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=231",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=229",
"results": [
{
"id": "jvasp-101938",
"created_at": "2022-09-04T14:36:37.230027Z",
"updated_at": "2022-09-04T14:36:37.230053Z",
"structure_string": "Hf1 H2 C3 O4\n1.0\n4.300829 -0.147544 0.882540\n1.623148 4.199019 0.420271\n0.041891 -0.104852 5.830978\nHf H C O\n1 2 3 4\ndirect\n0.715430 0.182644 0.554120 Hf\n0.224373 0.693096 0.035947 H\n0.783817 0.774711 0.106218 H\n0.053837 0.471246 0.352255 C\n0.025807 0.591950 0.098052 C\n0.055484 0.355325 0.921473 C\n-0.017791 0.757824 0.480928 O\n0.387954 0.294675 0.357971 O\n0.331747 0.144629 0.841090 O\n0.795331 0.372269 0.849286 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Hf",
"H",
"C",
"O"
],
"chemical_system": "C-H-Hf-O",
"density": 4.370759550167006,
"density_atomic": 0.09382527966084046,
"volume": 106.58108386298439,
"volume_molar": 6.418462893762565,
"formula_full": "Hf1 H2 C3 O4",
"formula_reduced": "HfH2C3O4",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 4.477141699999999,
"spacegroup": 1
},
{
"id": "jvasp-62807",
"created_at": "2022-09-04T14:36:11.347623Z",
"updated_at": "2022-09-04T14:36:11.347634Z",
"structure_string": "Tb1 Co12 B6\n1.0\n3.664740 -4.695083 0.002217\n3.664740 4.695083 0.002217\n-2.353675 0.000000 5.471228\nTb Co B\n1 12 6\ndirect\n0.000000 0.000000 0.000000 Tb\n0.455080 0.455080 0.186411 Co\n0.455080 0.186411 0.455080 Co\n0.544920 0.544920 0.813590 Co\n0.813589 0.544920 0.544921 Co\n0.544920 0.813589 0.544921 Co\n0.867572 0.500000 0.132429 Co\n0.132428 0.867572 0.500001 Co\n0.186411 0.455080 0.455080 Co\n0.500000 0.132428 0.867573 Co\n0.867572 0.132428 0.500001 Co\n0.500000 0.867572 0.132429 Co\n0.132428 0.500000 0.867573 Co\n0.677626 0.232392 0.232392 B\n0.232391 0.232391 0.677627 B\n0.232392 0.677626 0.232392 B\n0.767609 0.767609 0.322375 B\n0.322374 0.767608 0.767609 B\n0.767608 0.322374 0.767609 B\n",
"nsites": 19,
"nelements": 3,
"elements": [
"Tb",
"Co",
"B"
],
"chemical_system": "B-Co-Tb",
"density": 8.208800643982345,
"density_atomic": 0.10088796003235583,
"volume": 188.32772507151995,
"volume_molar": 5.969137207322496,
"formula_full": "Tb1 Co12 B6",
"formula_reduced": "Tb(Co2B)6",
"formula_anonymous": "AB6C12",
"energy_above_hull": 4.476118668421052,
"spacegroup": 166
},
{
"id": "jvasp-78831",
"created_at": "2022-09-04T14:36:39.374165Z",
"updated_at": "2022-09-04T14:36:39.374189Z",
"structure_string": "U1 V2\n1.0\n0.000000 0.000000 -2.819381\n-2.633224 -3.383442 0.000000\n-2.633224 3.383442 0.000000\nU V\n1 2\ndirect\n0.000000 0.000000 0.000000 U\n0.500000 0.668419 0.331579 V\n0.500000 0.331579 0.668419 V\n",
"nsites": 3,
"nelements": 2,
"elements": [
"U",
"V"
],
"chemical_system": "U-V",
"density": 11.2353129595618,
"density_atomic": 0.05971603302912988,
"volume": 50.23776442980698,
"volume_molar": 10.084629628800625,
"formula_full": "U1 V2",
"formula_reduced": "UV2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.4756448,
"spacegroup": 65
},
{
"id": "jvasp-103877",
"created_at": "2022-09-04T14:36:52.316596Z",
"updated_at": "2022-09-04T14:36:52.316613Z",
