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=4632",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=4630",
"results": [
{
"id": "jvasp-28925",
"created_at": "2022-09-04T14:37:43.846893Z",
"updated_at": "2022-09-04T14:37:43.846927Z",
"structure_string": "Te2 Mo2 W2 Se2 S4\n1.0\n3.315699 0.000000 0.000000\n-1.657849 2.871499 0.000033\n0.000001 0.000385 34.404398\nTe Mo W Se S\n2 2 2 2 4\ndirect\n0.333376 0.666753 0.715897 Te\n0.333327 0.666654 0.604094 Te\n0.333324 0.666647 0.463476 Mo\n0.666681 0.333363 0.283186 Mo\n0.333310 0.666620 0.096227 W\n0.666686 0.333372 0.660047 W\n0.666672 0.333343 0.047296 Se\n0.666608 0.333216 0.145219 Se\n0.333337 0.666675 0.327610 S\n0.666665 0.333328 0.419073 S\n0.666656 0.333309 0.507875 S\n0.333356 0.666713 0.238748 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.5810384920654865,
"density_atomic": 0.036633930348042215,
"volume": 327.56518031217206,
"volume_molar": 16.438696865955674,
"formula_full": "Te2 Mo2 W2 Se2 S4",
"formula_reduced": "TeMoWSeS2",
"formula_anonymous": "ABCDE2",
"energy_above_hull": 3.6160095055555552,
"spacegroup": 156
},
{
"id": "jvasp-29089",
"created_at": "2022-09-04T14:37:50.036822Z",
"updated_at": "2022-09-04T14:37:50.036854Z",
"structure_string": "Te2 Mo2 W2 Se2 S4\n1.0\n3.316142 0.000000 0.000000\n-1.658071 2.871873 0.000003\n0.000000 0.000043 37.438338\nTe Mo W Se S\n2 2 2 2 4\ndirect\n0.666647 0.333293 0.042933 Te\n0.666648 0.333296 0.145134 Te\n0.333311 0.666623 0.093861 Mo\n0.666683 0.333367 0.281821 Mo\n0.333306 0.666613 0.469654 W\n0.666686 0.333372 0.657531 W\n0.333353 0.666706 0.702443 Se\n0.333353 0.666706 0.612398 Se\n0.333358 0.666715 0.322658 S\n0.666646 0.333291 0.428567 S\n0.666645 0.333290 0.510753 S\n0.333358 0.666717 0.240997 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.12740754249443,
"density_atomic": 0.03365629730825429,
"volume": 356.5454598315831,
"volume_molar": 17.893057887039326,
"formula_full": "Te2 Mo2 W2 Se2 S4",
"formula_reduced": "TeMoWSeS2",
"formula_anonymous": "ABCDE2",
"energy_above_hull": 3.612121172222222,
"spacegroup": 156
},
{
"id": "jvasp-28681",
"created_at": "2022-09-04T14:37:41.876970Z",
"updated_at": "2022-09-04T14:37:41.876988Z",
"structure_string": "Te2 Mo2 W2 Se4 S2\n1.0\n3.347755 0.000000 -0.000000\n-1.673877 2.899242 -0.000029\n-0.000000 -0.000342 36.019838\nTe Mo W Se S\n2 2 2 4 2\ndirect\n0.333349 0.666703 0.332343 Te\n0.333375 0.666753 0.226756 Te\n0.333362 0.666727 0.093342 Mo\n0.666695 0.333393 0.279582 Mo\n0.333320 0.666641 0.473474 W\n0.666622 0.333248 0.656545 W\n0.333296 0.666596 0.703003 Se\n0.666646 0.333293 0.426947 Se\n0.666665 0.333332 0.519977 Se\n0.333274 0.666551 0.610039 Se\n0.666678 0.333357 0.051246 S\n0.666702 0.333405 0.135495 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.674648643388616,
