420498 0.613326 0.347910 O\n0.842785 0.274792 0.455589 O\n0.048903 0.594086 0.679242 O\n0.820226 0.033254 0.557982 O\n0.396215 0.214279 0.464667 O\n0.124860 0.433967 0.150613 O\n0.179773 0.966747 0.442019 O\n0.335736 0.622763 0.093191 O\n0.875140 0.566034 0.849387 O\n0.664263 0.377237 0.906810 O\n0.289423 0.086895 0.836987 O\n0.242120 0.350881 0.963881 O\n0.222854 0.267974 0.631952 O\n0.007573 0.777085 0.213898 O\n0.992426 0.222916 0.786103 O\n0.579501 0.386675 0.652091 O\n0.157214 0.725209 0.544412 O\n0.693601 0.186379 0.083793 O\n0.491258 0.407387 0.143265 O\n0.603785 0.785722 0.535333 O\n0.608605 0.273455 0.283199 O\n0.287242 0.476197 0.547776 O\n0.112403 0.098063 0.298283 O\n0.887597 0.901937 0.701717 O\n0.712757 0.523803 0.452224 O\n0.777146 0.732027 0.368048 O\n0.348222 0.134237 0.119474 O\n0.508741 0.592614 0.856736 O\n0.306398 0.813622 0.916208 O\n",
"nsites": 58,
"nelements": 3,
"elements": [
"Ca",
"P",
"O"
],
"chemical_system": "Ca-O-P",
"density": 2.8863203357565475,
"density_atomic": 0.07753261354640699,
"volume": 748.0722930265239,
"volume_molar": 7.767235598727058,
"formula_full": "Ca8 P12 O38",
"formula_reduced": "Ca4P6O19",
"formula_anonymous": "A4B6C19",
"energy_above_hull": 2.6486293510344825,
"spacegroup": 2
},
{
"id": "jvasp-94392",
"created_at": "2022-09-04T14:35:46.254537Z",
"updated_at": "2022-09-04T14:35:46.254561Z",
"structure_string": "Y2 Mg4\n1.0\n5.905080 0.000000 0.000000\n-2.952540 5.113949 0.000000\n-0.000000 0.000000 5.239967\nY Mg\n2 4\ndirect\n0.333333 0.666667 0.500000 Y\n0.666667 0.333333 0.500000 Y\n0.686617 -0.000000 0.000000 Mg\n0.000000 0.686617 0.000000 Mg\n0.313383 0.313383 0.000000 Mg\n0.000000 0.000000 0.500000 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Y",
"Mg"
],
"chemical_system": "Mg-Y",
"density": 2.8861647657792715,
"density_atomic": 0.03791757200805943,
"volume": 158.2379799720481,
"volume_molar": 15.882189816162244,
"formula_full": "Y2 Mg4",
"formula_reduced": "YMg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.7025251071428571,
"spacegroup": 189
},
{
"id": "jvasp-101952",
"created_at": "2022-09-04T14:36:47.479361Z",
"updated_at": "2022-09-04T14:36:47.479370Z",
"structure_string": "Cd1 H6 C5 O4\n1.0\n4.063340 -0.115967 -0.278640\n-0.996942 4.200739 -0.387402\n-0.030213 -0.013224 8.234216\nCd H C O\n1 6 5 4\ndirect\n0.791678 0.342719 0.244145 Cd\n0.451789 0.748284 0.552066 H\n0.499068 0.118989 0.670422 H\n0.864760 0.549783 0.630671 H\n-0.000784 0.381169 0.879584 H\n0.909473 0.902369 0.763250 H\n0.403910 0.482686 0.807545 H\n0.153567 0.024710 0.453976 C\n0.311302 0.914167 0.601911 C\n0.051815 0.740718 0.710319 C\n0.197546 0.582941 0.848475 C\n0.341368 0.792585 0.007947 C\n0.864349 0.863757 0.382844 O\n0.305685 0.288653 0.401567 O\n0.557073 0.064413 0.002620 O\n0.256676 0.687686 0.142164 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Cd",
"H",
"C",
"O"
],
"chemical_system": "C-Cd-H-O",
"density": 2.885952772424385,
"density_atomic": 0.11466501149691004,
"volume": 139.53689788302304,
"volume_molar": 5.251942751658192,
"formula_full": "Cd1 H6 C5 O4",
"formula_reduced": "CdH6C5O4",
"formula_anonymous": "AB4C5D6",
"energy_above_hull": 4.122310234375,
"spacegroup": 1
}
]
}