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=-nsites&page=523",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nsites&page=521",
"results": [
{
"id": "jvasp-22948",
"created_at": "2022-09-04T14:38:19.178790Z",
"updated_at": "2022-09-04T14:38:19.178816Z",
"structure_string": "Yb2 Ga14 Au6\n1.0\n7.197922 -0.038178 4.529609\n2.482326 6.756448 4.529609\n-0.055009 -0.038178 8.504376\nYb Ga Au\n2 14 6\ndirect\n0.500000 0.500000 0.500000 Yb\n0.000000 0.000000 0.000000 Yb\n0.426921 0.646242 0.828584 Ga\n0.171417 0.573079 0.353758 Ga\n0.328584 0.146242 0.926921 Ga\n0.146242 0.926921 0.328584 Ga\n0.750000 0.750000 0.750001 Ga\n0.250000 0.250000 0.250000 Ga\n0.926921 0.328583 0.146243 Ga\n0.573079 0.353758 0.171417 Ga\n0.073080 0.671416 0.853758 Ga\n0.853758 0.073079 0.671417 Ga\n0.671417 0.853758 0.073080 Ga\n0.828584 0.426920 0.646243 Ga\n0.646242 0.828583 0.426921 Ga\n0.353758 0.171416 0.573080 Ga\n0.750000 0.067044 0.432956 Au\n0.067045 0.432955 0.750001 Au\n0.567045 0.250000 0.932956 Au\n0.250000 0.932955 0.567045 Au\n0.932956 0.567044 0.250000 Au\n0.432956 0.750000 0.067045 Au\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Yb",
"Ga",
"Au"
],
"chemical_system": "Au-Ga-Yb",
"density": 9.973535179539281,
"density_atomic": 0.05277012676753139,
"volume": 416.9025421696778,
"volume_molar": 11.412026327943797,
"formula_full": "Yb2 Ga14 Au6",
"formula_reduced": "YbGa7Au3",
"formula_anonymous": "AB3C7",
"energy_above_hull": 0.0,
"spacegroup": 167
},
{
"id": "jvasp-51743",
"created_at": "2022-09-04T14:38:14.121156Z",
"updated_at": "2022-09-04T14:38:14.121174Z",
"structure_string": "Li8 H6 Cl2 O6\n1.0\n0.000000 5.352658 -0.068893\n7.300702 0.000000 0.000000\n0.000000 -0.390596 -6.130747\nLi H Cl O\n8 6 2 6\ndirect\n0.069679 0.750000 0.916117 Li\n0.930321 0.250000 0.083883 Li\n0.395820 0.750000 0.666388 Li\n0.604180 0.250000 0.333612 Li\n0.649200 0.516212 0.855478 Li\n0.350799 0.016212 0.144522 Li\n0.350799 0.483788 0.144522 Li\n0.649200 0.983788 0.855478 Li\n0.813685 0.957094 0.240026 H\n0.186315 0.457094 0.759974 H\n0.186315 0.042906 0.759974 H\n0.813685 0.542906 0.240026 H\n0.159185 0.250000 0.393009 H\n0.840815 0.750000 0.606991 H\n0.168741 0.750000 0.321517 Cl\n0.831258 0.250000 0.678483 Cl\n0.753202 0.750000 0.742929 O\n0.246797 0.250000 0.257071 O\n0.286995 0.547385 0.842207 O\n0.713004 0.047385 0.157793 O\n0.713004 0.452615 0.157793 O\n0.286995 0.952615 0.842207 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"H",
"Cl",
"O"
],
"chemical_system": "Cl-H-Li-O",
"density": 1.5823045235212958,
"density_atomic": 0.09175277086616498,
"volume": 239.77477510832082,
"volume_molar": 6.563442938180239,
"formula_full": "Li8 H6 Cl2 O6",
"formula_reduced": "Li4H3ClO3",
"formula_anonymous": "AB3C3D4",
"energy_above_hull": 1.8051913243181816,
"spacegroup": 11
},
{
"id": "jvasp-55816",
"created_at": "2022-09-04T14:38:13.504475Z",
"updated_at": "2022-09-04T14:38:13.504496Z",
