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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=4329",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=4327",
"results": [
{
"id": "jvasp-21710",
"created_at": "2022-09-04T14:38:31.164085Z",
"updated_at": "2022-09-04T14:38:31.164114Z",
"structure_string": "Cu4 Sn2 Se6\n1.0\n7.003576 -0.017716 -1.178055\n-1.783974 5.849328 -3.520639\n-0.019661 -0.006332 7.056322\nCu Sn Se\n4 2 6\ndirect\n0.381145 0.383543 0.888099 Cu\n0.881146 0.888100 0.383542 Cu\n0.879677 0.200443 0.037529 Cu\n0.379676 0.037530 0.200443 Cu\n0.896695 0.550617 0.733939 Sn\n0.396695 0.733940 0.550617 Sn\n0.994426 0.582921 0.396075 Se\n0.519679 0.761441 0.235725 Se\n0.018383 0.949051 0.118612 Se\n0.494425 0.396076 0.582920 Se\n0.518383 0.118612 0.949050 Se\n0.019678 0.235726 0.761441 Se\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Cu",
"Sn",
"Se"
],
"chemical_system": "Cu-Se-Sn",
"density": 5.555609467657451,
"density_atomic": 0.04158845231442285,
"volume": 288.5416343285852,
"volume_molar": 14.480319475393236,
"formula_full": "Cu4 Sn2 Se6",
"formula_reduced": "Cu2SnSe3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.6462221166666666,
"spacegroup": 9
},
{
"id": "jvasp-53406",
"created_at": "2022-09-04T14:38:31.939420Z",
"updated_at": "2022-09-04T14:38:31.939445Z",
"structure_string": "Li10 Ge2 P6\n1.0\n5.938295 -0.000543 0.000647\n-2.968533 6.489703 -0.023240\n-0.001063 -2.774315 8.120753\nLi Ge P\n10 2 6\ndirect\n0.101569 0.684822 0.424370 Li\n0.258221 0.007573 0.249200 Li\n0.232404 0.992211 0.756826 Li\n0.580421 0.684818 0.924371 Li\n0.445708 0.336692 0.065790 Li\n0.888172 0.336691 0.565789 Li\n0.756971 -0.007781 0.256833 Li\n0.746524 0.007581 0.749206 Li\n0.070184 0.648048 0.909430 Li\n0.575043 0.648045 0.409429 Li\n0.354473 0.334857 0.629749 Ge\n0.977558 0.334856 0.129751 Ge\n0.317451 0.657969 0.160081 P\n0.996169 0.012522 0.004991 P\n0.337695 0.657957 0.660081 P\n0.013536 0.012534 0.504997 P\n0.688322 0.333455 0.304787 P\n0.642295 0.333456 0.804780 P\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Li",
"Ge",
"P"
],
"chemical_system": "Ge-Li-P",
"density": 2.127876739499012,
"density_atomic": 0.05758800522549835,
"volume": 312.5650893709044,
"volume_molar": 10.457283138075367,
"formula_full": "Li10 Ge2 P6",
"formula_reduced": "Li5GeP3",
"formula_anonymous": "AB3C5",
"energy_above_hull": 1.667455827777778,
"spacegroup": 9
},
{
"id": "jvasp-46706",
"created_at": "2022-09-04T14:38:33.502060Z",
"updated_at": "2022-09-04T14:38:33.502087Z",
"structure_string": "Mn2 P2 O8\n1.0\n5.106155 0.180388 0.396534\n2.941714 7.071531 4.489061\n2.663849 -1.220823 4.204296\nMn P O\n2 2 8\ndirect\n0.198797 0.258764 0.286930 Mn\n0.786929 0.758764 0.698797 Mn\n0.161992 0.626223 0.089668 P\n0.589668 0.126223 0.661992 P\n0.038692 0.776706 0.243237 O\n0.203222 0.457358 0.334339 O\n0.274985 0.146694 0.994914 O\n0.509404 0.117299 0.420177 O\n0.494913 0.646693 0.774985 O\n0.743236 0.276706 0.538692 O\n0.920177 0.617299 0.009404 O\n0.834338 0.957359 0.703221 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Mn",
