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=3481",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=3479",
"results": [
{
"id": "jvasp-28455",
"created_at": "2022-09-04T14:36:47.825440Z",
"updated_at": "2022-09-04T14:36:47.825463Z",
"structure_string": "Te2 Mo1 W2 Se4\n1.0\n3.401680 0.000000 -0.000000\n-1.700840 2.945929 -0.000000\n-0.000000 -0.000000 29.644711\nTe Mo W Se\n2 1 2 4\ndirect\n0.333113 0.666228 0.410275 Te\n0.333113 0.666228 0.283690 Te\n0.666449 0.332898 0.346982 Mo\n0.333432 0.666863 0.113405 W\n0.333432 0.666863 0.580560 W\n0.666761 0.333523 0.057602 Se\n0.666770 0.333539 0.524658 Se\n0.666770 0.333539 0.169307 Se\n0.666761 0.333523 0.636362 Se\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"Se"
],
"chemical_system": "Mo-Se-Te-W",
"density": 5.783407633632016,
"density_atomic": 0.030295599877064785,
"volume": 297.07284346640154,
"volume_molar": 19.87793865920129,
"formula_full": "Te2 Mo1 W2 Se4",
"formula_reduced": "Te2Mo(WSe2)2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 3.8031927666666663,
"spacegroup": 187
},
{
"id": "jvasp-101970",
"created_at": "2022-09-04T14:37:03.550194Z",
"updated_at": "2022-09-04T14:37:03.550214Z",
"structure_string": "Sn2 H8 C4 Cl4\n1.0\n3.960457 0.004963 0.004854\n1.969007 5.897743 1.593839\n-0.011826 0.021973 10.401788\nSn H C Cl\n2 8 4 4\ndirect\n0.987391 0.972480 0.270653 Sn\n0.980478 0.972513 0.770646 Sn\n0.926828 0.743377 0.592761 H\n0.697436 0.201401 0.948589 H\n0.270439 0.743570 0.092719 H\n0.040989 0.201640 0.448533 H\n0.623504 0.150405 0.453914 H\n0.165962 0.150728 0.953876 H\n0.801903 0.794244 0.087432 H\n0.344328 0.794602 0.587377 H\n0.055611 0.874801 0.580355 C\n0.912221 0.070208 0.460938 C\n0.957744 0.070220 0.960942 C\n0.010127 0.874749 0.080365 C\n0.643079 0.670444 0.861298 Cl\n0.341333 0.274573 0.679986 Cl\n0.626510 0.670419 0.361319 Cl\n0.324768 0.274539 0.179989 Cl\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Sn",
"H",
"C",
"Cl"
],
"chemical_system": "C-Cl-H-Sn",
"density": 2.978282376188953,
"density_atomic": 0.07415874682831407,
"volume": 242.72254817994764,
"volume_molar": 8.120607504252924,
"formula_full": "Sn2 H8 C4 Cl4",
"formula_reduced": "SnH4(CCl)2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 2.982983315,
"spacegroup": 15
},
{
"id": "jvasp-8576",
"created_at": "2022-09-04T14:37:03.723803Z",
"updated_at": "2022-09-04T14:37:03.723827Z",
"structure_string": "K2 Os1 Cl4 O2\n1.0\n5.863889 0.107106 -2.788500\n-3.551876 5.358915 -0.915758\n0.070990 -0.107106 6.492757\nK Os Cl O\n2 1 4 2\ndirect\n0.499999 0.750000 0.250000 K\n0.500000 0.250000 0.750000 K\n0.000000 0.000000 0.000000 Os\n0.510390 0.755195 0.755196 Cl\n0.489609 0.244804 0.244804 Cl\n-0.000001 0.244803 0.755196 Cl\n-0.000001 0.755195 0.244803 Cl\n-0.000001 0.790654 0.790655 O\n-0.000000 0.209344 0.209344 O\n",
"nsites": 9,
"nelements": 4,
"elements": [
"K",
"Os",
"Cl",
"O"
],
"chemical_system": "Cl-K-O-Os",
"density": 3.566257368620376,
"density_atomic": 0.043706962551961534,
