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=-energy_above_hull&page=1141",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=1139",
"results": [
{
"id": "jvasp-35004",
"created_at": "2022-09-04T14:37:29.962126Z",
"updated_at": "2022-09-04T14:37:29.962151Z",
"structure_string": "Mn2 Co2 Sb2\n1.0\n4.040125 0.000000 0.000000\n-0.000000 4.040125 -0.000000\n0.000000 0.000000 6.027659\nMn Co Sb\n2 2 2\ndirect\n0.499999 0.000000 0.254881 Mn\n0.000000 0.499999 0.745119 Mn\n0.499999 0.499999 0.000000 Co\n0.000000 0.000000 0.000000 Co\n0.499999 0.000000 0.718774 Sb\n0.000000 0.499999 0.281226 Sb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Mn",
"Co",
"Sb"
],
"chemical_system": "Co-Mn-Sb",
"density": 7.953781975532342,
"density_atomic": 0.06098358772065976,
"volume": 98.38712716417217,
"volume_molar": 9.875018812577741,
"formula_full": "Mn2 Co2 Sb2",
"formula_reduced": "MnCoSb",
"formula_anonymous": "ABC",
"energy_above_hull": 2.7101280804597705,
"spacegroup": 129
},
{
"id": "jvasp-62152",
"created_at": "2022-09-04T14:35:56.970066Z",
"updated_at": "2022-09-04T14:35:56.970092Z",
"structure_string": "Ti6 Al16 Pd7\n1.0\n0.000000 6.126596 6.126596\n6.126596 0.000000 6.126596\n6.126596 6.126596 -0.000000\nTi Al Pd\n6 16 7\ndirect\n0.671373 0.328628 0.671373 Ti\n0.671373 0.328628 0.328628 Ti\n0.328628 0.671373 0.671373 Ti\n0.328628 0.328628 0.671373 Ti\n0.671373 0.671373 0.328628 Ti\n0.328628 0.671373 0.328628 Ti\n0.019654 0.660116 0.660116 Al\n0.660116 0.019654 0.660116 Al\n0.660116 0.660116 0.660116 Al\n0.980347 0.339884 0.339884 Al\n0.120355 0.638934 0.120355 Al\n0.339884 0.339884 0.339884 Al\n0.120355 0.120355 0.120355 Al\n0.120355 0.120355 0.638934 Al\n0.638934 0.120355 0.120355 Al\n0.879645 0.879645 0.879645 Al\n0.339884 0.339884 0.980347 Al\n0.660116 0.660116 0.019654 Al\n0.879645 0.361066 0.879645 Al\n0.879645 0.879645 0.361066 Al\n0.361066 0.879645 0.879645 Al\n0.339884 0.980347 0.339884 Al\n0.000000 0.000000 0.500000 Pd\n0.000000 0.000000 0.000000 Pd\n0.500000 0.000000 0.000000 Pd\n0.000000 0.500000 0.000000 Pd\n0.500000 0.000000 0.500000 Pd\n0.500000 0.500000 0.000000 Pd\n0.000000 0.500000 0.500000 Pd\n",
"nsites": 29,
"nelements": 3,
"elements": [
"Ti",
"Al",
"Pd"
],
"chemical_system": "Al-Pd-Ti",
"density": 5.285145479923565,
"density_atomic": 0.06305365601284144,
"volume": 459.92574949331873,
"volume_molar": 9.55081931930091,
"formula_full": "Ti6 Al16 Pd7",
"formula_reduced": "Ti6Al16Pd7",
"formula_anonymous": "A6B7C16",
"energy_above_hull": 2.7100943,
"spacegroup": 225
},
{
"id": "jvasp-111592",
"created_at": "2022-09-04T14:38:41.171681Z",
"updated_at": "2022-09-04T14:38:41.171713Z",