"P",
"O"
],
"chemical_system": "Mn-O-P",
"density": 2.9144333499739927,
"density_atomic": 0.07024693737297094,
"volume": 170.82595268583574,
"volume_molar": 8.572816104460024,
"formula_full": "Mn2 P2 O8",
"formula_reduced": "MnPO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.791919456896552,
"spacegroup": 9
},
{
"id": "jvasp-47734",
"created_at": "2022-09-04T14:38:34.100098Z",
"updated_at": "2022-09-04T14:38:34.100119Z",
"structure_string": "Li2 Co2 Si2 O8\n1.0\n1.727488 4.398083 2.370389\n6.884505 -3.757771 2.370389\n1.727488 4.398083 -2.370389\nLi Co Si O\n2 2 2 8\ndirect\n0.779175 0.131071 0.576222 Li\n-0.054849 0.631071 0.910247 Li\n0.294755 0.492997 0.034480 Co\n0.041483 0.992998 0.787753 Co\n0.431513 0.253394 0.358317 Si\n0.604925 0.753394 0.684905 Si\n0.458024 0.300459 0.056449 O\n0.786448 0.154008 0.220305 O\n0.181851 0.123077 0.500392 O\n0.295517 0.430097 0.663971 O\n0.255991 0.800459 0.758483 O\n0.566297 0.654009 0.940456 O\n0.877316 0.623077 0.304928 O\n0.733874 0.930098 0.725614 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Co",
"Si",
"O"
],
"chemical_system": "Co-Li-O-Si",
"density": 3.009359085703707,
"density_atomic": 0.08031252252343796,
"volume": 174.31901726053144,
"volume_molar": 7.4983832791984995,
"formula_full": "Li2 Co2 Si2 O8",
"formula_reduced": "LiCoSiO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.4456305,
"spacegroup": 9
},
{
"id": "jvasp-116829",
"created_at": "2022-09-04T14:38:33.944667Z",
"updated_at": "2022-09-04T14:38:33.944692Z",
"structure_string": "Li2 Mn4 Si4 O14\n1.0\n4.935080 -0.075019 0.148098\n2.144448 4.445450 -0.148244\n0.150053 -0.242647 12.965278\nLi Mn Si O\n2 4 4 14\ndirect\n0.334408 0.286390 0.910648 Li\n0.713610 0.665591 0.410648 Li\n0.024620 0.964369 0.253144 Mn\n0.035629 -0.024620 0.753144 Mn\n0.070261 0.938626 0.009475 Mn\n0.061375 0.929740 0.509475 Mn\n0.691314 0.629423 0.866478 Si\n0.370577 0.308685 0.366477 Si\n0.704933 0.589243 0.635703 Si\n0.410756 0.295067 0.135703 Si\n0.777125 0.134581 0.126790 O\n0.865420 0.222874 0.626789 O\n0.319598 0.084777 0.444346 O\n0.915222 0.680401 0.944346 O\n0.279330 0.170068 0.043442 O\n0.829932 0.720668 0.543442 O\n0.343208 0.720505 0.640137 O\n0.312541 0.190896 0.248596 O\n0.332957 0.868832 0.875964 O\n0.131168 0.667043 0.375964 O\n0.721251 0.287073 0.863299 O\n0.279494 0.656792 0.140137 O\n0.809103 0.687457 0.748597 O\n0.712927 0.278748 0.363298 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Si",
"O"
],
"chemical_system": "Li-Mn-O-Si",
"density": 3.30725762405314,
"density_atomic": 0.08386482877406432,
"volume": 286.1747928283154,
"volume_molar": 7.1807703515664745,
"formula_full": "Li2 Mn4 Si4 O14",
"formula_reduced": "LiMn2Si2O7",
"formula_anonymous": "AB2C2D7",
"energy_above_hull": 3.092092181896551,
"spacegroup": 9