"density_atomic": 0.0343242736743923,
"volume": 349.6068151021831,
"volume_molar": 17.544845426672005,
"formula_full": "Te2 Mo2 W2 Se4 S2",
"formula_reduced": "TeMoWSe2S",
"formula_anonymous": "ABCDE2",
"energy_above_hull": 3.529215066666667,
"spacegroup": 156
},
{
"id": "jvasp-29122",
"created_at": "2022-09-04T14:36:50.423549Z",
"updated_at": "2022-09-04T14:36:50.423567Z",
"structure_string": "Te4 Mo2 W2 Se2 S2\n1.0\n3.416157 -0.000001 -0.000001\n-1.708079 2.958480 -0.000001\n-0.000021 -0.000028 38.343440\nTe Mo W Se S\n4 2 2 2 2\ndirect\n0.333358 0.666716 0.706327 Te\n0.666640 0.333279 0.045405 Te\n0.666648 0.333296 0.142819 Te\n0.333351 0.666702 0.608480 Te\n0.333300 0.666601 0.093921 Mo\n0.333321 0.666642 0.469622 Mo\n0.666685 0.333370 0.281830 W\n0.666688 0.333372 0.657517 W\n0.666643 0.333284 0.426774 Se\n0.666649 0.333296 0.512501 Se\n0.333364 0.666725 0.321083 S\n0.333356 0.666713 0.242471 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.5362731995040715,
"density_atomic": 0.030965905686256984,
"volume": 387.5229783873473,
"volume_molar": 19.447649363192024,
"formula_full": "Te4 Mo2 W2 Se2 S2",
"formula_reduced": "Te2MoWSeS",
"formula_anonymous": "ABCDE2",
"energy_above_hull": 3.4644741333333333,
"spacegroup": 156
},
{
"id": "jvasp-28643",
"created_at": "2022-09-04T14:36:45.491070Z",
"updated_at": "2022-09-04T14:36:45.491091Z",
"structure_string": "Te2 Mo2 W2 Se4 S2\n1.0\n3.350700 0.000000 0.000000\n-1.675350 2.901706 0.000006\n0.000000 0.000082 37.937828\nTe Mo W Se S\n2 2 2 4 2\ndirect\n0.666644 0.333286 0.419600 Te\n0.666643 0.333286 0.519686 Te\n0.333330 0.666662 0.093971 Mo\n0.333316 0.666633 0.469678 Mo\n0.666680 0.333359 0.281733 W\n0.666684 0.333369 0.657576 W\n0.333357 0.666714 0.325878 Se\n0.333358 0.666718 0.701547 Se\n0.333355 0.666712 0.237547 Se\n0.333362 0.666726 0.613439 Se\n0.666636 0.333272 0.054085 S\n0.666636 0.333272 0.134008 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.378453892439533,
"density_atomic": 0.032532679105036946,
"volume": 368.85987659534845,
"volume_molar": 18.51105081311182,
"formula_full": "Te2 Mo2 W2 Se4 S2",
"formula_reduced": "TeMoWSe2S",
"formula_anonymous": "ABCDE2",
"energy_above_hull": 3.530261733333334,
"spacegroup": 156
},
{
"id": "jvasp-28809",
"created_at": "2022-09-04T14:38:33.372173Z",
"updated_at": "2022-09-04T14:38:33.372190Z",
"structure_string": "Te2 Mo2 W2 Se4 S2\n1.0\n3.354267 0.000001 -0.000000\n-1.677133 2.904896 -0.000025\n0.000002 -0.000325 37.834534\nTe Mo W Se S\n2 2 2 4 2\ndirect\n0.333355 0.666709 0.707819 Te\n0.333350 0.666699 0.607026 Te\n0.333314 0.666627 0.093917 Mo\n0.666698 0.333396 0.281767 Mo\n0.333313 0.666622 0.469612 W\n0.666684 0.333368 0.657570 W\n0.333359 0.666718 0.325860 Se\n0.666643 0.333283 0.050117 Se\n0.666647 0.333292 0.137959 Se\n0.333355 0.666708 0.237783 Se\n0.666644 0.333287 0.429352 S\n0.666647 0.333292 0.509964 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.381485624885209,
