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=-spacegroup&page=3583",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=3581",
"results": [
{
"id": "jvasp-56178",
"created_at": "2022-09-04T14:37:00.797749Z",
"updated_at": "2022-09-04T14:37:00.797776Z",
"structure_string": "Te8 Ir4\n1.0\n4.048016 -0.000000 0.000000\n0.000000 5.463454 0.000000\n0.000000 0.000000 13.580964\nTe Ir\n8 4\ndirect\n0.250000 0.761994 0.950571 Te\n0.250000 0.738005 0.450571 Te\n0.250000 0.293800 0.807150 Te\n0.750001 0.261994 0.549429 Te\n0.750001 0.238005 0.049429 Te\n0.750001 0.706200 0.192850 Te\n0.250000 0.206200 0.307150 Te\n0.750001 0.793799 0.692850 Te\n0.750001 0.485536 0.366268 Ir\n0.750001 0.014464 0.866268 Ir\n0.250000 0.985535 0.133732 Ir\n0.250000 0.514463 0.633731 Ir\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Te",
"Ir"
],
"chemical_system": "Ir-Te",
"density": 9.894217681767193,
"density_atomic": 0.03995224026597604,
"volume": 300.3586262024808,
"volume_molar": 15.073349378929699,
"formula_full": "Te8 Ir4",
"formula_reduced": "Te2Ir",
"formula_anonymous": "AB2",
"energy_above_hull": 1.823855544444444,
"spacegroup": 62
},
{
"id": "jvasp-14313",
"created_at": "2022-09-04T14:37:06.704748Z",
"updated_at": "2022-09-04T14:37:06.704773Z",
"structure_string": "Yb4 F12\n1.0\n4.105835 0.000000 0.000000\n0.000000 6.433088 0.000000\n0.000000 0.000000 7.046481\nYb F\n4 12\ndirect\n0.932922 0.614295 0.750000 Yb\n0.432923 0.885705 0.250000 Yb\n0.567076 0.114295 0.750000 Yb\n0.067076 0.385705 0.250000 Yb\n0.072125 0.961885 0.750000 F\n0.572125 0.538115 0.250000 F\n0.427874 0.461885 0.750000 F\n0.927873 0.038115 0.250000 F\n0.390002 0.183084 0.054361 F\n0.890001 0.316916 0.945639 F\n0.109998 0.683084 0.445639 F\n0.609997 0.816916 0.554361 F\n0.609997 0.816916 0.945639 F\n0.109998 0.683084 0.054361 F\n0.890001 0.316916 0.554361 F\n0.390002 0.183084 0.445639 F\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Yb",
"F"
],
"chemical_system": "F-Yb",
"density": 8.209375742567783,
"density_atomic": 0.08596599864259641,
"volume": 186.1200969294848,
"volume_molar": 7.005258887338758,
"formula_full": "Yb4 F12",
"formula_reduced": "YbF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1989275706249998,
"spacegroup": 62
},
{
"id": "jvasp-50067",
"created_at": "2022-09-04T14:37:00.380748Z",
"updated_at": "2022-09-04T14:37:00.380769Z",
"structure_string": "Yb4 C4 O12\n1.0\n4.895195 -0.000417 -0.003193\n0.000116 5.560272 -0.000360\n0.005195 0.000355 7.765055\nYb C O\n4 4 12\ndirect\n0.249979 0.761897 0.914980 Yb\n0.750009 0.738103 0.414978 Yb\n0.249990 0.261897 0.585022 Yb\n0.750020 0.238103 0.085020 Yb\n0.250028 0.910534 0.264789 C\n0.749999 0.589468 0.764788 C\n0.250000 0.410532 0.235212 C\n0.749971 0.089466 0.735211 C\n0.749982 0.103315 0.569842 O\n0.249999 0.396681 0.069844 O\n0.478206 0.410031 0.319798 O\n0.021795 0.410029 0.319808 O\n0.978204 0.589971 0.680191 O\n0.021823 0.910040 0.180201 O\n0.750000 0.603319 0.930156 O\n0.250017 0.896684 0.430158 O\n0.978176 0.089960 0.819799 O\n0.478235 0.910025 0.180196 O\n0.521793 0.589969 0.680202 O\n0.521764 0.089975 0.819804 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Yb",