},
{
"id": "jvasp-12889",
"created_at": "2022-09-04T14:38:34.418779Z",
"updated_at": "2022-09-04T14:38:34.418796Z",
"structure_string": "Na8 Sn2 O6\n1.0\n5.501886 -0.021977 1.922908\n1.900626 5.542001 0.664268\n0.002713 -0.010988 8.824778\nNa Sn O\n8 2 6\ndirect\n0.522806 0.252623 0.932284 Na\n0.963490 0.219010 0.086692 Na\n0.600175 0.694113 0.717756 Na\n0.317930 0.194114 0.282244 Na\n0.755028 0.248833 0.507587 Na\n0.262615 0.748833 0.492414 Na\n0.050181 0.719010 0.913309 Na\n0.455090 0.752624 0.067717 Na\n0.864675 0.747823 0.288530 Sn\n0.153204 0.247824 0.711470 Sn\n0.049964 0.971611 0.323540 O\n0.373503 0.471611 0.676461 O\n0.177812 0.511424 0.132439 O\n0.310250 0.011424 0.867562 O\n0.703112 0.962059 0.125061 O\n0.828172 0.462058 0.874940 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Na",
"Sn",
"O"
],
"chemical_system": "Na-O-Sn",
"density": 3.18853173833255,
"density_atomic": 0.05938682980358218,
"volume": 269.4200052927373,
"volume_molar": 10.140532471455057,
"formula_full": "Na8 Sn2 O6",
"formula_reduced": "Na4SnO3",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.5067097750000001,
"spacegroup": 9
},
{
"id": "jvasp-10862",
"created_at": "2022-09-04T14:38:34.431721Z",
"updated_at": "2022-09-04T14:38:34.431746Z",
"structure_string": "Al4 Se6\n1.0\n6.763729 -0.000000 0.000000\n-3.381864 5.034619 -3.046510\n0.000000 0.015215 7.418078\nAl Se\n4 6\ndirect\n0.638164 0.083379 0.128073 Al\n0.445216 0.083379 0.628074 Al\n0.267331 0.400401 0.116921 Al\n0.133069 0.400401 0.616921 Al\n0.909398 0.988555 0.988357 Se\n0.079158 0.988554 0.488357 Se\n0.593543 0.351217 0.013356 Se\n0.757675 0.351218 0.513356 Se\n0.241955 0.676250 0.003294 Se\n0.434297 0.676251 0.503294 Se\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Al",
"Se"
],
"chemical_system": "Al-Se",
"density": 3.819046433380892,
"density_atomic": 0.03953822009476318,
"volume": 252.91983240602414,
"volume_molar": 15.231188317446867,
"formula_full": "Al4 Se6",
"formula_reduced": "Al2Se3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.4226971400000004,
"spacegroup": 9
},
{
"id": "jvasp-119717",
"created_at": "2022-09-04T14:38:36.909277Z",
"updated_at": "2022-09-04T14:38:36.909301Z",
"structure_string": "Cr2 P6 O18\n1.0\n6.512582 -0.007161 -0.090337\n3.240673 5.649199 -0.090151\n-0.105243 -0.060489 9.501151\nCr P O\n2 6 18\ndirect\n0.659532 0.672201 0.499905 Cr\n0.672185 0.659517 0.999907 Cr\n0.774292 0.936237 0.762109 P\n0.936234 0.774295 0.262133 P\n0.287238 0.772582 0.738646 P\n0.772570 0.287239 0.238676 P\n0.938107 0.287151 0.749104 P\n0.287149 0.938099 0.249041 P\n0.753549 0.053297 0.248474 O\n0.053298 0.753555 0.748454 O\n0.929242 0.419324 0.882521 O\n0.419441 0.929180 0.382423 O\n0.910174 0.647056 0.135588 O\n0.647025 0.910252 0.635549 O\n0.053026 0.190171 0.246086 O\n0.190179 0.053026 0.746110 O\n0.903058 0.410200 0.612250 O\n0.755158 0.189177 0.755822 O\n0.410085 0.903094 0.112152 O\n0.690391 0.916206 0.904053 O\n0.661534 0.436260 0.366757 O\n0.436340 0.661446 0.866696 O\n0.394483 0.671829 0.597876 O\n0.671716 0.394555 0.097925 O\n0.189178 0.755154 0.255811 O\n0.916275 0.690359 0.404087 O\n",