"structure_string": "Lu4 V4 O14\n1.0\n6.071406 -0.000000 3.505328\n2.023802 5.724176 3.505328\n-0.000000 -0.000000 7.010655\nLu V O\n4 4 14\ndirect\n0.000000 0.000000 0.000000 Lu\n0.499999 0.000000 -0.000000 Lu\n0.000001 0.499999 1.000000 Lu\n0.000000 0.000000 0.500000 Lu\n0.500000 0.499999 0.500001 V\n0.500000 0.499999 0.000001 V\n0.000001 0.499999 0.500000 V\n0.499999 0.000000 0.500000 V\n0.582499 0.167502 0.582498 O\n0.167501 0.582498 0.167502 O\n0.167502 0.167502 0.582498 O\n0.875000 0.875002 0.875000 O\n0.417503 0.417503 0.832498 O\n0.832498 0.417503 0.417502 O\n0.417502 0.832499 0.417502 O\n0.832498 0.417503 0.832498 O\n0.417502 0.832499 0.832498 O\n0.582499 0.582498 0.167502 O\n0.832499 0.832499 0.417501 O\n0.125001 0.124999 0.124999 O\n0.582499 0.167502 0.167502 O\n0.167501 0.582498 0.582498 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Lu",
"V",
"O"
],
"chemical_system": "Lu-O-V",
"density": 7.6851646209726825,
"density_atomic": 0.09029461097724217,
"volume": 243.64687728202153,
"volume_molar": 6.669435412394455,
"formula_full": "Lu4 V4 O14",
"formula_reduced": "Lu2V2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.8184576727272725,
"spacegroup": 227
},
{
"id": "jvasp-52550",
"created_at": "2022-09-04T14:38:12.857652Z",
"updated_at": "2022-09-04T14:38:12.857680Z",
"structure_string": "Sm6 Ta2 O14\n1.0\n5.377973 3.839210 0.000000\n-5.377973 3.839210 0.000000\n0.000000 0.000000 7.611757\nSm Ta O\n6 2 14\ndirect\n0.001159 0.463805 0.491616 Sm\n0.536195 0.998841 0.508384 Sm\n0.469055 0.469055 0.750000 Sm\n0.530945 0.530945 0.250000 Sm\n0.998841 0.536195 0.991616 Sm\n0.463805 0.001159 0.008384 Sm\n0.001502 0.001502 0.250000 Ta\n0.998498 0.998498 0.750000 Ta\n0.305002 0.051658 0.291098 O\n0.948342 0.694998 0.708902 O\n0.629513 0.370487 0.000000 O\n0.919927 0.676723 0.273699 O\n0.323277 0.080073 0.726301 O\n0.080073 0.323277 0.773699 O\n0.051658 0.305002 0.208902 O\n0.370487 0.629513 0.500000 O\n0.694998 0.948342 0.791099 O\n0.637264 0.362736 0.500000 O\n0.362736 0.637264 0.000000 O\n0.062670 0.937330 0.000000 O\n0.676723 0.919927 0.226301 O\n0.937330 0.062670 0.500000 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Sm",
"Ta",
"O"
],
"chemical_system": "O-Sm-Ta",
"density": 7.861229125911832,
"density_atomic": 0.06999181960866394,
"volume": 314.32244686601535,
"volume_molar": 8.604063722976205,
"formula_full": "Sm6 Ta2 O14",
"formula_reduced": "Sm3TaO7",
"formula_anonymous": "AB3C7",
"energy_above_hull": 2.772386393181818,
"spacegroup": 20
},
{
"id": "jvasp-54744",
"created_at": "2022-09-04T14:38:11.368436Z",
"updated_at": "2022-09-04T14:38:11.368463Z",
"structure_string": "Sr2 H8 O12\n1.0\n4.106006 2.923397 1.092577\n-4.106006 2.923397 -1.092577\n0.447900 0.000000 8.996003\nSr H O\n2 8 12\ndirect\n0.891082 0.842352 0.742828 Sr\n0.157649 0.108919 0.242828 Sr\n0.195639 0.682048 0.954260 H\n0.470524 0.223908 0.832661 H\n0.585272 0.143807 0.656891 H\n0.856194 0.414729 0.156891 H\n0.317953 0.804362 0.454260 H\n-0.223908 0.529477 0.332661 H\n0.336040 0.134881 0.521189 H\n0.865120 0.663961 0.021189 H\n0.463485 0.555911 0.937388 O\n0.463186 0.490193 0.576073 O\n-0.056924 0.527996 0.248320 O\n0.615924 -0.052261 0.175540 O\n0.052261 0.384077 0.675540 O\n0.054683 0.786594 0.977167 O\n0.213407 0.945318 0.477168 O\n0.635553 0.063546 0.051714 O\n0.936455 0.364448 0.551714 O\n0.444090 0.536516 0.437388 O\n0.472005 0.056924 0.748320 O\n0.509808 0.536815 0.076074 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Sr",