"volume": 205.916848815569,
"volume_molar": 13.778447204699955,
"formula_full": "K2 Os1 Cl4 O2",
"formula_reduced": "K2Os(Cl2O)2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 1.0739849188888888,
"spacegroup": 139
},
{
"id": "jvasp-28523",
"created_at": "2022-09-04T14:37:04.401914Z",
"updated_at": "2022-09-04T14:37:04.401949Z",
"structure_string": "Te2 Mo2 W1 S4\n1.0\n3.310932 0.000000 0.000000\n-1.655466 2.867499 0.000000\n0.000000 0.000000 29.092001\nTe Mo W S\n2 2 1 4\ndirect\n0.333290 0.666582 0.413349 Te\n0.333290 0.666582 0.280616 Te\n0.333348 0.666698 0.115056 Mo\n0.333348 0.666698 0.578909 Mo\n0.666611 0.333223 0.346982 W\n0.666686 0.333372 0.062567 S\n0.666669 0.333339 0.526351 S\n0.666669 0.333339 0.167614 S\n0.666686 0.333372 0.631397 S\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"S"
],
"chemical_system": "Mo-S-Te-W",
"density": 4.564221639124878,
"density_atomic": 0.03258482397077371,
"volume": 276.20219793338043,
"volume_molar": 18.48142793529109,
"formula_full": "Te2 Mo2 W1 S4",
"formula_reduced": "Te2Mo2WS4",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 3.793167481481481,
"spacegroup": 187
},
{
"id": "jvasp-104002",
"created_at": "2022-09-04T14:36:51.255872Z",
"updated_at": "2022-09-04T14:36:51.255887Z",
"structure_string": "Sn2 H8 C4 F4\n1.0\n4.301360 0.113928 0.526829\n1.627895 5.544948 1.589978\n-0.090953 -0.138611 7.186864\nSn H C F\n2 8 4 4\ndirect\n0.577490 0.622511 0.459462 Sn\n0.077490 0.122512 0.959462 Sn\n0.168221 0.462753 0.115120 H\n0.536285 0.327916 0.255191 H\n0.904442 0.205187 0.377837 H\n0.798447 0.585980 0.991927 H\n0.668222 0.962754 0.615120 H\n0.404443 0.705187 0.877836 H\n0.036283 0.827916 0.755190 H\n0.298445 0.085982 0.491926 H\n0.758113 0.364730 0.278771 C\n0.942646 0.429856 0.094220 C\n0.442649 0.929855 0.594219 C\n0.258115 0.864731 0.778771 C\n0.192203 0.856288 0.217849 F\n0.132342 0.542930 0.531197 F\n0.692202 0.356288 0.717849 F\n0.632341 0.042930 0.031197 F\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Sn",
"H",
"C",
"F"
],
"chemical_system": "C-F-H-Sn",
"density": 3.585004992929912,
"density_atomic": 0.1051659870304502,
"volume": 171.15799992242933,
"volume_molar": 5.7263198207385475,
"formula_full": "Sn2 H8 C4 F4",
"formula_reduced": "SnH4(CF)2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 2.8711091405555558,
"spacegroup": 8
},
{
"id": "jvasp-28476",
"created_at": "2022-09-04T14:37:17.458414Z",
"updated_at": "2022-09-04T14:37:17.458430Z",
"structure_string": "Mo1 W2 Se4 S2\n1.0\n3.279431 -0.000004 -0.000026\n-1.639719 2.840083 0.000104\n-0.000251 0.000779 27.922468\nMo W Se S\n1 2 4 2\ndirect\n0.666784 0.333571 0.344250 Mo\n0.333204 0.666537 0.114560 W\n0.333316 0.666506 0.582140 W\n0.333443 0.666864 0.404782 Se\n0.666662 0.333221 0.521229 Se\n0.666638 0.333131 0.642973 Se\n0.333469 0.666957 0.283729 Se\n0.666541 0.333223 0.059224 S\n0.666545 0.333192 0.169952 S\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-W",
"density": 5.386386274537974,
"density_atomic": 0.03460664387888485,