"nsites": 26,
"nelements": 3,
"elements": [
"Cr",
"P",
"O"
],
"chemical_system": "Cr-O-P",
"density": 2.7437427542091513,
"density_atomic": 0.07434847858829906,
"volume": 349.70453321545,
"volume_molar": 8.099884320898212,
"formula_full": "Cr2 P6 O18",
"formula_reduced": "Cr(PO3)3",
"formula_anonymous": "AB3C9",
"energy_above_hull": 3.180834261538461,
"spacegroup": 9
},
{
"id": "jvasp-120448",
"created_at": "2022-09-04T14:38:37.961454Z",
"updated_at": "2022-09-04T14:38:37.961479Z",
"structure_string": "Cu8 Sn4 Se12\n1.0\n7.022913 0.000799 0.596154\n-3.582293 6.040570 0.596154\n-0.025135 -0.044135 13.546161\nCu Sn Se\n8 4 12\ndirect\n0.085559 0.918899 0.742383 Cu\n0.918898 0.085559 0.242383 Cu\n0.232150 0.739928 0.241350 Cu\n0.739927 0.232151 0.741350 Cu\n0.152786 0.315137 0.492013 Cu\n0.315136 0.152787 0.992013 Cu\n0.838142 0.659359 0.490858 Cu\n0.659359 0.838143 0.990858 Cu\n0.427520 0.573763 0.748958 Sn\n0.573762 0.427520 0.248958 Sn\n0.493106 0.004433 0.500098 Sn\n0.004432 0.493107 0.000098 Sn\n0.751693 0.911500 0.810624 Se\n0.114517 0.968707 0.561674 Se\n0.968706 0.114517 0.061674 Se\n0.477369 0.617630 0.548078 Se\n0.617630 0.477370 0.048078 Se\n0.557312 0.040909 0.298799 Se\n0.040908 0.557313 0.798799 Se\n0.832151 0.329153 0.560919 Se\n0.329153 0.832152 0.060919 Se\n0.394389 0.197493 0.811541 Se\n0.197492 0.394389 0.311541 Se\n0.911500 0.751693 0.310624 Se\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Cu",
"Sn",
"Se"
],
"chemical_system": "Cu-Se-Sn",
"density": 5.575069451661084,
"density_atomic": 0.04173412681179095,
"volume": 575.0689383830451,
"volume_molar": 14.429775390193601,
"formula_full": "Cu8 Sn4 Se12",
"formula_reduced": "Cu2SnSe3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.6438887833333333,
"spacegroup": 9
},
{
"id": "jvasp-111706",
"created_at": "2022-09-04T14:38:38.073817Z",
"updated_at": "2022-09-04T14:38:38.073841Z",
"structure_string": "Li8 Mn2 Ge4 S14\n1.0\n9.097344 0.013842 0.638857\n6.632948 6.226222 0.638857\n-0.032032 -0.012707 10.102776\nLi Mn Ge S\n8 2 4 14\ndirect\n0.568658 0.271505 0.292995 Li\n0.271506 0.568657 0.792996 Li\n0.025037 0.679683 0.140177 Li\n0.679684 0.025036 0.640177 Li\n0.975806 0.305970 0.218693 Li\n0.305971 0.975805 0.718693 Li\n0.894675 0.529704 0.858076 Li\n0.529705 0.894674 0.358076 Li\n0.818837 0.169330 0.940004 Mn\n0.169331 0.818836 0.440004 Mn\n0.396417 0.741597 0.079339 Ge\n0.741598 0.396416 0.579339 Ge\n0.448264 0.117752 0.018821 Ge\n0.117753 0.448264 0.518821 Ge\n0.568126 0.190754 0.853096 S\n0.508677 0.846522 0.926846 S\n0.846523 0.508676 0.426846 S\n0.678203 0.391571 0.129090 S\n0.391572 0.678203 0.629090 S\n0.271646 0.925786 0.265500 S\n0.925787 0.271645 0.765500 S\n0.143448 0.796361 0.985828 S\n0.796362 0.143446 0.485828 S\n0.652445 0.983039 0.192028 S\n0.983041 0.652444 0.692028 S\n0.098959 0.394943 0.052534 S\n0.394944 0.098958 0.552534 S\n0.190755 0.568125 0.353096 S\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Ge",
