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=-density&page=4166",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=4164",
"results": [
{
"id": "jvasp-78469",
"created_at": "2022-09-04T14:36:34.776582Z",
"updated_at": "2022-09-04T14:36:34.776616Z",
"structure_string": "Na1 O1\n1.0\n2.847484 -0.000000 -0.000000\n-0.000000 2.847484 -0.000000\n0.000000 0.000000 2.847484\nNa O\n1 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.499999 0.499999 0.499999 O\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Na",
"O"
],
"chemical_system": "Na-O",
"density": 2.8042014020340575,
"density_atomic": 0.08662557258913896,
"volume": 23.08787047776188,
"volume_molar": 6.951920293286524,
"formula_full": "Na1 O1",
"formula_reduced": "NaO",
"formula_anonymous": "AB",
"energy_above_hull": 0.227395875,
"spacegroup": 221
},
{
"id": "jvasp-114160",
"created_at": "2022-09-04T14:38:40.588631Z",
"updated_at": "2022-09-04T14:38:40.588661Z",
"structure_string": "Ca1 Ge1 H1\n1.0\n4.822301 -0.000000 0.000000\n-2.411150 4.176235 -0.000000\n-0.000000 -0.000000 3.344360\nCa Ge H\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ca\n0.333334 0.666668 0.000000 Ge\n0.666667 0.333334 0.000000 H\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Ge",
"H"
],
"chemical_system": "Ca-Ge-H",
"density": 2.8038602814348246,
"density_atomic": 0.04454192585792363,
"volume": 67.35227411515987,
"volume_molar": 13.520162507586575,
"formula_full": "Ca1 Ge1 H1",
"formula_reduced": "CaGeH",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0294621233333334,
"spacegroup": 187
},
{
"id": "jvasp-46752",
"created_at": "2022-09-04T14:38:03.817140Z",
"updated_at": "2022-09-04T14:38:03.817158Z",
"structure_string": "Li6 Mn1 Cr1 P2 C2 O14\n1.0\n0.000000 4.934712 0.075261\n6.370040 0.000000 0.000000\n0.000000 -0.776443 -8.651599\nLi Mn Cr P C O\n6 1 1 2 2 14\ndirect\n0.804086 0.500000 0.887377 Li\n0.277422 0.268142 0.735220 Li\n0.277422 0.731858 0.735220 Li\n0.718901 0.767402 0.264439 Li\n0.718901 0.232599 0.264439 Li\n0.193962 0.000000 0.104652 Li\n0.777324 0.000000 0.653932 Mn\n0.195440 0.500000 0.334253 Cr\n0.265762 0.000000 0.406880 P\n0.745714 0.500000 0.595542 P\n0.668395 0.000000 0.960574 C\n0.323096 0.500000 0.040564 C\n0.485161 0.500000 0.172043 O\n0.149225 0.811742 0.306000 O\n0.149225 0.188259 0.306000 O\n0.832452 0.500000 0.429922 O\n0.583806 0.000000 0.417244 O\n0.431460 0.500000 0.588419 O\n0.921730 0.000000 0.940904 O\n0.865508 0.688503 0.694819 O\n0.865508 0.311497 0.694819 O\n0.489226 0.000000 0.837938 O\n0.424126 0.500000 0.909039 O\n0.586571 0.000000 0.098502 O\n0.183067 0.000000 0.571662 O\n0.066514 0.500000 0.049602 O\n",
"nsites": 26,
"nelements": 6,
"elements": [
"Li",
"Mn",
"Cr",
"P",
"C",
"O"
],
"chemical_system": "C-Cr-Li-Mn-O-P",
"density": 2.803634845607705,
"density_atomic": 0.09573436022287798,
"volume": 271.5848305610412,
"volume_molar": 6.290469530459,
"formula_full": "Li6 Mn1 Cr1 P2 C2 O14",
"formula_reduced": "Li6MnCrP2(CO7)2",
"formula_anonymous": "ABC2D2E6F14",
"energy_above_hull": 3.1171717169761277,
"spacegroup": 6
},
{
"id": "jvasp-34636",
"created_at": "2022-09-04T14:37:12.475583Z",
"updated_at": "2022-09-04T14:37:12.475608Z",