"structure_string": "Be4 Co8 O16\n1.0\n2.890475 0.000000 0.000000\n0.000000 8.986134 0.000000\n0.000000 0.000000 9.269452\nBe Co O\n4 8 16\ndirect\n0.749999 0.644900 0.106821 Be\n0.250000 0.855100 0.606821 Be\n0.749999 0.144900 0.393179 Be\n0.250000 0.355100 0.893178 Be\n0.250000 0.370593 0.204856 Co\n0.250000 0.381894 0.571915 Co\n0.749999 0.129407 0.704856 Co\n0.749999 0.118106 0.071915 Co\n0.250000 0.881894 0.928085 Co\n0.749999 0.618106 0.428085 Co\n0.749999 0.629407 0.795143 Co\n0.250000 0.870592 0.295144 Co\n0.749999 0.017366 0.885412 O\n0.749999 0.234056 0.251157 O\n0.250000 0.253976 0.030138 O\n0.749999 0.246023 0.530137 O\n0.250000 0.265944 0.751157 O\n0.749999 0.976709 0.374564 O\n0.250000 0.982634 0.114588 O\n0.749999 0.476710 0.125436 O\n0.749999 0.734055 0.248843 O\n0.250000 0.753976 0.469862 O\n0.749999 0.746023 0.969862 O\n0.250000 0.765944 0.748843 O\n0.250000 0.523290 0.874563 O\n0.749999 0.517365 0.614588 O\n0.250000 0.023290 0.625436 O\n0.250000 0.482634 0.385412 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Be",
"Co",
"O"
],
"chemical_system": "Be-Co-O",
"density": 5.265803364758274,
"density_atomic": 0.11629521971768333,
"volume": 240.7665600355063,
"volume_molar": 5.178321838695749,
"formula_full": "Be4 Co8 O16",
"formula_reduced": "Be(CoO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.7100717,
"spacegroup": 62
},
{
"id": "jvasp-117312",
"created_at": "2022-09-04T14:38:26.163670Z",
"updated_at": "2022-09-04T14:38:26.163696Z",
"structure_string": "Li8 Mn6 O14\n1.0\n2.930268 -0.006180 0.283286\n0.380612 5.893744 0.691173\n0.002789 0.010439 14.320951\nLi Mn O\n8 6 14\ndirect\n0.909412 0.199426 0.629814 Li\n0.500000 0.500000 0.500000 Li\n0.090588 0.800574 0.370186 Li\n0.360297 0.927560 0.782317 Li\n0.791862 0.643623 0.927351 Li\n0.208138 0.356376 0.072649 Li\n0.639703 0.072439 0.217683 Li\n0.500001 0.000000 0.500000 Li\n0.792986 0.143552 0.927226 Mn\n0.207015 0.856448 0.072774 Mn\n0.382409 0.435274 0.782935 Mn\n0.049351 0.274253 0.365027 Mn\n0.950649 0.725746 0.634973 Mn\n0.617592 0.564726 0.217065 Mn\n0.335612 0.391489 0.920864 O\n0.911198 0.672378 0.778421 O\n0.526348 0.507564 0.353200 O\n-0.002991 0.254336 0.490850 O\n0.423116 0.937735 0.641606 O\n0.088802 0.327621 0.221579 O\n0.664389 0.608511 0.079136 O\n0.840886 0.185378 0.789643 O\n0.576884 0.062265 0.358394 O\n0.002991 0.745664 0.509150 O\n0.473653 0.492435 0.646800 O\n0.751830 0.106289 0.064891 O\n0.248171 0.893711 0.935109 O\n0.159114 0.814621 0.210357 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Li",
"Mn",
"O"
],
"chemical_system": "Li-Mn-O",
"density": 4.08964446953223,
"density_atomic": 0.11320660294632745,
"volume": 247.33539626902436,
"volume_molar": 5.319602040223014,
"formula_full": "Li8 Mn6 O14",
"formula_reduced": "Li4Mn3O7",
"formula_anonymous": "A3B4C7",
"energy_above_hull": 2.710061873152709,
"spacegroup": 2
},
{
"id": "jvasp-47540",
"created_at": "2022-09-04T14:36:04.255888Z",
"updated_at": "2022-09-04T14:36:04.255906Z",