"density_atomic": 0.032551017159198975,
"volume": 368.6520744132501,
"volume_molar": 18.50062236318822,
"formula_full": "Te2 Mo2 W2 Se4 S2",
"formula_reduced": "TeMoWSe2S",
"formula_anonymous": "ABCDE2",
"energy_above_hull": 3.531745066666667,
"spacegroup": 156
},
{
"id": "jvasp-28962",
"created_at": "2022-09-04T14:35:48.176358Z",
"updated_at": "2022-09-04T14:35:48.176368Z",
"structure_string": "Te2 Mo2 W2 Se4 S2\n1.0\n3.352227 0.000000 0.000000\n-1.676114 2.903123 -0.000022\n0.000000 -0.000285 37.902076\nTe Mo W Se S\n2 2 2 4 2\ndirect\n0.333355 0.666711 0.707793 Te\n0.333353 0.666705 0.607177 Te\n0.333314 0.666626 0.469600 Mo\n0.666692 0.333381 0.281758 Mo\n0.333309 0.666616 0.093940 W\n0.666687 0.333373 0.657585 W\n0.333357 0.666714 0.325820 Se\n0.666645 0.333289 0.425619 Se\n0.666647 0.333291 0.513612 Se\n0.333354 0.666707 0.237789 Se\n0.666644 0.333285 0.053848 S\n0.666646 0.333289 0.134206 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.378448472268959,
"density_atomic": 0.032532646320025956,
"volume": 368.86024831657244,
"volume_molar": 18.511069467757935,
"formula_full": "Te2 Mo2 W2 Se4 S2",
"formula_reduced": "TeMoWSe2S",
"formula_anonymous": "ABCDE2",
"energy_above_hull": 3.531530066666667,
"spacegroup": 156
},
{
"id": "jvasp-97661",
"created_at": "2022-09-04T14:35:52.578760Z",
"updated_at": "2022-09-04T14:35:52.578779Z",
"structure_string": "Si4 B4 H4 C12 N4 Cl8\n1.0\n8.070152 0.000000 0.487734\n0.000000 10.477005 0.000000\n1.570408 0.000000 6.140222\nSi B H C N Cl\n4 4 4 12 4 8\ndirect\n0.275278 0.838133 0.512039 Si\n0.724722 0.338133 0.987960 Si\n0.724722 0.161867 0.487960 Si\n0.275278 0.661867 0.012039 Si\n0.898857 0.936017 0.598825 B\n0.101144 0.436017 0.901174 B\n0.101143 0.063984 0.401174 B\n0.898857 0.563984 0.098825 B\n0.105691 0.503077 0.225302 H\n0.894309 0.003076 0.274698 H\n0.105691 -0.003076 0.725301 H\n0.894309 0.496924 0.774697 H\n0.440032 0.637147 0.224083 C\n0.313240 0.726150 0.271912 C\n0.686760 0.226149 0.228087 C\n0.686760 0.273851 0.728087 C\n0.313240 -0.226149 0.771912 C\n0.559968 0.137146 0.275917 C\n0.559968 0.362854 0.775916 C\n0.440032 -0.137146 0.724082 C\n0.457909 0.554517 0.037802 C\n0.542091 0.054517 0.462197 C\n0.542091 0.445483 0.962197 C\n0.457910 -0.054517 0.537802 C\n0.902711 0.045345 0.418039 N\n0.097289 0.545345 0.081961 N\n0.097289 -0.045345 0.581960 N\n0.902711 0.454656 0.918038 N\n0.148256 0.219630 0.488932 Cl\n0.756076 0.988058 0.871540 Cl\n0.243924 0.488057 0.628459 Cl\n0.243924 0.011943 0.128459 Cl\n0.756076 0.511943 0.371540 Cl\n-0.148256 0.780370 0.511068 Cl\n0.148256 0.280370 0.988932 Cl\n-0.148256 0.719630 0.011068 Cl\n",