"volume": 260.0656692251896,
"volume_molar": 17.4016896324188,
"formula_full": "Mo1 W2 Se4 S2",
"formula_reduced": "MoW2(Se2S)2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 4.030777707407408,
"spacegroup": 156
},
{
"id": "jvasp-28538",
"created_at": "2022-09-04T14:37:32.462245Z",
"updated_at": "2022-09-04T14:37:32.462268Z",
"structure_string": "Mo2 W1 Se2 S4\n1.0\n3.235775 0.000000 0.000000\n-1.617887 2.802271 0.000000\n0.000000 0.000000 27.831213\nMo W Se S\n2 1 2 4\ndirect\n0.333377 0.666755 0.115522 Mo\n0.333377 0.666755 0.578443 Mo\n0.666556 0.333116 0.346982 W\n0.333222 0.666446 0.408677 Se\n0.333222 0.666446 0.285288 Se\n0.666696 0.333393 0.059785 S\n0.666722 0.333447 0.522635 S\n0.666722 0.333447 0.171330 S\n0.666696 0.333393 0.634179 S\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-W",
"density": 4.355328285210789,
"density_atomic": 0.035663332827846346,
"volume": 252.36003722491958,
"volume_molar": 16.88608518185895,
"formula_full": "Mo2 W1 Se2 S4",
"formula_reduced": "Mo2W(SeS2)2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 3.89338317037037,
"spacegroup": 187
},
{
"id": "jvasp-42296",
"created_at": "2022-09-04T14:37:28.380330Z",
"updated_at": "2022-09-04T14:37:28.380350Z",
"structure_string": "K2 Li4 Mn4 O8\n1.0\n0.000000 3.247522 0.020238\n12.493117 0.000000 0.000000\n0.000000 -0.323598 -5.398177\nK Li Mn O\n2 4 4 8\ndirect\n0.944574 0.250000 0.349146 K\n0.055425 0.750000 0.650854 K\n0.532286 0.643617 0.142460 Li\n0.532286 0.856384 0.142460 Li\n0.467713 0.356384 0.857540 Li\n0.467713 0.143617 0.857540 Li\n0.499999 0.500000 0.500000 Mn\n0.499999 0.000000 0.500000 Mn\n0.000000 0.500000 0.000000 Mn\n0.000000 0.000000 0.000000 Mn\n0.957837 0.099837 0.718611 O\n0.042162 0.599837 0.281389 O\n0.042162 0.900163 0.281389 O\n0.577971 0.588917 0.828997 O\n0.577971 0.911083 0.828997 O\n0.422028 0.411083 0.171003 O\n0.422028 0.088917 0.171003 O\n0.957837 0.400163 0.718611 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"K",
"Li",
"Mn",
"O"
],
"chemical_system": "K-Li-Mn-O",
"density": 3.4412621386993147,
"density_atomic": 0.08221759070061253,
"volume": 218.93125116673966,
"volume_molar": 7.324637840494558,
"formula_full": "K2 Li4 Mn4 O8",
"formula_reduced": "KLi2Mn2O4",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 2.253710720306513,
"spacegroup": 11
},
{
"id": "jvasp-28493",
"created_at": "2022-09-04T14:37:33.920274Z",
"updated_at": "2022-09-04T14:37:33.920312Z",
"structure_string": "Mo1 W2 Se2 S4\n1.0\n3.235943 0.000000 -0.000635\n-1.617965 2.802345 -0.000826\n-0.007244 -0.013544 19.667275\nMo W Se S\n1 2 2 4\ndirect\n0.665946 0.331627 0.343164 Mo\n0.332295 0.666124 0.026893 W\n0.335070 0.668866 0.670875 W\n0.667767 0.334854 0.583558 Se\n0.669051 0.336231 0.758182 Se\n0.333175 0.665556 0.422131 S\n0.665053 0.332193 -0.052448 S\n0.666205 0.333394 0.106252 S\n0.332053 0.664367 0.264231 S\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-W",
"density": 6.98116709103164,
"density_atomic": 0.05046334197815531,