"structure_string": "Si4 O8\n1.0\n5.129491 -0.017871 0.033309\n-2.537366 4.889320 0.010052\n-0.963379 -1.212749 5.673608\nSi O\n4 8\ndirect\n0.828242 0.503240 0.397060 Si\n-0.004522 0.064971 0.472916 Si\n0.529165 0.270243 0.911000 Si\n0.131000 0.768539 0.082959 Si\n0.402743 0.941653 0.950831 O\n0.028969 0.993924 0.200220 O\n0.775917 0.206522 0.465748 O\n0.550168 0.432440 0.170271 O\n0.160288 0.631761 0.318075 O\n0.310721 0.268324 0.675139 O\n0.841509 0.767960 0.565614 O\n0.879272 0.476522 0.889007 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Si",
"O"
],
"chemical_system": "O-Si",
"density": 2.8034332730803984,
"density_atomic": 0.08429491458297077,
"volume": 142.35734218804507,
"volume_molar": 7.144132940632448,
"formula_full": "Si4 O8",
"formula_reduced": "SiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.4593052000000002,
"spacegroup": 1
},
{
"id": "jvasp-35418",
"created_at": "2022-09-04T14:37:38.067000Z",
"updated_at": "2022-09-04T14:37:38.067021Z",
"structure_string": "Rb2 Mg1 Cl4\n1.0\n4.967316 -0.000000 -0.000000\n-0.000000 4.967316 -0.000000\n-2.483657 -2.483657 8.091481\nRb Mg Cl\n2 1 4\ndirect\n0.356434 0.356434 0.712868 Rb\n0.643566 0.643566 0.287132 Rb\n0.000000 0.000000 0.000000 Mg\n0.156010 0.156010 0.312021 Cl\n0.843990 0.843990 0.687978 Cl\n0.000000 0.500000 0.000000 Cl\n0.500000 0.000000 0.000000 Cl\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Rb",
"Mg",
"Cl"
],
"chemical_system": "Cl-Mg-Rb",
"density": 2.803336183470353,
"density_atomic": 0.03506117315281241,
"volume": 199.6510490248242,
"volume_molar": 17.176096001559312,
"formula_full": "Rb2 Mg1 Cl4",
"formula_reduced": "Rb2MgCl4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-97420",
"created_at": "2022-09-04T14:36:04.990987Z",
"updated_at": "2022-09-04T14:36:04.991004Z",
"structure_string": "As2 C2 S6 N4 F22\n1.0\n5.673704 -0.132580 -0.519699\n-1.878526 7.079632 -0.897658\n0.353097 -0.362402 12.491954\nAs C S N F\n2 2 6 4 22\ndirect\n0.514396 0.776121 0.817783 As\n0.485603 0.223879 0.182216 As\n0.045868 0.744981 0.271492 C\n0.954132 0.255019 0.728507 C\n0.180876 0.747369 0.409718 S\n0.819124 0.252631 0.590281 S\n0.834086 0.832129 0.121305 S\n0.917180 0.417730 0.839273 S\n0.165913 0.167871 0.878695 S\n0.082820 0.582270 0.160726 S\n0.922379 0.861665 0.250725 N\n0.060059 0.339688 0.927707 N\n0.077620 0.138335 0.749274 N\n0.939940 0.660312 0.072292 N\n0.701359 0.257028 0.472635 F\n0.187819 0.966065 0.447668 F\n0.652009 0.781995 0.696759 F\n0.534254 0.477120 0.200426 F\n0.452281 0.814422 0.370529 F\n0.616497 0.230868 0.056892 F\n0.298641 0.742972 0.527365 F\n0.820505 0.473493 0.628400 F\n0.547718 0.185578 0.629470 F\n0.777966 0.255026 0.249958 F\n0.222033 0.744974 0.750041 F\n0.347991 0.218004 0.303240 F\n0.432028 0.970558 0.161644 F\n0.806679 0.811159 0.892190 F\n0.909646 0.678019 0.446734 F\n0.179494 0.526507 0.371600 F\n0.465745 0.522880 0.799574 F\n0.567971 0.029442 0.838355 F\n0.383503 0.769132 0.943108 F\n0.193320 0.188840 0.107809 F\n0.812180 0.033935 0.552331 F\n0.090353 0.321981 0.553265 F\n",
"nsites": 36,
"nelements": 5,
"elements": [
"As",
"C",
"S",
"N",
"F"
],
"chemical_system": "As-C-F-N-S",
"density": 2.802833756832533,
"density_atomic": 0.07231762405795905,
"volume": 497.803965063174,
"volume_molar": 8.327348745823768,
"formula_full": "As2 C2 S6 N4 F22",
"formula_reduced": "AsCS3N2F11",
"formula_anonymous": "ABC2D3E11",
"energy_above_hull": 1.5143961865277773,
"spacegroup": 2
},
{
"id": "jvasp-38263",
"created_at": "2022-09-04T14:37:41.075949Z",
"updated_at": "2022-09-04T14:37:41.075967Z",