"nsites": 36,
"nelements": 6,
"elements": [
"Si",
"B",
"H",
"C",
"N",
"Cl"
],
"chemical_system": "B-C-Cl-H-N-Si",
"density": 2.090213003890476,
"density_atomic": 0.07043117666545877,
"volume": 511.13727903477314,
"volume_molar": 8.550390672307781,
"formula_full": "Si4 B4 H4 C12 N4 Cl8",
"formula_reduced": "SiBHC3NCl2",
"formula_anonymous": "ABCDE2F3",
"energy_above_hull": 4.418299174259259,
"spacegroup": 14
},
{
"id": "jvasp-96812",
"created_at": "2022-09-04T14:36:13.462854Z",
"updated_at": "2022-09-04T14:36:13.462881Z",
"structure_string": "Si2 H16 C4 N2 Cl2 O2\n1.0\n5.465383 0.041546 -1.201994\n-0.784684 6.181577 -1.226413\n-0.032327 0.025497 8.628556\nSi H C N Cl O\n2 16 4 2 2 2\ndirect\n0.941045 0.296699 0.677645 Si\n0.058955 0.703302 0.322357 Si\n0.183473 0.848419 0.480203 H\n0.777419 0.434051 0.986088 H\n0.538102 0.091743 0.254275 H\n0.715013 0.842650 0.657943 H\n0.284987 0.157352 0.342058 H\n0.792495 0.192534 0.068110 H\n0.222581 0.565950 0.013913 H\n0.152344 0.494332 0.275189 H\n0.207505 0.807468 0.931891 H\n0.265226 0.164310 0.131485 H\n0.506674 0.246989 0.947467 H\n0.816527 0.151582 0.519799 H\n0.734774 0.835691 0.868516 H\n0.847656 0.505670 0.724813 H\n0.461898 0.908259 0.745727 H\n0.493326 0.753012 0.052534 H\n0.291812 0.737810 0.035735 C\n0.708188 0.262192 0.964267 C\n0.335715 0.081396 0.230456 C\n0.664285 0.918605 0.769545 C\n0.239560 0.852982 0.185695 N\n0.760440 0.147019 0.814306 N\n0.288797 0.404912 0.636207 Cl\n0.711203 0.595090 0.363794 Cl\n0.036295 0.168885 0.832508 O\n0.963705 0.831116 0.167494 O\n",
"nsites": 28,
"nelements": 6,
"elements": [
"Si",
"H",
"C",
"N",
"Cl",
"O"
],
"chemical_system": "C-Cl-H-N-O-Si",
"density": 1.4300749956213086,
"density_atomic": 0.09597233272522009,
"volume": 291.7507494599224,
"volume_molar": 6.274871714582667,
"formula_full": "Si2 H16 C4 N2 Cl2 O2",
"formula_reduced": "SiH8C2NClO",
"formula_anonymous": "ABCDE2F8",
"energy_above_hull": 3.814080672678572,
"spacegroup": 2
},
{
"id": "jvasp-94834",
"created_at": "2022-09-04T14:35:47.747006Z",
"updated_at": "2022-09-04T14:35:47.747033Z",
"structure_string": "Ba1 Zn1 B1 O3 F1\n1.0\n0.000000 0.000000 -4.335599\n-2.549185 -4.415312 0.000000\n-2.549168 4.415302 0.000000\nBa Zn B O F\n1 1 1 3 1\ndirect\n0.500000 0.666676 0.333337 Ba\n0.000000 0.333345 0.666671 Zn\n0.000000 0.000007 0.000006 B\n0.000000 0.975017 0.258133 O\n0.000000 0.741882 0.716889 O\n0.000000 0.283122 0.024991 O\n0.500000 0.333354 0.666676 F\n",
"nsites": 7,
"nelements": 5,
"elements": [
"Ba",
"Zn",
"B",
"O",
"F"
],
"chemical_system": "B-Ba-F-O-Zn",
