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=id&page=956",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=954",
"results": [
{
"id": "jvasp-116728",
"created_at": "2022-09-04T14:38:44.852210Z",
"updated_at": "2022-09-04T14:38:44.852234Z",
"structure_string": "Ho4 Mg2 S8\n1.0\n6.789615 -0.000000 3.919986\n2.263205 6.401311 3.919986\n-0.000000 0.000000 7.839973\nHo Mg S\n4 2 8\ndirect\n0.625001 0.125000 0.625000 Ho\n0.625001 0.625000 0.125000 Ho\n0.125001 0.625000 0.625000 Ho\n0.625001 0.625000 0.625000 Ho\n0.000000 0.000000 0.000000 Mg\n0.250000 0.250000 0.250000 Mg\n0.379520 0.379519 0.379519 S\n0.861443 0.379519 0.379519 S\n0.379520 0.861442 0.379519 S\n0.379520 0.379519 0.861442 S\n0.870482 0.870481 0.388558 S\n0.870482 0.388557 0.870481 S\n0.388558 0.870481 0.870481 S\n0.870482 0.870481 0.870481 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ho",
"Mg",
"S"
],
"chemical_system": "Ho-Mg-S",
"density": 4.701980587238633,
"density_atomic": 0.04108652324085995,
"volume": 340.7443340466736,
"volume_molar": 14.657216734296634,
"formula_full": "Ho4 Mg2 S8",
"formula_reduced": "Ho2MgS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.2585585976190474,
"spacegroup": 227
},
{
"id": "jvasp-116729",
"created_at": "2022-09-04T14:38:45.142690Z",
"updated_at": "2022-09-04T14:38:45.142718Z",
"structure_string": "Mg1 Cu3 Sn4 O12\n1.0\n6.297428 -0.000000 -2.226477\n-3.148714 5.453732 -2.226477\n-0.000000 -0.000000 6.679431\nMg Cu Sn O\n1 3 4 12\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Cu\n0.500000 0.500000 -0.000000 Cu\n0.000000 0.500000 0.500000 Cu\n0.000000 0.500000 -0.000000 Sn\n0.500000 0.000000 -0.000000 Sn\n0.500000 0.500000 0.500000 Sn\n0.000000 0.000000 0.500000 Sn\n0.526797 0.832078 0.694718 O\n0.305281 0.473203 0.167921 O\n0.832079 0.694719 0.526796 O\n0.862641 0.167921 0.694719 O\n0.832079 0.305281 0.137359 O\n0.694720 0.862640 0.167921 O\n0.473204 0.167921 0.305281 O\n0.694720 0.526796 0.832078 O\n0.167922 0.694719 0.862640 O\n0.305281 0.137359 0.832078 O\n0.167922 0.305281 0.473203 O\n0.137360 0.832078 0.305280 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Mg",
"Cu",
"Sn",
"O"
],
"chemical_system": "Cu-Mg-O-Sn",
"density": 6.3827936132234075,
"density_atomic": 0.08718334432435941,
"volume": 229.40161512491912,
"volume_molar": 6.9074440842680405,
"formula_full": "Mg1 Cu3 Sn4 O12",
"formula_reduced": "MgCu3(SnO3)4",
"formula_anonymous": "AB3C4D12",
"energy_above_hull": 1.72717946,
"spacegroup": 204
},
{
"id": "jvasp-11673",
"created_at": "2022-09-04T14:38:06.165000Z",
"updated_at": "2022-09-04T14:38:06.165012Z",