"structure_string": "Be4 Co8 O16\n1.0\n2.890622 0.000000 0.000000\n-0.000000 8.986432 0.000000\n0.000000 0.000000 9.269888\nBe Co O\n4 8 16\ndirect\n0.749999 0.144892 0.606837 Be\n0.250000 0.355108 0.106837 Be\n0.749999 0.644892 0.893163 Be\n0.250000 0.855108 0.393163 Be\n0.250000 0.870591 0.704851 Co\n0.250000 0.881888 0.071906 Co\n0.749999 0.629409 0.204851 Co\n0.749999 0.618111 0.571907 Co\n0.250000 0.381888 0.428094 Co\n0.749999 0.118111 0.928094 Co\n0.749999 0.129409 0.295150 Co\n0.250000 0.370591 0.795150 Co\n0.749999 0.517360 0.385414 O\n0.749999 0.734054 0.751145 O\n0.250000 0.753988 0.530124 O\n0.749999 0.746012 0.030124 O\n0.250000 0.765945 0.251145 O\n0.749999 0.476709 0.874558 O\n0.250000 0.482639 0.614587 O\n0.749999 0.976709 0.625443 O\n0.749999 0.234055 0.748856 O\n0.250000 0.253988 0.969876 O\n0.749999 0.246012 0.469876 O\n0.250000 0.265945 0.248855 O\n0.250000 0.023291 0.374558 O\n0.749999 0.017360 0.114587 O\n0.250000 0.523290 0.125443 O\n0.250000 0.982639 0.885414 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Be",
"Co",
"O"
],
"chemical_system": "Be-Co-O",
"density": 5.265113315024562,
"density_atomic": 0.11627997997555108,
"volume": 240.79811508298553,
"volume_molar": 5.1790005134729205,
"formula_full": "Be4 Co8 O16",
"formula_reduced": "Be(CoO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.7100517,
"spacegroup": 62
},
{
"id": "jvasp-90808",
"created_at": "2022-09-04T14:36:13.841264Z",
"updated_at": "2022-09-04T14:36:13.841297Z",
"structure_string": "Be2 B1 O5\n1.0\n-2.254217 -3.865068 -0.217313\n-2.220138 3.845393 0.000000\n-0.244458 -0.141138 -4.830636\nBe B O\n2 1 5\ndirect\n0.348688 0.675162 0.898324 Be\n0.651314 0.326475 0.101676 Be\n-0.000000 -0.000094 0.000000 B\n0.388461 0.692900 0.554439 O\n0.611542 0.304440 0.445561 O\n0.695708 0.693500 0.990009 O\n0.304294 -0.002206 0.009991 O\n0.000000 0.309824 -0.000000 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Be",
"B",
"O"
],
"chemical_system": "B-Be-O",
"density": 2.1759677855036625,
"density_atomic": 0.09632417282092301,
"volume": 83.05288034887006,
"volume_molar": 6.251951699804168,
"formula_full": "Be2 B1 O5",
"formula_reduced": "Be2BO5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 2.7100202854166664,
"spacegroup": 5
},
{
"id": "jvasp-23795",
"created_at": "2022-09-04T14:37:58.030346Z",
"updated_at": "2022-09-04T14:37:58.030377Z",
"structure_string": "Ce2 Si4 Pt4\n1.0\n4.276621 0.000000 0.000000\n0.000000 4.276621 0.000000\n0.000000 0.000000 9.797706\nCe Si Pt\n2 4 4\ndirect\n0.500000 0.000000 0.252163 Ce\n0.000000 0.500000 0.747837 Ce\n0.000000 0.000000 0.500000 Si\n0.000000 0.500000 0.132415 Si\n0.500000 0.500000 0.500000 Si\n0.500000 0.000000 0.867586 Si\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.620833 Pt\n0.000000 0.500000 0.379168 Pt\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ce",
"Si",
"Pt"
],
"chemical_system": "Ce-Pt-Si",
"density": 10.86895660128935,