"volume": 178.3472843296019,
"volume_molar": 11.93369389329561,
"formula_full": "Mo1 W2 Se2 S4",
"formula_reduced": "MoW2(SeS2)2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 4.150421403703704,
"spacegroup": 156
},
{
"id": "jvasp-28490",
"created_at": "2022-09-04T14:37:33.384316Z",
"updated_at": "2022-09-04T14:37:33.384340Z",
"structure_string": "Te2 Mo1 W2 Se4\n1.0\n3.405355 0.000001 -0.000001\n-1.702677 2.949148 -0.000315\n-0.000006 -0.002771 29.155046\nTe Mo W Se\n2 1 2 4\ndirect\n0.333527 0.667057 0.411306 Te\n0.333413 0.666830 0.282003 Te\n0.333104 0.666210 0.110117 Mo\n0.333399 0.666801 0.584170 W\n0.666804 0.333610 0.346659 W\n0.666384 0.332771 0.053677 Se\n0.666662 0.333327 0.527379 Se\n0.666495 0.332991 0.166666 Se\n0.666800 0.333604 0.640866 Se\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"Se"
],
"chemical_system": "Mo-Se-Te-W",
"density": 5.867782348736825,
"density_atomic": 0.03073758542788292,
"volume": 292.8011382389148,
"volume_molar": 19.592107435144037,
"formula_full": "Te2 Mo1 W2 Se4",
"formula_reduced": "Te2Mo(WSe2)2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 3.8058605444444447,
"spacegroup": 156
},
{
"id": "jvasp-28532",
"created_at": "2022-09-04T14:37:28.461349Z",
"updated_at": "2022-09-04T14:37:28.461370Z",
"structure_string": "Mo2 W1 Se4 S2\n1.0\n3.278356 0.000000 -0.000000\n-1.639178 2.839141 -0.000010\n-0.000000 -0.000104 28.328847\nMo W Se S\n2 1 4 2\ndirect\n0.333307 0.666615 0.115413 Mo\n0.666675 0.333348 0.349536 Mo\n0.333332 0.666662 0.575997 W\n0.333343 0.666687 0.409202 Se\n0.666643 0.333282 0.055796 Se\n0.666641 0.333281 0.175108 Se\n0.333337 0.666674 0.289853 Se\n0.666661 0.333320 0.521386 S\n0.666668 0.333333 0.630550 S\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-W",
"density": 4.759055835980812,
"density_atomic": 0.03413269161295252,
"volume": 263.6768322303864,
"volume_molar": 17.643322209358796,
"formula_full": "Mo2 W1 Se4 S2",
"formula_reduced": "Mo2W(Se2S)2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 3.7694405851851847,
"spacegroup": 156
},
{
"id": "jvasp-28480",
"created_at": "2022-09-04T14:37:28.235058Z",
"updated_at": "2022-09-04T14:37:28.235081Z",
"structure_string": "Te2 Mo2 W1 Se4\n1.0\n3.405283 -0.000540 -0.001245\n-1.702263 2.946101 -0.136943\n0.010262 -1.022129 20.470708\nTe Mo W Se\n2 2 1 4\ndirect\n0.525050 0.049875 -0.077057 Te\n0.586477 0.173091 0.106747 Te\n0.222430 0.444790 0.014789 Mo\n0.668901 0.337632 0.353042 Mo\n0.441988 0.884198 0.673088 W\n0.362551 0.725092 0.433784 Se\n0.748185 0.496450 0.591972 Se\n0.802452 0.605287 0.754254 Se\n0.308563 0.616781 0.272222 Se\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"Se"
],
"chemical_system": "Mo-Se-Te-W",
"density": 7.673771030410849,
"density_atomic": 0.0439301157516192,
"volume": 204.8708464800317,
"volume_molar": 13.708456390256682,
"formula_full": "Te2 Mo2 W1 Se4",
"formula_reduced": "Te2Mo2WSe4",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 3.5388767555555543,
"spacegroup": 160
}
]
}