"structure_string": "Nd2 V2 O8\n1.0\n5.908180 -0.001705 -1.710498\n-3.337514 4.875203 -1.710498\n0.000899 0.001705 6.150805\nNd V O\n2 2 8\ndirect\n0.875000 0.125000 0.750000 Nd\n0.125000 0.874999 0.250000 Nd\n0.625000 0.375000 0.250000 V\n0.375000 0.624999 0.750000 V\n0.794872 0.364324 0.069453 O\n0.794872 0.725419 0.430547 O\n0.635676 0.205129 0.430548 O\n0.205129 0.274581 0.569453 O\n0.205129 0.635675 0.930548 O\n0.274581 0.205129 0.069453 O\n0.725419 0.794871 0.930548 O\n0.364324 0.794871 0.569453 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Nd",
"V",
"O"
],
"chemical_system": "Nd-O-V",
"density": 4.858535251755674,
"density_atomic": 0.06773360368546762,
"volume": 177.1646471923156,
"volume_molar": 8.890920359065529,
"formula_full": "Nd2 V2 O8",
"formula_reduced": "NdVO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.35996995,
"spacegroup": 141
},
{
"id": "jvasp-116730",
"created_at": "2022-09-04T14:38:42.956184Z",
"updated_at": "2022-09-04T14:38:42.956221Z",
"structure_string": "Tm4 Sb4 O16\n1.0\n5.319134 -0.000000 0.000000\n0.000000 7.400856 1.081372\n-0.000000 -0.033386 7.565818\nTm Sb O\n4 4 16\ndirect\n0.726703 0.613443 0.143340 Tm\n0.273296 0.386558 0.856660 Tm\n0.773296 0.113442 0.143340 Tm\n0.226703 0.886558 0.856660 Tm\n0.769329 0.189590 0.663477 Sb\n0.230670 0.810411 0.336523 Sb\n0.269329 0.310410 0.336524 Sb\n0.730670 0.689590 0.663476 Sb\n0.486860 0.115927 0.824495 O\n0.513139 0.884073 0.175505 O\n0.521010 0.673573 0.889790 O\n0.478989 0.326427 0.110210 O\n0.021010 0.826427 0.110210 O\n0.978989 0.173573 0.889790 O\n0.402510 0.812797 0.572076 O\n0.608669 0.435360 0.670495 O\n0.891330 0.935361 0.670495 O\n0.108669 0.064640 0.329505 O\n0.986860 0.384073 0.175505 O\n0.391331 0.564640 0.329505 O\n0.097490 0.312797 0.572076 O\n0.902509 0.687204 0.427924 O\n0.597490 0.187203 0.427924 O\n0.013139 0.615927 0.824495 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Tm",
"Sb",
"O"
],
"chemical_system": "O-Sb-Tm",
"density": 7.904994029990615,
"density_atomic": 0.08052904312396908,
"volume": 298.0291217797485,
"volume_molar": 7.478222174736779,
"formula_full": "Tm4 Sb4 O16",
"formula_reduced": "TmSbO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.8942190583333336,
"spacegroup": 14
},
{
"id": "jvasp-116731",
"created_at": "2022-09-04T14:38:44.692258Z",
"updated_at": "2022-09-04T14:38:44.692290Z",
"structure_string": "Ti2 Cr2 Ag2 S8\n1.0\n6.321194 -0.004116 -3.524941\n-2.114713 5.892119 -3.632305\n-0.004197 0.004116 7.237588\nTi Cr Ag S\n2 2 2 8\ndirect\n0.992784 0.721216 0.228431 Ti\n0.007215 0.235647 0.728432 Ti\n0.499999 0.255042 0.755042 Cr\n0.000000 0.255042 0.255042 Cr\n0.372303 0.886552 0.014248 Ag\n0.627697 0.641945 0.514248 Ag\n0.757858 0.484026 0.226168 S\n0.759871 0.481853 0.766280 S\n0.215572 0.481852 0.221981 S\n0.765351 0.053682 0.788329 S\n0.234648 0.022977 0.288329 S\n0.242142 0.468310 0.726168 S\n0.784427 0.006408 0.266279 S\n0.240128 0.006409 0.721981 S\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Ti",
"Cr",
"Ag",