"structure_string": "Sn1 H18 C10 O6\n1.0\n4.764775 -0.035648 0.676569\n-0.118911 6.205529 1.933976\n-0.069304 0.278991 10.276587\nSn H C O\n1 18 10 6\ndirect\n0.552879 0.590947 0.102814 Sn\n0.966829 0.645879 0.537914 H\n0.693821 0.606186 0.862320 H\n0.003065 0.723732 0.684844 H\n0.275542 0.063707 0.517029 H\n0.910375 0.058651 0.510000 H\n0.966255 0.990725 0.294201 H\n0.304534 0.876170 0.317516 H\n0.419390 0.078547 0.738001 H\n0.829369 0.554113 0.290905 H\n0.289095 0.376826 0.518794 H\n0.636578 0.377427 0.553271 H\n0.528161 0.739959 0.484559 H\n0.489331 0.675758 0.666724 H\n0.085747 0.235370 0.998078 H\n0.754388 0.119799 0.992646 H\n0.935277 0.378741 0.766408 H\n0.918515 0.116954 0.751793 H\n0.459323 0.287723 0.809433 H\n0.979904 0.127709 0.955976 C\n0.031626 0.219303 0.795557 C\n0.397692 0.646769 0.581461 C\n0.419053 0.405565 0.592090 C\n0.344054 0.240246 0.737833 C\n0.107897 0.979623 0.489277 C\n0.101036 0.739235 0.578698 C\n0.308275 0.216914 0.250071 C\n0.092888 0.903555 0.004848 C\n0.165055 0.003583 0.332959 C\n0.171614 0.396498 0.218963 O\n0.528563 0.533833 0.925801 O\n0.673602 0.651654 0.264772 O\n0.965099 0.741851 0.992333 O\n0.330792 0.884351 0.052256 O\n0.572484 0.229945 0.209211 O\n",
"nsites": 35,
"nelements": 4,
"elements": [
"Sn",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Sn",
"density": 1.943833405173945,
"density_atomic": 0.11607990003968587,
"volume": 301.5164553728428,
"volume_molar": 5.1879272448900515,
"formula_full": "Sn1 H18 C10 O6",
"formula_reduced": "SnH18(C5O3)2",
"formula_anonymous": "AB6C10D18",
"energy_above_hull": 4.47534122,
"spacegroup": 1
},
{
"id": "jvasp-15662",
"created_at": "2022-09-04T14:36:37.085354Z",
"updated_at": "2022-09-04T14:36:37.085383Z",
"structure_string": "Ce1 B2 Ru3\n1.0\n2.770578 -4.798782 0.000000\n2.770578 4.798782 0.000000\n0.000000 0.000000 3.017937\nCe B Ru\n1 2 3\ndirect\n0.000000 0.000000 0.000000 Ce\n0.333333 0.666667 0.000000 B\n0.666667 0.333333 0.000000 B\n0.000000 0.500000 0.500000 Ru\n0.500000 0.500000 0.500000 Ru\n0.500000 0.000000 0.500000 Ru\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"B",
"Ru"
],
"chemical_system": "B-Ce-Ru",
"density": 9.620816108118145,
"density_atomic": 0.07476695309907984,
"volume": 80.24935818969253,
"volume_molar": 8.05454884863312,
"formula_full": "Ce1 B2 Ru3",
"formula_reduced": "CeB2Ru3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 4.4747120277777785,
"spacegroup": 191
},
{
"id": "jvasp-41925",
"created_at": "2022-09-04T14:37:35.591936Z",
"updated_at": "2022-09-04T14:37:35.591965Z",
"structure_string": "Sc1 Pa1 Tc2\n1.0\n0.000000 3.338086 3.338086\n3.338086 -0.000000 3.338086\n3.338086 3.338086 -0.000000\nSc Pa Tc\n1 1 2\ndirect\n0.750002 0.750002 0.750002 Sc\n0.250000 0.250000 0.250000 Pa\n0.500001 0.500001 0.500001 Tc\n0.000000 0.000000 0.000000 Tc\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Pa",
"Tc"
],
"chemical_system": "Pa-Sc-Tc",
"density": 10.53564149400308,
"density_atomic": 0.05376967749956907,
"volume": 74.39137049003237,
"volume_molar": 11.199882610507126,
"formula_full": "Sc1 Pa1 Tc2",
"formula_reduced": "ScPaTc2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.4744278375,
"spacegroup": 225
},
{
"id": "jvasp-102735",
"created_at": "2022-09-04T14:36:58.514560Z",
"updated_at": "2022-09-04T14:36:58.514585Z",