"C",
"O"
],
"chemical_system": "C-O-Yb",
"density": 7.323950235155727,
"density_atomic": 0.0946279069555465,
"volume": 211.35414111394675,
"volume_molar": 6.364021939985452,
"formula_full": "Yb4 C4 O12",
"formula_reduced": "YbCO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.14328224,
"spacegroup": 62
},
{
"id": "jvasp-42219",
"created_at": "2022-09-04T14:37:00.458728Z",
"updated_at": "2022-09-04T14:37:00.458755Z",
"structure_string": "Li4 Mn4 P4 O16\n1.0\n5.738766 0.000000 0.000000\n0.000000 4.984824 0.000000\n0.000000 0.000000 10.564694\nLi Mn P O\n4 4 4 16\ndirect\n-0.009767 0.590328 0.052643 Li\n0.490234 0.090328 0.447357 Li\n-0.009767 0.909671 0.552642 Li\n0.490234 0.409672 0.947357 Li\n0.990132 -0.029076 0.234579 Mn\n0.490132 0.470924 0.265421 Mn\n0.990132 0.529075 0.734579 Mn\n0.490132 0.029076 0.765421 Mn\n0.990134 0.112341 0.916883 P\n0.490134 0.612341 0.583116 P\n0.990134 0.387658 0.416883 P\n0.490134 0.887658 0.083117 P\n0.705528 0.749041 0.651702 O\n0.274739 0.749028 0.651708 O\n0.774739 0.249028 0.848292 O\n0.205528 0.249041 0.848297 O\n0.490129 0.307720 0.601397 O\n0.490126 0.701238 0.443761 O\n0.990127 0.298761 0.556238 O\n0.490129 0.192280 0.101397 O\n0.705528 0.750958 0.151703 O\n0.274739 0.750971 0.151708 O\n0.774739 0.250971 0.348292 O\n0.205528 0.250959 0.348297 O\n0.990129 0.807720 0.898603 O\n0.490126 0.798761 0.943761 O\n0.990129 0.692279 0.398603 O\n0.990127 0.201239 0.056238 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Mn",
"P",
"O"
],
"chemical_system": "Li-Mn-O-P",
"density": 3.447223727965762,
"density_atomic": 0.09264729909012671,
"volume": 302.22143845512187,
"volume_molar": 6.500071582380074,
"formula_full": "Li4 Mn4 P4 O16",
"formula_reduced": "LiMnPO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.549022391625616,
"spacegroup": 62
},
{
"id": "jvasp-21229",
"created_at": "2022-09-04T14:37:00.549341Z",
"updated_at": "2022-09-04T14:37:00.549357Z",
"structure_string": "Pr4 Ga4 O12\n1.0\n5.507034 -0.000000 0.000000\n-0.000000 5.572023 0.000000\n0.000000 0.000000 7.817402\nPr Ga O\n4 4 12\ndirect\n0.010066 0.957666 0.750000 Pr\n0.510066 0.542334 0.250000 Pr\n0.489934 0.457666 0.750000 Pr\n0.989933 0.042334 0.250000 Pr\n0.500000 0.000000 0.500000 Ga\n0.000000 0.500000 0.500000 Ga\n0.000000 0.500000 0.000000 Ga\n0.500000 0.000000 0.000000 Ga\n0.579631 0.016852 0.750000 O\n0.079631 0.483148 0.250000 O\n0.713409 0.287397 0.042918 O\n0.213409 0.212603 0.957082 O\n0.786590 0.787396 0.457082 O\n0.213409 0.212603 0.542918 O\n0.286591 0.712603 0.957082 O\n0.786590 0.787396 0.042918 O\n0.420368 0.983147 0.250000 O\n0.713409 0.287397 0.457082 O\n0.286591 0.712603 0.542918 O\n0.920368 0.516852 0.750000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Pr",