"H",
"O"
],
"chemical_system": "H-O-Sr",
"density": 2.9243449991968395,
"density_atomic": 0.1032352192755661,
"volume": 213.10556759970964,
"volume_molar": 5.833416931023395,
"formula_full": "Sr2 H8 O12",
"formula_reduced": "Sr(H2O3)2",
"formula_anonymous": "AB4C6",
"energy_above_hull": 2.5615624827272723,
"spacegroup": 9
},
{
"id": "jvasp-52088",
"created_at": "2022-09-04T14:38:07.390258Z",
"updated_at": "2022-09-04T14:38:07.390282Z",
"structure_string": "Ho4 Ru4 O14\n1.0\n6.211430 -0.000000 3.586171\n2.070477 5.856193 3.586171\n-0.000000 -0.000000 7.172342\nHo Ru O\n4 4 14\ndirect\n0.500000 0.500000 0.500000 Ho\n0.000000 0.500000 0.500000 Ho\n0.500000 0.000000 0.500000 Ho\n0.500000 0.500000 -0.000000 Ho\n0.000000 0.000000 0.000000 Ru\n0.000000 0.000000 0.500000 Ru\n0.500000 0.000000 -0.000000 Ru\n0.000000 0.500000 -0.000000 Ru\n0.625000 0.625000 0.625000 O\n0.375000 0.375000 0.375000 O\n0.335490 0.914510 0.914510 O\n0.914511 0.335489 0.335489 O\n0.914511 0.914510 0.335489 O\n0.335490 0.335489 0.914510 O\n0.335490 0.914510 0.335489 O\n0.085490 0.664510 0.085489 O\n0.664511 0.085489 0.664510 O\n0.664511 0.085489 0.085489 O\n0.085489 0.085489 0.664510 O\n0.664511 0.664510 0.085489 O\n0.914511 0.335489 0.914510 O\n0.085490 0.664510 0.664510 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Ho",
"Ru",
"O"
],
"chemical_system": "Ho-O-Ru",
"density": 8.19774855627893,
"density_atomic": 0.08432468246542622,
"volume": 260.8963278221673,
"volume_molar": 7.141610954146344,
"formula_full": "Ho4 Ru4 O14",
"formula_reduced": "Ho2Ru2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.935076057575757,
"spacegroup": 227
},
{
"id": "jvasp-31813",
"created_at": "2022-09-04T14:38:07.577192Z",
"updated_at": "2022-09-04T14:38:07.577219Z",
"structure_string": "V2 P2 Cl18\n1.0\n5.952843 0.000000 -0.000000\n-0.000000 9.587691 -3.194388\n0.000000 -0.049626 10.105714\nV P Cl\n2 2 18\ndirect\n0.619698 0.031139 0.468861 V\n0.380301 0.531139 0.968860 V\n0.000000 0.031133 0.968866 P\n0.000000 0.531134 0.468866 P\n0.805750 0.557759 0.632787 Cl\n0.805750 0.867212 0.942240 Cl\n0.194249 0.057759 0.132788 Cl\n0.194297 0.004529 0.804970 Cl\n0.805703 0.195029 0.995470 Cl\n0.805703 0.504529 0.304970 Cl\n0.194297 0.695029 0.495470 Cl\n0.366471 0.389405 0.110594 Cl\n0.633529 0.889405 0.610594 Cl\n0.366510 0.672873 0.827126 Cl\n0.251488 0.031132 0.468868 Cl\n0.748511 0.531132 0.968867 Cl\n0.232816 0.360210 0.797925 Cl\n0.767183 0.202074 0.639789 Cl\n0.767183 0.860211 0.297925 Cl\n0.232816 0.702074 0.139789 Cl\n0.194249 0.367212 0.442241 Cl\n0.633490 0.172873 0.327127 Cl\n",
"nsites": 22,
"nelements": 3,
"elements": [
"V",
"P",
"Cl"
],
"chemical_system": "Cl-P-V",
"density": 2.312707802592677,
"density_atomic": 0.038205717599742776,
"volume": 575.8300427826048,
"volume_molar": 15.762407143062127,
"formula_full": "V2 P2 Cl18",
"formula_reduced": "VPCl9",
"formula_anonymous": "ABC9",
"energy_above_hull": 0.8276387552272728,
"spacegroup": 67
},
{
"id": "jvasp-12807",
"created_at": "2022-09-04T14:38:13.997305Z",
"updated_at": "2022-09-04T14:38:13.997316Z",