"structure_string": "Ir1 Os1 Ru1\n1.0\n2.725768 -0.000000 0.000000\n-1.362883 2.360584 0.000000\n-0.000000 -0.000000 6.690524\nIr Os Ru\n1 1 1\ndirect\n0.000000 0.000000 -0.000304 Ir\n0.666667 0.333333 0.339101 Os\n0.333334 0.666665 0.661203 Ru\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ir",
"Os",
"Ru"
],
"chemical_system": "Ir-Os-Ru",
"density": 18.650580971260684,
"density_atomic": 0.06968716130158205,
"volume": 43.04953658561342,
"volume_molar": 8.641678965711126,
"formula_full": "Ir1 Os1 Ru1",
"formula_reduced": "IrOsRu",
"formula_anonymous": "ABC",
"energy_above_hull": 4.472945533333332,
"spacegroup": 156
},
{
"id": "jvasp-22737",
"created_at": "2022-09-04T14:37:37.982750Z",
"updated_at": "2022-09-04T14:37:37.982769Z",
"structure_string": "Si24 Os16\n1.0\n5.662492 0.000000 0.000000\n0.000000 9.057985 0.000000\n0.000000 0.000000 11.318249\nSi Os\n24 16\ndirect\n0.601913 0.107392 0.370242 Si\n0.554212 0.205986 0.074173 Si\n0.054213 0.294014 0.425827 Si\n0.945787 0.205986 0.925827 Si\n0.445787 0.294014 0.574173 Si\n0.945787 0.705986 0.574173 Si\n0.054213 0.794015 0.074173 Si\n0.554212 0.705986 0.425827 Si\n0.907965 0.563971 0.318488 Si\n0.407965 0.936030 0.181512 Si\n0.592034 0.563971 0.681512 Si\n0.092034 0.936030 0.818488 Si\n0.445787 0.794015 0.925827 Si\n0.592034 0.063971 0.818488 Si\n0.092034 0.436030 0.681512 Si\n0.101913 0.392608 0.129758 Si\n0.898086 0.107392 0.629758 Si\n0.398087 0.892608 0.629758 Si\n0.398087 0.392608 0.870242 Si\n0.101913 0.892608 0.370242 Si\n0.601913 0.607393 0.129758 Si\n0.907965 0.063971 0.181512 Si\n0.407965 0.436030 0.318488 Si\n0.898086 0.607393 0.870242 Si\n0.738996 0.813277 0.755424 Os\n0.761003 0.313277 0.255424 Os\n0.238996 0.686724 0.744576 Os\n0.238996 0.186723 0.755424 Os\n0.738996 0.313277 0.744576 Os\n0.261003 0.186723 0.244576 Os\n0.750000 0.963376 0.000000 Os\n0.250000 0.076176 0.500000 Os\n0.250000 0.036624 0.000000 Os\n0.750000 0.463376 0.500000 Os\n0.750000 0.423824 0.000000 Os\n0.250000 0.576177 0.000000 Os\n0.750000 0.923824 0.500000 Os\n0.261003 0.686724 0.255424 Os\n0.250000 0.536625 0.500000 Os\n0.761003 0.813277 0.244576 Os\n",
"nsites": 40,
"nelements": 2,
"elements": [
"Si",
"Os"
],
"chemical_system": "Os-Si",
"density": 10.634295750863089,
"density_atomic": 0.06890354217818681,
"volume": 580.5216790823133,
"volume_molar": 8.739958164163097,
"formula_full": "Si24 Os16",
"formula_reduced": "Si3Os2",
"formula_anonymous": "A2B3",
"energy_above_hull": 4.472429160000001,
"spacegroup": 60
},
{
"id": "jvasp-62704",
"created_at": "2022-09-04T14:36:17.397381Z",
"updated_at": "2022-09-04T14:36:17.397409Z",
"structure_string": "Er1 Co12 B6\n1.0\n3.658391 -4.688300 0.001856\n3.658391 4.688300 0.001856\n-2.352528 0.000000 5.461647\nEr Co B\n1 12 6\ndirect\n0.000000 0.000000 0.000000 Er\n0.453954 0.186011 0.453954 Co\n0.186011 0.453954 0.453954 Co\n0.546046 0.813990 0.546047 Co\n0.546046 0.546046 0.813991 Co\n0.813990 0.546046 0.546047 Co\n0.500000 0.132110 0.867891 Co\n0.867891 0.500000 0.132111 Co\n0.453954 0.453954 0.186011 Co\n0.132110 0.867890 0.500001 Co\n0.132110 0.500000 0.867891 Co\n0.867890 0.132110 0.500001 Co\n0.500000 0.867891 0.132111 Co\n0.232996 0.232996 0.679586 B\n0.232996 0.679585 0.232997 B\n0.679585 0.232996 0.232997 B\n0.767004 0.320415 0.767005 B\n0.767004 0.767004 0.320416 B\n0.320415 0.767004 0.767005 B\n",