"Ga",
"O"
],
"chemical_system": "Ga-O-Pr",
"density": 7.161317911270249,
"density_atomic": 0.08337520060828908,
"volume": 239.87948279685003,
"volume_molar": 7.222940054193146,
"formula_full": "Pr4 Ga4 O12",
"formula_reduced": "PrGaO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.2366525349999995,
"spacegroup": 62
},
{
"id": "jvasp-58905",
"created_at": "2022-09-04T14:37:01.199895Z",
"updated_at": "2022-09-04T14:37:01.199924Z",
"structure_string": "K4 Si4 H12\n1.0\n5.322810 0.000000 0.000000\n0.000000 6.802914 0.000000\n0.000000 0.000000 8.753093\nK Si H\n4 4 12\ndirect\n0.250000 0.346356 0.687111 K\n0.750000 0.653644 0.312889 K\n0.750000 0.846355 0.812889 K\n0.250000 0.153644 0.187111 K\n0.250000 0.846987 0.547229 Si\n0.750000 0.153013 0.452770 Si\n0.750000 0.346987 0.952770 Si\n0.250000 0.653013 0.047229 Si\n0.750000 0.303217 0.126651 H\n0.250000 0.696782 0.873349 H\n0.462436 0.805954 0.080452 H\n0.962436 0.194045 0.919547 H\n0.537564 0.305955 0.419547 H\n0.462436 0.694045 0.580452 H\n0.537564 0.194045 0.919547 H\n0.037564 0.805954 0.080452 H\n0.750000 0.196782 0.626651 H\n0.962436 0.305955 0.419547 H\n0.037564 0.694045 0.580452 H\n0.250000 0.803217 0.373349 H\n",
"nsites": 20,
"nelements": 3,
"elements": [
"K",
"Si",
"H"
],
"chemical_system": "H-K-Si",
"density": 1.4712817637843918,
"density_atomic": 0.06310045748732541,
"volume": 316.95491279151616,
"volume_molar": 9.543735497020176,
"formula_full": "K4 Si4 H12",
"formula_reduced": "KSiH3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.07383332,
"spacegroup": 62
},
{
"id": "jvasp-13769",
"created_at": "2022-09-04T14:37:00.991127Z",
"updated_at": "2022-09-04T14:37:00.991161Z",
"structure_string": "Yb4 Mn4 Si4\n1.0\n4.253048 -0.000000 0.000000\n-0.000000 6.964789 0.000000\n0.000000 0.000000 7.201749\nYb Mn Si\n4 4 4\ndirect\n0.750000 0.175934 0.503739 Yb\n0.250000 0.824066 0.496261 Yb\n0.750000 0.324066 0.003739 Yb\n0.250000 0.675934 -0.003739 Yb\n0.250000 0.063222 0.133332 Mn\n0.750000 0.936778 0.866668 Mn\n0.250000 0.436778 0.633332 Mn\n0.750000 0.563222 0.366668 Mn\n0.750000 0.887787 0.197175 Si\n0.250000 0.112213 0.802825 Si\n0.750000 0.612213 0.697175 Si\n0.250000 0.387787 0.302825 Si\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Yb",
"Mn",
"Si"
],
"chemical_system": "Mn-Si-Yb",
"density": 7.972795291938124,
"density_atomic": 0.05625161775602502,
"volume": 213.3271980202685,
"volume_molar": 10.70572012012042,
"formula_full": "Yb4 Mn4 Si4",
"formula_reduced": "YbMnSi",
"formula_anonymous": "ABC",
"energy_above_hull": 1.8372821804597697,
"spacegroup": 62
},
{
"id": "jvasp-59607",
"created_at": "2022-09-04T14:37:00.753469Z",
"updated_at": "2022-09-04T14:37:00.753496Z",