"structure_string": "Rb8 In4 S10\n1.0\n7.074328 -0.044914 2.594368\n-0.256271 8.948517 2.749740\n-0.079995 -0.037857 10.933792\nRb In S\n8 4 10\ndirect\n0.766610 0.473666 0.664058 Rb\n0.233391 0.526335 0.335942 Rb\n0.506320 0.790639 0.912057 Rb\n0.459110 0.816256 0.452509 Rb\n0.540891 0.183745 0.547491 Rb\n0.880101 0.818848 0.090111 Rb\n0.119900 0.181153 0.909889 Rb\n0.493682 0.209362 0.087943 Rb\n0.031216 -0.007070 0.341114 In\n0.123286 0.593134 0.827517 In\n0.876715 0.406866 0.172482 In\n0.968785 0.007071 0.658886 In\n0.729906 0.521068 0.351975 S\n0.735873 0.113519 0.819468 S\n0.270095 0.478933 0.648025 S\n0.219006 0.479573 0.038460 S\n0.178648 0.158553 0.429102 S\n0.821354 0.841448 0.570898 S\n0.199490 0.870668 0.768017 S\n0.800511 0.129332 0.231983 S\n0.780995 0.520428 0.961540 S\n0.264128 0.886482 0.180531 S\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Rb",
"In",
"S"
],
"chemical_system": "In-Rb-S",
"density": 3.498775068001714,
"density_atomic": 0.03167000242651649,
"volume": 694.6636663841856,
"volume_molar": 19.015283544651115,
"formula_full": "Rb8 In4 S10",
"formula_reduced": "Rb4In2S5",
"formula_anonymous": "A2B4C5",
"energy_above_hull": 0.4199399945454546,
"spacegroup": 2
},
{
"id": "jvasp-45901",
"created_at": "2022-09-04T14:38:07.287382Z",
"updated_at": "2022-09-04T14:38:07.287414Z",
"structure_string": "Li4 Co4 Sn2 O12\n1.0\n5.142150 -0.012633 -0.000000\n2.547113 4.426697 -0.000000\n-0.000000 -0.000000 9.829995\nLi Co Sn O\n4 4 2 12\ndirect\n0.500000 0.170643 0.750000 Li\n0.499999 0.329357 0.250000 Li\n0.499999 0.670644 0.750000 Li\n0.499999 0.829358 0.250000 Li\n0.328153 0.335923 0.000000 Co\n0.328152 0.835923 0.500000 Co\n0.671847 0.164078 0.500000 Co\n0.671846 0.664078 0.000000 Co\n0.000000 0.000000 0.000000 Sn\n-0.000000 0.500000 0.500000 Sn\n0.640650 0.354381 0.893955 O\n0.640650 0.004969 0.106045 O\n0.359349 0.645620 0.106045 O\n0.359349 0.495032 0.606046 O\n0.359349 0.145620 0.393955 O\n-0.000000 0.146283 0.602549 O\n0.359348 0.995034 0.893955 O\n-0.000001 0.646284 0.897452 O\n-0.000000 0.353717 0.102548 O\n0.640650 0.504968 0.393955 O\n-0.000001 0.853718 0.397452 O\n0.640650 0.854381 0.606046 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"Co",
"Sn",
"O"
],
"chemical_system": "Co-Li-O-Sn",
"density": 5.1349277655745285,
"density_atomic": 0.09818188280251332,
"volume": 224.07392659449826,
"volume_molar": 6.133657848172619,
"formula_full": "Li4 Co4 Sn2 O12",
"formula_reduced": "Li2Co2SnO6",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 2.364874045454545,
"spacegroup": 64
},
{
"id": "jvasp-25777",
"created_at": "2022-09-04T14:38:14.088338Z",
"updated_at": "2022-09-04T14:38:14.088363Z",
"structure_string": "Y4 Si2 C2 O14\n1.0\n6.500488 -0.004220 0.011294\n-0.311998 6.610234 -0.004002\n-2.969164 -0.785802 5.925357\nY Si C O\n4 2 2 14\ndirect\n0.256512 0.668500 0.188368 Y\n0.251117 0.914203 0.701464 Y\n0.743488 0.331499 0.811632 Y\n0.748884 0.085796 0.298536 Y\n0.262921 0.158601 0.241201 Si\n0.737080 0.841399 0.758800 Si\n0.804903 0.588866 0.267009 C\n0.195098 0.411134 0.732991 C\n0.873447 0.666753 0.907971 O\n0.733905 0.402263 0.165465 O\n0.887575 0.967154 0.658804 O\n0.126553 0.333247 0.092029 O\n0.331875 0.983769 0.087716 O\n0.977368 0.353539 0.621627 O\n0.266095 0.597737 0.834535 O\n0.478694 0.751146 0.561448 O\n0.022633 0.646460 0.378373 O\n0.656017 0.715838 0.250401 O\n0.343984 0.284162 0.749600 O\n0.112425 0.032845 0.341197 O\n0.668125 0.016231 0.912285 O\n0.521307 0.248853 0.438552 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Y",