"nsites": 19,
"nelements": 3,
"elements": [
"Er",
"Co",
"B"
],
"chemical_system": "B-Co-Er",
"density": 8.323580440192439,
"density_atomic": 0.10139103836720767,
"volume": 187.3932874736695,
"volume_molar": 5.939519761292539,
"formula_full": "Er1 Co12 B6",
"formula_reduced": "Er(Co2B)6",
"formula_anonymous": "AB6C12",
"energy_above_hull": 4.4720577,
"spacegroup": 166
},
{
"id": "jvasp-118541",
"created_at": "2022-09-04T14:38:53.212732Z",
"updated_at": "2022-09-04T14:38:53.212763Z",
"structure_string": "Hg1 C3\n1.0\n3.341888 0.926381 0.217297\n-0.855773 -3.319315 -0.025150\n-1.005046 -1.459495 -5.969163\nHg C\n1 3\ndirect\n0.897452 0.793881 0.068494 Hg\n0.772922 0.910527 0.709348 C\n0.700708 -0.018766 0.495231 C\n0.624493 0.054529 0.271074 C\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Hg",
"C"
],
"chemical_system": "C-Hg",
"density": 6.448752052284547,
"density_atomic": 0.0656494766948938,
"volume": 60.929655518657306,
"volume_molar": 9.173174049791628,
"formula_full": "Hg1 C3",
"formula_reduced": "HgC3",
"formula_anonymous": "AB3",
"energy_above_hull": 4.47195615,
"spacegroup": 160
},
{
"id": "jvasp-119063",
"created_at": "2022-09-04T14:38:33.513669Z",
"updated_at": "2022-09-04T14:38:33.513697Z",
"structure_string": "Tm1 Co12 B6\n1.0\n5.754841 0.003055 -1.444598\n-1.852749 5.448442 -1.444598\n0.002186 0.003055 5.933384\nTm Co B\n1 12 6\ndirect\n0.000000 0.000000 0.000000 Tm\n0.185941 0.453675 0.453675 Co\n0.453676 0.453675 0.185940 Co\n0.453676 0.185940 0.453675 Co\n0.546324 0.546323 0.814058 Co\n0.546324 0.814058 0.546323 Co\n0.814059 0.546323 0.546323 Co\n0.132070 0.499999 0.867929 Co\n0.500000 0.867930 0.132069 Co\n0.867930 0.499999 0.132069 Co\n0.500000 0.132068 0.867929 Co\n0.132069 0.867930 0.499999 Co\n0.867930 0.132068 0.499999 Co\n0.233074 0.233074 0.679846 B\n0.766925 0.320152 0.766924 B\n0.766925 0.766924 0.320152 B\n0.320153 0.766924 0.766924 B\n0.233074 0.679846 0.233074 B\n0.679847 0.233074 0.233074 B\n",
"nsites": 19,
"nelements": 3,
"elements": [
"Tm",
"Co",
"B"
],
"chemical_system": "B-Co-Tm",
"density": 8.395238968761516,
"density_atomic": 0.10208186880018273,
"volume": 186.1251192137853,
"volume_molar": 5.899324562511556,
"formula_full": "Tm1 Co12 B6",
"formula_reduced": "Tm(Co2B)6",
"formula_anonymous": "AB6C12",
"energy_above_hull": 4.470644239473684,
"spacegroup": 166
},
{
"id": "jvasp-106249",
"created_at": "2022-09-04T14:38:39.922446Z",
"updated_at": "2022-09-04T14:38:39.922477Z",
"structure_string": "Hf6 Al2\n1.0\n6.117945 0.000000 -0.000000\n-3.058973 5.298295 0.000000\n-0.000000 -0.000000 4.998558\nHf Al\n6 2\ndirect\n0.169860 0.339720 0.250000 Hf\n0.660280 0.830139 0.250000 Hf\n0.169860 0.830139 0.250000 Hf\n0.830140 0.660279 0.750000 Hf\n0.339721 0.169860 0.750000 Hf\n0.830140 0.169860 0.750000 Hf\n0.333333 0.666666 0.750000 Al\n0.666668 0.333333 0.250000 Al\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Hf",
"Al"
],
"chemical_system": "Al-Hf",
"density": 11.52863163466683,
"density_atomic": 0.04937459513113334,
"volume": 162.02664505405878,
"volume_molar": 12.196840792326247,
"formula_full": "Hf6 Al2",
"formula_reduced": "Hf3Al",
"formula_anonymous": "AB3",
"energy_above_hull": 4.47027545,
"spacegroup": 194
}
]
}