"S"
],
"chemical_system": "Ag-Cr-S-Ti",
"density": 4.13983456064632,
"density_atomic": 0.05194023333091744,
"volume": 269.5405681142078,
"volume_molar": 11.594366012243766,
"formula_full": "Ti2 Cr2 Ag2 S8",
"formula_reduced": "TiCrAgS4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.46550899904762,
"spacegroup": 46
},
{
"id": "jvasp-116732",
"created_at": "2022-09-04T14:38:44.740952Z",
"updated_at": "2022-09-04T14:38:44.740977Z",
"structure_string": "Na12 Fe4 O12\n1.0\n5.740055 0.024936 0.040766\n-2.438874 5.275413 -0.024774\n-0.091623 0.018119 12.597118\nNa Fe O\n12 4 12\ndirect\n0.860660 0.307608 0.778702 Na\n0.639340 0.192407 0.278691 Na\n0.238830 0.782108 0.484093 Na\n0.360641 0.807619 0.721308 Na\n0.738866 0.282083 0.015928 Na\n0.761186 0.217900 0.515903 Na\n0.295979 0.360188 0.597869 Na\n0.204043 0.139795 0.097866 Na\n0.704024 0.639811 0.402137 Na\n0.795993 0.860191 0.902129 Na\n0.261169 0.717883 0.984090 Na\n0.139344 0.692398 0.221300 Na\n0.826349 0.743155 0.663087 Fe\n0.673621 0.756836 0.163071 Fe\n0.173635 0.256840 0.336912 Fe\n0.326377 0.243174 0.836928 Fe\n0.578252 0.549011 0.772287 O\n0.921730 0.950965 0.272288 O\n0.421723 0.450994 0.227705 O\n0.078258 0.049016 0.727719 O\n0.500508 0.953670 0.126841 O\n-0.000560 0.546342 0.626837 O\n0.120120 0.300309 0.938605 O\n0.379930 0.199714 0.438601 O\n0.879903 0.699698 0.061404 O\n0.620074 0.800279 0.561392 O\n0.499489 0.046348 0.873164 O\n0.000545 0.453660 0.373154 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Na",
"Fe",
"O"
],
"chemical_system": "Fe-Na-O",
"density": 3.002934522879035,
"density_atomic": 0.0732520246102999,
"volume": 382.2419946610314,
"volume_molar": 8.221125343685355,
"formula_full": "Na12 Fe4 O12",
"formula_reduced": "Na3FeO3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 1.1661232857142858,
"spacegroup": 14
},
{
"id": "jvasp-116733",
"created_at": "2022-09-04T14:38:44.864628Z",
"updated_at": "2022-09-04T14:38:44.864661Z",
"structure_string": "Ga4 Fe2 N6\n1.0\n5.581426 0.000461 0.000000\n-2.784828 4.829794 0.000000\n0.000000 -0.000000 5.229999\nGa Fe N\n4 2 6\ndirect\n0.333278 0.331603 0.493826 Ga\n0.666722 0.998325 0.493826 Ga\n0.666722 0.668396 0.993826 Ga\n0.333278 0.001674 0.993826 Ga\n-0.000000 0.663795 0.490906 Fe\n-0.000000 0.336204 0.990906 Fe\n0.334803 0.335460 0.870444 N\n0.665197 0.000658 0.870444 N\n0.665197 0.664539 0.370444 N\n0.334803 0.999342 0.370444 N\n-0.000000 0.672246 0.868557 N\n-0.000000 0.327753 0.368557 N\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ga",
"Fe",
"N"
],
"chemical_system": "Fe-Ga-N",
"density": 5.58986190013771,
"density_atomic": 0.0851108992454804,
"volume": 140.99251807208734,
"volume_molar": 7.075639916141282,
"formula_full": "Ga4 Fe2 N6",
"formula_reduced": "Ga2FeN3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 3.294658316666667,