"density_atomic": 0.055805122805599155,
"volume": 179.19501825729625,
"volume_molar": 10.79137623436208,
"formula_full": "Ce2 Si4 Pt4",
"formula_reduced": "Ce(SiPt)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.7099871,
"spacegroup": 129
},
{
"id": "jvasp-121095",
"created_at": "2022-09-04T14:38:55.177501Z",
"updated_at": "2022-09-04T14:38:55.177528Z",
"structure_string": "Nb2 H2 O2\n1.0\n2.921490 0.000000 0.000000\n0.000000 4.154948 0.000000\n0.000000 0.000000 5.750508\nNb H O\n2 2 2\ndirect\n0.500000 0.500001 0.634306 Nb\n0.000000 0.000000 0.365694 Nb\n0.000000 0.500001 0.860386 H\n0.500000 0.000000 0.139613 H\n0.000000 0.500001 0.340858 O\n0.500000 0.000000 0.659142 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Nb",
"H",
"O"
],
"chemical_system": "H-Nb-O",
"density": 5.229435260604599,
"density_atomic": 0.08595577125099017,
"volume": 69.80334086561852,
"volume_molar": 7.006092403516917,
"formula_full": "Nb2 H2 O2",
"formula_reduced": "NbHO",
"formula_anonymous": "ABC",
"energy_above_hull": 2.7097976333333333,
"spacegroup": 59
},
{
"id": "jvasp-112503",
"created_at": "2022-09-04T14:38:41.381347Z",
"updated_at": "2022-09-04T14:38:41.381368Z",
"structure_string": "Li8 Mn6 O14\n1.0\n2.959000 -0.004377 0.086217\n1.432840 6.194973 0.619449\n0.023258 0.013211 13.559733\nLi Mn O\n8 6 14\ndirect\n0.678818 0.660649 0.429619 Li\n0.565595 0.214764 0.140671 Li\n0.434407 0.785235 0.859329 Li\n0.067385 0.935396 0.296538 Li\n0.000000 0.500000 0.000000 Li\n0.932617 0.064602 0.703462 Li\n0.321184 0.339350 0.570382 Li\n0.000000 -0.000000 0.500000 Li\n0.800528 0.576128 0.220779 Mn\n0.199473 0.423871 0.779221 Mn\n0.733127 0.143412 0.926897 Mn\n0.382465 0.278572 0.365638 Mn\n0.617536 0.721427 0.634362 Mn\n0.266874 0.856587 0.073104 Mn\n0.575403 0.451243 0.889708 O\n0.657490 0.882717 0.178479 O\n0.094047 0.728960 0.735662 O\n0.108557 0.165956 0.037581 O\n0.209035 0.598970 0.322555 O\n0.790967 0.401029 0.677445 O\n0.342511 0.117282 0.821521 O\n0.522633 0.990385 0.390178 O\n0.891444 0.834043 0.962420 O\n0.905954 0.271039 0.264338 O\n0.153827 0.678713 0.547074 O\n0.477368 0.009613 0.609822 O\n0.424598 0.548756 0.110292 O\n0.846174 0.321286 0.452927 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Li",
"Mn",
"O"
],
"chemical_system": "Li-Mn-O",
"density": 4.068637549693903,
"density_atomic": 0.11262510446865297,
"volume": 248.612422000401,
"volume_molar": 5.347067857039057,
"formula_full": "Li8 Mn6 O14",
"formula_reduced": "Li4Mn3O7",
"formula_anonymous": "A3B4C7",
"energy_above_hull": 2.7097604445812804,
"spacegroup": 2
},
{
"id": "jvasp-65251",
"created_at": "2022-09-04T14:35:55.758466Z",
"updated_at": "2022-09-04T14:35:55.758477Z",