"S"
],
"chemical_system": "Ge-Li-Mn-S",
"density": 2.629359747618106,
"density_atomic": 0.04899714681857862,
"volume": 571.4618466188531,
"volume_molar": 12.290798854672369,
"formula_full": "Li8 Mn2 Ge4 S14",
"formula_reduced": "Li4MnGe2S7",
"formula_anonymous": "AB2C4D7",
"energy_above_hull": 1.8640192243842368,
"spacegroup": 9
},
{
"id": "jvasp-110587",
"created_at": "2022-09-04T14:38:38.147157Z",
"updated_at": "2022-09-04T14:38:38.147166Z",
"structure_string": "Ga2 Ag2 Se2 S2\n1.0\n5.330151 -0.011364 2.519372\n-1.207346 5.191624 2.519372\n-0.009021 -0.011335 6.773984\nGa Ag Se S\n2 2 2 2\ndirect\n0.249145 0.492921 0.501402 Ga\n0.492921 0.249146 0.001402 Ga\n0.735316 0.032876 0.498131 Ag\n0.032875 0.735315 -0.001868 Ag\n0.870663 0.605528 0.742395 Se\n0.605528 0.870663 0.242396 Se\n0.362605 0.160944 0.758070 S\n0.160944 0.362605 0.258071 S\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Ga",
"Ag",
"Se",
"S"
],
"chemical_system": "Ag-Ga-S-Se",
"density": 5.1076601382007025,
"density_atomic": 0.04262969066478645,
"volume": 187.6626331377128,
"volume_molar": 14.126634901844335,
"formula_full": "Ga2 Ag2 Se2 S2",
"formula_reduced": "GaAgSeS",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.5226282379166667,
"spacegroup": 9
},
{
"id": "jvasp-121786",
"created_at": "2022-09-04T14:38:55.473171Z",
"updated_at": "2022-09-04T14:38:55.473189Z",
"structure_string": "Li3 Co8 O4 F12\n1.0\n5.665763 0.027331 1.847424\n2.611400 5.028142 1.847424\n0.005770 0.003524 10.319021\nLi Co O F\n3 8 4 12\ndirect\n0.994694 0.994694 0.001649 Li\n0.828396 0.828394 0.554734 Li\n0.181885 0.181884 0.448640 Li\n0.022564 0.466093 0.006191 Co\n0.466093 0.022564 0.006191 Co\n0.274934 0.739657 0.739935 Co\n0.256140 0.256139 0.728394 Co\n0.739658 0.274933 0.739935 Co\n0.275334 0.745873 0.241411 Co\n0.745873 0.275334 0.241411 Co\n0.731329 0.731328 0.266597 Co\n0.647393 0.647393 0.121326 O\n0.111539 0.111539 0.130118 O\n0.368604 0.368602 0.859908 O\n0.111941 0.111940 0.653206 O\n0.106667 0.640040 0.128433 F\n0.354256 0.889623 0.879457 F\n0.889624 0.354255 0.879457 F\n0.875235 0.875233 0.890109 F\n0.132103 0.631180 0.626790 F\n0.638663 0.638661 0.620577 F\n0.631181 0.132102 0.626790 F\n0.378564 0.378563 0.360422 F\n0.362951 0.869684 0.375459 F\n0.875985 0.875984 0.359222 F\n0.869685 0.362950 0.375459 F\n0.640040 0.106666 0.128433 F\n",
"nsites": 27,
"nelements": 4,
"elements": [
"Li",
"Co",
"O",
"F"
],
"chemical_system": "Co-F-Li-O",
"density": 4.442285114272964,
"density_atomic": 0.0920994751260382,
"volume": 293.1612798341194,
"volume_molar": 6.538735157565987,
"formula_full": "Li3 Co8 O4 F12",
"formula_reduced": "Li3Co8(OF3)4",
"formula_anonymous": "A3B4C8D12",
"energy_above_hull": null,
"spacegroup": 8
}
]
}