"spacegroup": 36
},
{
"id": "jvasp-116734",
"created_at": "2022-09-04T14:38:44.890271Z",
"updated_at": "2022-09-04T14:38:44.890290Z",
"structure_string": "Zn4 Cr4 N8\n1.0\n5.529221 -0.000000 0.000000\n0.000000 6.354600 0.000000\n-0.000000 -0.000000 5.212939\nZn Cr N\n4 4 8\ndirect\n0.588752 0.877983 0.001320 Zn\n0.411248 0.122017 0.501320 Zn\n0.911248 0.377983 0.501320 Zn\n0.088752 0.622017 0.001320 Zn\n0.575184 0.373311 0.998447 Cr\n0.424816 0.626689 0.498447 Cr\n0.924815 0.873311 0.498447 Cr\n0.075184 0.126689 0.998447 Cr\n0.566195 0.389219 0.355642 N\n0.433805 0.610781 0.855643 N\n0.933805 0.889219 0.855643 N\n0.066195 0.110781 0.355642 N\n0.602312 0.860126 0.394591 N\n0.397688 0.139874 0.894591 N\n0.897688 0.360126 0.894591 N\n0.102312 0.639874 0.394591 N\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Zn",
"Cr",
"N"
],
"chemical_system": "Cr-N-Zn",
"density": 5.273439150783844,
"density_atomic": 0.0873544779138551,
"volume": 183.16176093203202,
"volume_molar": 6.893911913638536,
"formula_full": "Zn4 Cr4 N8",
"formula_reduced": "ZnCrN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.286183575,
"spacegroup": 33
},
{
"id": "jvasp-116735",
"created_at": "2022-09-04T14:38:44.476107Z",
"updated_at": "2022-09-04T14:38:44.476124Z",
"structure_string": "Mg1 Fe10 N8\n1.0\n7.888837 0.007080 3.501029\n0.635170 3.108389 -0.000000\n-0.021341 0.004361 7.663887\nMg Fe N\n1 10 8\ndirect\n0.000000 0.500000 0.500000 Mg\n0.304093 0.847954 0.201210 Fe\n0.194727 0.402637 0.895079 Fe\n0.805274 0.597363 0.104921 Fe\n0.343621 0.328189 0.529822 Fe\n0.695907 0.152046 0.798791 Fe\n0.007119 0.996441 0.174432 Fe\n0.992882 0.003559 0.825568 Fe\n0.543496 0.228251 0.187376 Fe\n0.456504 0.771749 0.812624 Fe\n0.656380 0.671811 0.470178 Fe\n0.099011 0.450494 0.718029 N\n0.233332 0.883334 0.006694 N\n0.766669 0.116666 0.993306 N\n0.407372 0.796314 0.611219 N\n0.592628 0.203686 0.388782 N\n0.700947 0.649527 0.691196 N\n0.299053 0.350473 0.308804 N\n0.900990 0.549506 0.281972 N\n",
"nsites": 19,
"nelements": 3,
"elements": [
"Mg",
"Fe",
"N"
],
"chemical_system": "Fe-Mg-N",
"density": 6.1325011923908015,
"density_atomic": 0.10098967149801358,
"volume": 188.13805132907797,
"volume_molar": 5.963125407451645,
"formula_full": "Mg1 Fe10 N8",
"formula_reduced": "Mg(Fe5N4)2",
"formula_anonymous": "AB8C10",
"energy_above_hull": 4.951596844736842,
"spacegroup": 12
},
{
"id": "jvasp-116736",
"created_at": "2022-09-04T14:38:44.508870Z",
"updated_at": "2022-09-04T14:38:44.508902Z",
"structure_string": "Ti1 B12\n1.0\n4.503351 -0.000000 2.600010\n1.501117 4.245800 2.600010\n-0.000000 -0.000000 5.200021\nTi B\n1 12\ndirect\n0.000000 0.000000 0.000000 Ti\n0.840004 0.500000 0.500000 B\n0.500000 0.500000 0.840004 B\n0.840004 0.159996 0.500000 B\n0.500000 0.840004 0.159995 B\n0.500000 0.159996 0.840004 B\n0.500000 0.840004 0.500000 B\n0.840004 0.500000 0.159996 B\n0.159996 0.840004 0.500000 B\n0.500000 0.159996 0.500000 B\n0.159996 0.500000 0.840004 B\n0.500000 0.500000 0.159996 B\n0.159996 0.500000 0.500000 B\n",