"structure_string": "Rb3 Dy1\n1.0\n6.284677 -0.000000 0.000000\n0.000000 6.284677 0.000000\n-0.000000 0.000000 6.284677\nRb Dy\n3 1\ndirect\n0.000000 0.500000 0.500000 Rb\n0.500000 0.500000 0.000000 Rb\n0.500000 0.000000 0.500000 Rb\n0.000000 0.000000 0.000000 Dy\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"Dy"
],
"chemical_system": "Dy-Rb",
"density": 2.802296578015264,
"density_atomic": 0.01611428739886682,
"volume": 248.22692440506464,
"volume_molar": 37.37143697972947,
"formula_full": "Rb3 Dy1",
"formula_reduced": "Rb3Dy",
"formula_anonymous": "AB3",
"energy_above_hull": 2.000000000002e-05,
"spacegroup": 221
},
{
"id": "jvasp-52905",
"created_at": "2022-09-04T14:36:52.014137Z",
"updated_at": "2022-09-04T14:36:52.014157Z",
"structure_string": "Rb2 H4 N2\n1.0\n0.000000 4.827596 -0.027694\n3.920227 0.000000 0.000000\n0.000000 -0.912059 -6.350431\nRb H N\n2 4 2\ndirect\n0.211457 0.750000 0.305456 Rb\n0.788544 0.250000 0.694544 Rb\n0.323358 0.545969 0.870585 H\n0.676643 0.045969 0.129414 H\n0.676643 0.454031 0.129414 H\n0.323358 0.954032 0.870585 H\n0.283046 0.750000 0.768798 N\n0.716954 0.250000 0.231201 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Rb",
"H",
"N"
],
"chemical_system": "H-N-Rb",
"density": 2.8022118672381313,
"density_atomic": 0.06651000541995097,
"volume": 120.28265445908751,
"volume_molar": 9.054488451738333,
"formula_full": "Rb2 H4 N2",
"formula_reduced": "RbH2N",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.2416733125,
"spacegroup": 11
},
{
"id": "jvasp-18564",
"created_at": "2022-09-04T14:36:48.793269Z",
"updated_at": "2022-09-04T14:36:48.793294Z",
"structure_string": "Li1 Mg2 Ge1\n1.0\n4.116987 -0.000000 2.376944\n1.372329 3.881533 2.376944\n0.000000 -0.000000 4.753887\nLi Mg Ge\n1 2 1\ndirect\n0.500001 0.500000 0.499999 Li\n0.250000 0.250000 0.250000 Mg\n0.750001 0.749999 0.749999 Mg\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Mg",
"Ge"
],
"chemical_system": "Ge-Li-Mg",
"density": 2.8020443191079654,
"density_atomic": 0.052653635001701914,
"volume": 75.96816439872971,
"volume_molar": 11.437274482199276,
"formula_full": "Li1 Mg2 Ge1",
"formula_reduced": "LiMg2Ge",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-62361",
"created_at": "2022-09-04T14:36:05.527767Z",
"updated_at": "2022-09-04T14:36:05.527788Z",
"structure_string": "Li12 Al4 F24\n1.0\n4.891268 0.000000 0.000000\n0.000000 8.279740 0.000000\n0.000000 0.000000 9.470359\nLi Al F\n12 4 24\ndirect\n0.508320 0.648460 0.625334 Li\n0.008320 0.351540 0.374666 Li\n0.508320 0.851540 0.125334 Li\n0.008320 0.148460 0.874667 Li\n0.494720 0.544880 0.896688 Li\n0.994720 0.455120 0.103312 Li\n0.494720 0.955120 0.396688 Li\n0.994720 0.044880 0.603313 Li\n0.002545 0.453843 0.647242 Li\n0.502545 0.546157 0.352758 Li\n0.002545 0.046157 0.147242 Li\n0.502545 0.953843 0.852758 Li\n0.499885 0.260516 0.628490 Al\n-0.000116 0.739484 0.371510 Al\n0.499885 0.239484 0.128490 Al\n-0.000116 0.760516 0.871510 Al\n0.330713 0.090035 0.011430 F\n0.830713 0.909965 0.988570 F\n0.674711 0.117999 0.746493 F\n0.174711 0.882001 0.253507 F\n0.674711 0.382001 0.246493 F\n0.174711 0.617999 0.753507 F\n0.348334 0.097208 0.528296 F\n0.848335 0.902792 0.471704 F\n0.348334 0.402792 0.028296 F\n0.848335 0.597208 0.971704 F\n0.194996 0.268905 0.738572 F\n0.641491 0.434451 0.725749 F\n0.194996 0.231095 0.238571 F\n0.694996 0.768905 0.761429 F\n0.811456 0.255763 0.522889 F\n0.311456 0.744237 0.477111 F\n0.811456 0.244237 0.022889 F\n0.311456 0.755763 0.977111 F\n0.830713 0.590035 0.488570 F\n0.141491 0.565549 0.274251 F\n0.641491 0.065549 0.225749 F\n0.141491 0.934451 0.774251 F\n0.694996 0.731095 0.261429 F\n0.330713 0.409965 0.511430 F\n",