"structure_string": "Y4 Mn4 Ge4\n1.0\n4.084184 -0.000000 0.000000\n-0.000000 7.048659 0.000000\n0.000000 0.000000 7.969415\nY Mn Ge\n4 4 4\ndirect\n0.250000 0.524573 0.182562 Y\n0.749999 0.475427 0.817438 Y\n0.250000 0.024573 0.317438 Y\n0.749999 0.975427 0.682562 Y\n0.749999 0.367844 0.445040 Mn\n0.250000 0.132156 0.945040 Mn\n0.749999 0.867844 0.054961 Mn\n0.250000 0.632156 0.554961 Mn\n0.250000 0.274079 0.617044 Ge\n0.749999 0.225921 0.117044 Ge\n0.250000 0.774079 0.882957 Ge\n0.749999 0.725921 0.382956 Ge\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Y",
"Mn",
"Ge"
],
"chemical_system": "Ge-Mn-Y",
"density": 6.267530249179463,
"density_atomic": 0.05230497546872034,
"volume": 229.42368087288935,
"volume_molar": 11.51351416578216,
"formula_full": "Y4 Mn4 Ge4",
"formula_reduced": "YMnGe",
"formula_anonymous": "ABC",
"energy_above_hull": 2.190419547126436,
"spacegroup": 62
},
{
"id": "jvasp-49633",
"created_at": "2022-09-04T14:37:01.137446Z",
"updated_at": "2022-09-04T14:37:01.137465Z",
"structure_string": "Al4 Cr4 O12\n1.0\n4.973121 0.000000 0.000000\n0.000000 5.017693 0.000000\n0.000000 0.000000 7.470049\nAl Cr O\n4 4 12\ndirect\n0.989598 0.972401 0.750000 Al\n0.489598 0.527598 0.250000 Al\n0.510402 0.472401 0.750000 Al\n0.010402 0.027598 0.250000 Al\n0.000000 0.500000 0.500000 Cr\n0.500000 0.000000 0.500000 Cr\n0.500000 0.000000 0.000000 Cr\n0.000000 0.500000 0.000000 Cr\n0.640684 0.116569 0.750000 O\n0.140684 0.383431 0.250000 O\n0.661678 0.335362 0.078042 O\n0.161678 0.164637 0.921958 O\n0.838322 0.835362 0.421958 O\n0.161678 0.164637 0.578042 O\n0.338322 0.664637 0.921958 O\n0.838322 0.835362 0.078042 O\n0.359316 0.883431 0.250000 O\n0.661678 0.335362 0.421958 O\n0.338322 0.664637 0.578042 O\n0.859316 0.616568 0.750000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Al",
"Cr",
"O"
],
"chemical_system": "Al-Cr-O",
"density": 4.524531495847107,
"density_atomic": 0.10729350501198713,
"volume": 186.404573117129,
"volume_molar": 5.612772888095314,
"formula_full": "Al4 Cr4 O12",
"formula_reduced": "AlCrO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.41303614,
"spacegroup": 62
},
{
"id": "jvasp-14118",
"created_at": "2022-09-04T14:37:01.300839Z",
"updated_at": "2022-09-04T14:37:01.300856Z",
"structure_string": "Sm4 Co4 O12\n1.0\n5.271143 0.000000 0.000000\n0.000000 5.463585 0.000000\n0.000000 0.000000 7.515500\nSm Co O\n4 4 12\ndirect\n0.014367 0.939375 0.750000 Sm\n0.514366 0.560624 0.250000 Sm\n0.485633 0.439375 0.750000 Sm\n0.985633 0.060625 0.250000 Sm\n0.500000 0.000000 0.500000 Co\n0.000000 0.500000 0.500000 Co\n0.000000 0.500000 0.000000 Co\n0.500000 0.000000 0.000000 Co\n0.585230 0.017297 0.750000 O\n0.085230 0.482703 0.250000 O\n0.701346 0.295291 0.043973 O\n0.201346 0.204709 0.956027 O\n0.798654 0.795290 0.456027 O\n0.201346 0.204709 0.543973 O\n0.298654 0.704709 0.956027 O\n0.798654 0.795290 0.043973 O\n0.914769 0.517296 0.750000 O\n0.701346 0.295291 0.456027 O\n0.298654 0.704709 0.543973 O\n0.414769 0.982702 0.250000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Sm",