"structure_string": "Na1 Be1 Co4\n1.0\n0.000000 3.352536 3.352536\n3.352536 -0.000000 3.352536\n3.352536 3.352536 0.000000\nNa Be Co\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Be\n0.122776 0.625742 0.625742 Co\n0.625742 0.625742 0.625742 Co\n0.625742 0.122776 0.625742 Co\n0.625742 0.625742 0.122776 Co\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Na",
"Be",
"Co"
],
"chemical_system": "Be-Co-Na",
"density": 5.899340509214149,
"density_atomic": 0.07961610086241837,
"volume": 75.36164086166914,
"volume_molar": 7.563973486225654,
"formula_full": "Na1 Be1 Co4",
"formula_reduced": "NaBeCo4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.7097331166666665,
"spacegroup": 216
},
{
"id": "jvasp-15249",
"created_at": "2022-09-04T14:36:57.090494Z",
"updated_at": "2022-09-04T14:36:57.090522Z",
"structure_string": "Nd1 Si2 Rh2\n1.0\n3.856472 -0.000000 -1.450040\n-0.545218 3.817737 -1.450040\n0.004346 0.005010 5.864841\nNd Si Rh\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Nd\n0.624858 0.624859 0.249715 Si\n0.375142 0.375142 0.750285 Si\n0.250000 0.750001 0.500000 Rh\n0.750000 0.250000 0.500000 Rh\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Nd",
"Si",
"Rh"
],
"chemical_system": "Nd-Rh-Si",
"density": 7.80693382539392,
"density_atomic": 0.057867647427004114,
"volume": 86.40406552395518,
"volume_molar": 10.406748896430427,
"formula_full": "Nd1 Si2 Rh2",
"formula_reduced": "Nd(SiRh)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.70956094,
"spacegroup": 139
},
{
"id": "jvasp-118988",
"created_at": "2022-09-04T14:38:31.735106Z",
"updated_at": "2022-09-04T14:38:31.735132Z",
"structure_string": "Li8 Mn6 O14\n1.0\n2.941592 -0.018723 0.331105\n0.671448 7.599524 1.247179\n-0.060814 0.015378 11.119804\nLi Mn O\n8 6 14\ndirect\n0.640833 0.163246 0.934312 Li\n0.860598 0.576947 0.199928 Li\n0.000001 0.000000 0.500000 Li\n0.139404 0.423053 0.800072 Li\n0.359168 0.836754 0.065688 Li\n0.429514 0.286499 0.355135 Li\n0.570487 0.713501 0.644865 Li\n0.500000 0.500000 0.000000 Li\n0.612240 0.935326 0.284048 Mn\n0.387761 0.064674 0.715952 Mn\n0.788340 0.357476 0.573933 Mn\n0.035546 0.226388 0.138124 Mn\n0.964456 0.773612 0.861876 Mn\n0.211662 0.642524 0.426068 Mn\n0.598890 0.056897 0.117857 O\n0.517930 0.627317 0.826451 O\n0.427945 0.175723 0.546413 O\n0.270580 0.747944 0.255064 O\n0.084314 0.310414 0.976292 O\n0.148732 0.539713 0.598237 O\n-0.012205 0.108506 0.312058 O\n0.729421 0.252056 0.744936 O\n0.572056 0.824277 0.453587 O\n0.482071 0.372683 0.173549 O\n0.401112 0.943103 0.882143 O\n0.851269 0.460287 0.401763 O\n0.915687 0.689586 0.023708 O\n0.012207 0.891494 0.687942 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Li",
"Mn",
"O"
],
"chemical_system": "Li-Mn-O",
"density": 4.065225177389606,
"density_atomic": 0.11253064562768636,
"volume": 248.8211086306169,
"volume_molar": 5.351556215117235,
"formula_full": "Li8 Mn6 O14",
"formula_reduced": "Li4Mn3O7",
"formula_anonymous": "A3B4C7",
"energy_above_hull": 2.709439016009852,
"spacegroup": 2
}
]
}