"nsites": 40,
"nelements": 3,
"elements": [
"Li",
"Al",
"F"
],
"chemical_system": "Al-F-Li",
"density": 2.802008645770404,
"density_atomic": 0.10429305530186107,
"volume": 383.53464556413485,
"volume_molar": 5.774249054809824,
"formula_full": "Li12 Al4 F24",
"formula_reduced": "Li3AlF6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0035544495,
"spacegroup": 33
},
{
"id": "jvasp-111891",
"created_at": "2022-09-04T14:38:42.050505Z",
"updated_at": "2022-09-04T14:38:42.050532Z",
"structure_string": "Li16 Co2 O10 F2\n1.0\n5.242851 0.061337 0.526847\n-0.243894 5.666584 0.768663\n0.069022 -0.067978 8.508974\nLi Co O F\n16 2 10 2\ndirect\n0.345658 0.234781 0.120872 Li\n0.141882 0.275478 0.381361 Li\n0.345116 0.914350 0.449965 Li\n0.845165 0.414369 0.949945 Li\n0.810879 0.057174 0.285441 Li\n0.310911 0.557160 0.785454 Li\n0.019142 0.318493 0.662249 Li\n0.519145 0.818459 0.162280 Li\n0.641931 0.775497 0.881361 Li\n0.505905 0.151975 0.859675 Li\n0.183494 0.942349 0.705020 Li\n0.683468 0.442305 0.204980 Li\n0.666969 0.099346 0.562519 Li\n0.167009 0.599325 0.062479 Li\n0.845667 0.734809 0.620821 Li\n0.005820 0.651984 0.359560 Li\n0.987124 -0.000391 0.974939 Co\n0.487082 0.499595 0.474925 Co\n0.329956 0.198808 0.557546 O\n0.829991 0.698819 0.057553 O\n0.797389 0.345854 0.405997 O\n0.297433 0.845871 0.906011 O\n0.190252 0.647975 0.580899 O\n0.833447 0.013392 0.747782 O\n0.671743 0.798908 0.432737 O\n0.171799 0.298922 0.932780 O\n0.333423 0.513349 0.247769 O\n0.690250 0.147998 0.080889 O\n0.670999 0.501546 0.773087 F\n0.170952 0.001493 0.273095 F\n",
"nsites": 30,
"nelements": 4,
"elements": [
"Li",
"Co",
"O",
"F"
],
"chemical_system": "Co-F-Li-O",
"density": 2.801991820633756,
"density_atomic": 0.11857672215580482,
"volume": 253.0007530532111,
"volume_molar": 5.07868715757479,
"formula_full": "Li16 Co2 O10 F2",
"formula_reduced": "Li8CoO5F",
"formula_anonymous": "ABC5D8",
"energy_above_hull": 1.584587912166667,
"spacegroup": 1
},
{
"id": "jvasp-51727",
"created_at": "2022-09-04T14:37:27.130181Z",
"updated_at": "2022-09-04T14:37:27.130212Z",
"structure_string": "Li8 H4 I4 O4\n1.0\n5.527022 -0.000000 0.000000\n0.000000 6.646584 0.000000\n0.000000 0.000000 10.182637\nLi H I O\n8 4 4 4\ndirect\n0.000453 0.562271 0.889543 Li\n0.499546 0.937728 0.389543 Li\n0.500453 0.437729 0.110457 Li\n-0.000453 0.062271 0.610457 Li\n-0.000453 0.437729 0.110457 Li\n0.500453 0.062271 0.610457 Li\n0.499546 0.562271 0.889543 Li\n0.000453 0.937728 0.389543 Li\n0.750000 0.275176 0.946902 H\n0.750000 0.224824 0.446902 H\n0.250000 0.724824 0.053098 H\n0.250000 0.775176 0.553098 H\n0.250000 0.417441 0.671421 I\n0.250000 0.082559 0.171421 I\n0.750000 0.582559 0.328579 I\n0.750000 0.917440 0.828579 I\n0.250000 0.914678 0.521137 O\n0.250000 0.585322 0.021137 O\n0.750000 0.085322 0.478863 O\n0.750000 0.414678 0.978864 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Li",
"H",
"I",
"O"
],
"chemical_system": "H-I-Li-O",
"density": 2.801877207452289,
"density_atomic": 0.05346628914449958,
"volume": 374.06747915396573,
"volume_molar": 11.263435066017736,
"formula_full": "Li8 H4 I4 O4",
"formula_reduced": "Li2HIO",
"formula_anonymous": "ABCD2",
"energy_above_hull": 0.9832799549999998,
"spacegroup": 62
}
]
}