"Co",
"O"
],
"chemical_system": "Co-O-Sm",
"density": 7.895760545274059,
"density_atomic": 0.09240375378144067,
"volume": 216.44142344374117,
"volume_molar": 6.517203591364866,
"formula_full": "Sm4 Co4 O12",
"formula_reduced": "SmCoO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.070456055,
"spacegroup": 62
},
{
"id": "jvasp-50974",
"created_at": "2022-09-04T14:37:01.786845Z",
"updated_at": "2022-09-04T14:37:01.786869Z",
"structure_string": "Lu4 Ti4 O12\n1.0\n5.234747 0.000000 0.000000\n-0.000000 5.630499 0.000000\n0.000000 0.000000 7.586246\nLu Ti O\n4 4 12\ndirect\n0.975840 0.425197 0.750000 Lu\n0.524161 0.925197 0.750000 Lu\n0.475840 0.074804 0.250000 Lu\n0.024161 0.574804 0.250000 Lu\n0.000000 0.000000 0.000000 Ti\n0.000000 0.000000 0.500000 Ti\n0.500000 0.500000 0.000000 Ti\n0.500000 0.500000 0.500000 Ti\n0.815318 0.693147 0.564098 O\n0.684683 0.193147 0.564098 O\n0.684683 0.193147 0.935903 O\n0.634719 0.445001 0.250000 O\n0.365282 0.554999 0.750000 O\n0.184683 0.306853 0.064097 O\n0.315318 0.806853 0.435903 O\n0.184683 0.306853 0.435903 O\n0.815318 0.693147 0.935903 O\n0.134719 0.054999 0.750000 O\n0.315318 0.806853 0.064097 O\n0.865282 0.945001 0.250000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Lu",
"Ti",
"O"
],
"chemical_system": "Lu-O-Ti",
"density": 8.04525627039104,
"density_atomic": 0.08944591102407806,
"volume": 223.59881822452647,
"volume_molar": 6.7327177855887586,
"formula_full": "Lu4 Ti4 O12",
"formula_reduced": "LuTiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.939040916666667,
"spacegroup": 62
},
{
"id": "jvasp-50537",
"created_at": "2022-09-04T14:37:01.383785Z",
"updated_at": "2022-09-04T14:37:01.383809Z",
"structure_string": "Ti8 O16\n1.0\n2.979340 0.000000 0.000000\n0.000000 8.926892 0.000000\n0.000000 0.000000 10.733583\nTi O\n8 16\ndirect\n0.750000 0.044876 0.879145 Ti\n0.750000 0.094807 0.401927 Ti\n0.250000 0.405193 0.901927 Ti\n0.250000 0.455123 0.379145 Ti\n0.750000 0.544876 0.620855 Ti\n0.750000 0.594807 0.098073 Ti\n0.250000 0.905193 0.598073 Ti\n0.250000 0.955123 0.120855 Ti\n0.750000 0.885719 0.485331 O\n0.750000 0.802130 0.141477 O\n0.250000 0.697870 0.641477 O\n0.250000 0.614280 0.985331 O\n0.750000 0.577587 0.428387 O\n0.250000 0.531037 0.213931 O\n0.750000 0.468963 0.786069 O\n0.250000 0.197870 0.858523 O\n0.750000 0.385719 0.014669 O\n0.750000 0.302130 0.358523 O\n0.250000 0.922413 0.928387 O\n0.250000 0.114280 0.514669 O\n0.750000 0.077587 0.071613 O\n0.250000 0.031038 0.286069 O\n0.250000 0.422413 0.571612 O\n0.750000 0.968962 0.713931 O\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Ti",
"O"
],
"chemical_system": "O-Ti",
"density": 3.716506218475243,
"density_atomic": 0.08407099255554092,
"volume": 285.473018343926,
"volume_molar": 7.16316124853827,
"formula_full": "Ti8 O16",
"formula_reduced": "TiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.5015051111111113,
"spacegroup": 62
}
]
}