"density": 4.7731991315084485,
"density_atomic": 0.07172294684055398,
"volume": 97.5977746084747,
"volume_molar": 8.396393379356978,
"formula_full": "Ba1 Zn1 B1 O3 F1",
"formula_reduced": "BaZnBO3F",
"formula_anonymous": "ABCDE3",
"energy_above_hull": 1.1937342479761903,
"spacegroup": 174
},
{
"id": "jvasp-40499",
"created_at": "2022-09-04T14:38:33.665655Z",
"updated_at": "2022-09-04T14:38:33.665682Z",
"structure_string": "Rb3 Ca3 C3 O9 F3\n1.0\n9.206186 0.000000 0.000000\n-4.603093 7.972855 0.000000\n0.000000 0.000000 4.443823\nRb Ca C O F\n3 3 3 9 3\ndirect\n-0.000003 0.718495 0.000000 Rb\n0.281500 0.281505 0.000000 Rb\n0.718490 0.000000 0.000000 Rb\n0.612641 0.612646 0.500000 Ca\n0.387350 0.000000 0.500000 Ca\n-0.000006 0.387352 0.500000 Ca\n0.333328 0.666665 0.500000 C\n-0.000005 0.000000 0.500000 C\n0.666665 0.333334 0.500000 C\n0.795042 0.484522 0.500000 O\n0.515476 0.310527 0.500000 O\n0.689467 0.204952 0.500000 O\n0.310518 0.515476 0.500000 O\n0.140475 0.000000 0.500000 O\n0.484515 0.795047 0.500000 O\n-0.000001 0.140481 0.500000 O\n0.859518 0.859518 0.500000 O\n0.204949 0.689473 0.500000 O\n0.385212 0.000000 0.000000 F\n0.614777 0.614787 0.000000 F\n0.999990 0.385212 0.000000 F\n",
"nsites": 21,
"nelements": 5,
"elements": [
"Rb",
"Ca",
"C",
"O",
"F"
],
"chemical_system": "C-Ca-F-O-Rb",
"density": 3.1241081609968675,
"density_atomic": 0.06438266232591026,
"volume": 326.17476881736104,
"volume_molar": 9.353668429421939,
"formula_full": "Rb3 Ca3 C3 O9 F3",
"formula_reduced": "RbCaCO3F",
"formula_anonymous": "ABCDE3",
"energy_above_hull": 1.544343028928571,
"spacegroup": 189
},
{
"id": "jvasp-35174",
"created_at": "2022-09-04T14:37:29.538253Z",
"updated_at": "2022-09-04T14:37:29.538260Z",
"structure_string": "Li2 Ca2 Mg2 Si2 N6\n1.0\n-5.533322 0.000000 0.676214\n-2.766661 -4.938711 0.338107\n0.014741 0.000000 6.008632\nLi Ca Mg Si N\n2 2 2 2 6\ndirect\n0.680378 0.000000 0.091204 Li\n0.319622 0.000000 0.908795 Li\n0.319664 0.360672 0.500000 Ca\n0.680335 0.639328 0.500000 Ca\n0.235530 0.528941 0.000000 Mg\n0.764470 0.471059 -0.000000 Mg\n0.130207 0.000000 0.320670 Si\n0.869792 0.000000 0.679329 Si\n0.807340 0.000000 0.389109 N\n0.192659 0.000000 0.610890 N\n0.607915 0.290725 0.810574 N\n0.898640 0.709275 0.810574 N\n0.392085 0.709275 0.189425 N\n0.101359 0.290725 0.189425 N\n",
"nsites": 14,
"nelements": 5,
"elements": [
"Li",
"Ca",
"Mg",
"Si",
"N"
],
"chemical_system": "Ca-Li-Mg-N-Si",
"density": 2.859657727526712,
"density_atomic": 0.08523592625997121,
"volume": 164.2499895795082,
"volume_molar": 7.065261121973797,
"formula_full": "Li2 Ca2 Mg2 Si2 N6",
"formula_reduced": "LiCaMgSiN3",
"formula_anonymous": "ABCDE3",
"energy_above_hull": 2.7637654028571426,
"spacegroup": 12
}
]
}