"nsites": 13,
"nelements": 2,
"elements": [
"Ti",
"B"
],
"chemical_system": "B-Ti",
"density": 2.9661231965278216,
"density_atomic": 0.13075036925497283,
"volume": 99.4261054410412,
"volume_molar": 4.605830786035016,
"formula_full": "Ti1 B12",
"formula_reduced": "TiB12",
"formula_anonymous": "AB12",
"energy_above_hull": 5.430827641025641,
"spacegroup": 225
},
{
"id": "jvasp-116737",
"created_at": "2022-09-04T14:38:49.635651Z",
"updated_at": "2022-09-04T14:38:49.635681Z",
"structure_string": "V6 Ag3 N9\n1.0\n2.941768 -0.000000 0.000000\n-1.470884 2.547646 0.000000\n0.000000 0.000000 26.134531\nV Ag N\n6 3 9\ndirect\n0.765956 0.705486 0.214248 V\n0.939533 0.234047 0.880914 V\n0.294516 0.060468 0.547581 V\n0.234049 0.939534 0.119086 V\n0.705487 0.765955 0.785752 V\n0.060469 0.294516 0.452419 V\n0.366633 0.000000 0.333333 Ag\n0.633369 0.633368 -0.000000 Ag\n0.000001 0.366634 0.666667 Ag\n0.993202 0.361939 0.585293 N\n0.000001 0.322110 0.166667 N\n0.322110 0.000000 0.833333 N\n0.677892 0.677891 0.500000 N\n0.361940 0.993202 0.414707 N\n0.631264 0.638063 0.081373 N\n0.006800 0.368738 0.748040 N\n0.638064 0.631263 0.918627 N\n0.368738 0.006800 0.251960 N\n",
"nsites": 18,
"nelements": 3,
"elements": [
"V",
"Ag",
"N"
],
"chemical_system": "Ag-N-V",
"density": 6.403455007154934,
"density_atomic": 0.09189889574405072,
"volume": 195.86742424122403,
"volume_molar": 6.5530066615515965,
"formula_full": "V6 Ag3 N9",
"formula_reduced": "V2AgN3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 4.315302568333333,
"spacegroup": 152
},
{
"id": "jvasp-116738",
"created_at": "2022-09-04T14:38:44.936017Z",
"updated_at": "2022-09-04T14:38:44.936044Z",
"structure_string": "Mn4 Ir2 N6\n1.0\n5.318569 -0.020745 0.000000\n-2.815457 4.713509 0.000000\n-0.000000 -0.000000 4.949324\nMn Ir N\n4 2 6\ndirect\n0.373667 0.346914 0.494979 Mn\n0.626333 0.973248 0.494979 Mn\n0.626333 0.653087 0.994979 Mn\n0.373667 0.026754 0.994979 Mn\n-0.000000 0.596697 0.494201 Ir\n-0.000000 0.403304 0.994200 Ir\n0.317994 0.314982 0.865117 N\n0.682007 -0.003012 0.865117 N\n0.682006 0.685019 0.365117 N\n0.317994 0.003013 0.365117 N\n-0.000000 0.750431 0.873603 N\n-0.000000 0.249569 0.373604 N\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Mn",
"Ir",
"N"
],
"chemical_system": "Ir-Mn-N",
"density": 9.23226792540665,
"density_atomic": 0.09694138780331933,
"volume": 123.78613791197564,
"volume_molar": 6.212146222022416,
"formula_full": "Mn4 Ir2 N6",
"formula_reduced": "Mn2IrN3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 5.26738255545977,
"spacegroup": 36
}
]
}