"Si",
"C",
"O"
],
"chemical_system": "C-O-Si-Y",
"density": 4.299862142978851,
"density_atomic": 0.08633977912590456,
"volume": 254.8072304877988,
"volume_molar": 6.9749318575603985,
"formula_full": "Y4 Si2 C2 O14",
"formula_reduced": "Y2SiCO7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 3.2258621818181816,
"spacegroup": 2
},
{
"id": "jvasp-44470",
"created_at": "2022-09-04T14:38:14.004577Z",
"updated_at": "2022-09-04T14:38:14.004594Z",
"structure_string": "Li12 Cr2 O8\n1.0\n4.521553 -0.000633 -0.000704\n0.000898 6.678271 0.000042\n0.001382 0.000076 6.678410\nLi Cr O\n12 2 8\ndirect\n0.250009 0.965244 0.534757 Li\n0.750012 0.034741 0.465256 Li\n0.178992 0.249995 0.750000 Li\n0.678993 0.249984 0.750011 Li\n0.749995 0.465265 0.465279 Li\n0.749994 0.465290 0.034711 Li\n0.750001 0.034712 0.034732 Li\n0.249994 0.534725 0.534743 Li\n0.821009 0.749988 0.250012 Li\n0.321008 0.749992 0.250005 Li\n0.249997 0.965275 0.965292 Li\n0.249992 0.534694 0.965302 Li\n0.749978 0.749998 0.750000 Cr\n0.250020 0.249990 0.250021 Cr\n0.439804 0.249993 0.520673 O\n0.060211 0.979330 0.250003 O\n0.560211 0.749991 0.020670 O\n0.560201 0.749991 0.479342 O\n0.060205 0.520648 0.250005 O\n0.939786 0.479336 0.750013 O\n0.439784 0.249994 0.979346 O\n0.939797 0.020653 0.750012 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Li",
"Cr",
"O"
],
"chemical_system": "Cr-Li-O",
"density": 2.5960911022224624,
"density_atomic": 0.10909325920847986,
"volume": 201.66232230680237,
"volume_molar": 5.520176776909326,
"formula_full": "Li12 Cr2 O8",
"formula_reduced": "Li6CrO4",
"formula_anonymous": "AB4C6",
"energy_above_hull": 1.8738974,
"spacegroup": 137
},
{
"id": "jvasp-46823",
"created_at": "2022-09-04T14:38:14.043058Z",
"updated_at": "2022-09-04T14:38:14.043084Z",
"structure_string": "K2 Nb2 P2 C2 O14\n1.0\n0.000000 5.026185 -0.418843\n6.456167 0.000000 0.000000\n0.000000 0.626951 -9.694182\nK Nb P C O\n2 2 2 2 14\ndirect\n0.903961 0.651655 0.157768 K\n0.096039 0.151655 0.842231 K\n0.266966 0.226104 0.329299 Nb\n0.733035 0.726104 0.670701 Nb\n0.325088 0.728766 0.433844 P\n0.674913 0.228766 0.566155 P\n0.477186 0.244404 0.072964 C\n0.522815 0.744404 0.927035 C\n0.383432 0.748255 0.821300 O\n0.719623 0.419362 0.658979 O\n0.725554 0.038872 0.656713 O\n0.127958 0.733226 0.569156 O\n0.383945 0.227525 0.536569 O\n0.616056 0.727525 0.463430 O\n0.616569 0.248255 0.178699 O\n0.274447 0.538872 0.343287 O\n0.280378 0.919363 0.341020 O\n0.788833 0.741764 0.880648 O\n0.211168 0.241764 0.119352 O\n0.427561 0.742219 0.051767 O\n0.872043 0.233226 0.430843 O\n0.572440 0.242219 -0.051767 O\n",
"nsites": 22,
"nelements": 5,
"elements": [
"K",
"Nb",
"P",
"C",
"O"
],
"chemical_system": "C-K-Nb-O-P",
"density": 3.0462160168574584,
"density_atomic": 0.07031454566610629,
"volume": 312.87978599006516,
"volume_molar": 8.56457323723113,
"formula_full": "K2 Nb2 P2 C2 O14",
"formula_reduced": "KNbPCO7",
"formula_anonymous": "ABCDE7",
"energy_above_hull": 3.155857945454545,
"spacegroup": 4
}
]
}