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=4360",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=4358",
"results": [
{
"id": "jvasp-56219",
"created_at": "2022-09-04T14:37:31.069343Z",
"updated_at": "2022-09-04T14:37:31.069369Z",
"structure_string": "Li2 B12 C2\n1.0\n4.705272 0.000000 0.000000\n0.000000 4.778230 -2.307395\n0.000000 0.002127 5.306180\nLi B C\n2 12 2\ndirect\n0.500000 0.527744 0.115734 Li\n0.500000 0.115734 0.527744 Li\n0.817349 0.257618 0.257618 B\n0.693666 0.901523 0.097929 B\n0.693666 0.097928 0.901523 B\n0.183207 0.743118 0.743118 B\n0.000000 0.332613 0.993243 B\n0.306333 0.097928 0.901523 B\n0.000000 0.007513 0.668909 B\n0.000000 0.993243 0.332614 B\n0.306333 0.901523 0.097929 B\n0.182650 0.257618 0.257618 B\n0.000000 0.668909 0.007513 B\n0.816793 0.743118 0.743118 B\n0.646267 0.501638 0.501638 C\n0.353733 0.501638 0.501638 C\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Li",
"B",
"C"
],
"chemical_system": "B-C-Li",
"density": 2.332904768631107,
"density_atomic": 0.13409178158051888,
"volume": 119.32125751041936,
"volume_molar": 4.491058802424704,
"formula_full": "Li2 B12 C2",
"formula_reduced": "LiB6C",
"formula_anonymous": "ABC6",
"energy_above_hull": 4.8561644375,
"spacegroup": 38
},
{
"id": "jvasp-118106",
"created_at": "2022-09-04T14:38:50.642819Z",
"updated_at": "2022-09-04T14:38:50.642844Z",
"structure_string": "Cl1 O2\n1.0\n4.301975 0.000000 -0.135924\n0.000000 2.779950 0.000000\n-0.103281 0.000000 4.018116\nCl O\n1 2\ndirect\n0.544674 0.000000 -0.092262 Cl\n-0.124583 0.000000 -0.485122 O\n-0.020091 0.000000 -0.022616 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Cl",
"O"
],
"chemical_system": "Cl-O",
"density": 2.3327497476402317,
"density_atomic": 0.062480826351551895,
"volume": 48.01472988081705,
"volume_molar": 9.63838206318861,
"formula_full": "Cl1 O2",
"formula_reduced": "ClO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.174010355833333,
"spacegroup": 6
},
{
"id": "jvasp-101930",
"created_at": "2022-09-04T14:36:57.629163Z",
"updated_at": "2022-09-04T14:36:57.629187Z",
"structure_string": "Mg2 H4 C6 O8\n1.0\n4.440735 -0.037821 1.678400\n1.331792 6.028754 1.676769\n-0.001991 0.000378 6.706179\nMg H C O\n2 4 6 8\ndirect\n0.976410 0.808150 0.434352 Mg\n0.976410 0.808150 0.934351 Mg\n0.265609 0.346202 0.471121 H\n0.265606 0.346203 0.971120 H\n0.687114 0.270063 0.384757 H\n0.687111 0.270063 0.884759 H\n0.476364 0.308134 0.838107 C\n0.476366 0.308133 0.338106 C\n0.454382 0.098589 0.781192 C\n0.498356 0.517685 0.665418 C\n0.498356 0.517684 0.165418 C\n0.454382 0.098589 0.281192 C\n0.245674 0.658281 0.156376 O\n0.760156 0.549499 0.049500 O\n0.760157 0.549499 0.549502 O\n0.192584 0.066816 0.312026 O\n0.192583 0.066817 0.812026 O\n0.707045 0.957955 0.216154 O\n0.707045 0.957957 0.716154 O\n0.245675 0.658281 0.656375 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Mg",
"H",
"C",
"O"
],
"chemical_system": "C-H-Mg-O",
"density": 2.332589185829744,
"density_atomic": 0.11117622425773527,
"volume": 179.89457848141004,
"volume_molar": 5.4167523678795915,
"formula_full": "Mg2 H4 C6 O8",
"formula_reduced": "MgH2C3O4",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 3.714112305,
"spacegroup": 5
},
{
"id": "jvasp-97757",
"created_at": "2022-09-04T14:36:02.669446Z",
"updated_at": "2022-09-04T14:36:02.669470Z",
"structure_string": "K2 Zr1 Cd1 H16 C8 O24\n1.0\n-5.643267 5.643267 4.348085\n5.643267 -5.643267 4.348085\n5.643267 5.643267 -4.348085\nK Zr Cd H C O\n2 1 1 16 8 24\ndirect\n0.499999 0.499999 0.000000 K\n0.750000 0.250000 0.500000 K\n0.250000 0.750000 0.500000 Zr\n0.000000 0.000000 0.000000 Cd\n0.995852 0.150197 0.667379 H\n0.482819 0.328473 0.332621 H\n0.849802 0.517181 0.845654 H\n0.671527 0.004148 0.154346 H\n0.139266 0.220657 0.580775 H\n0.639882 0.558491 0.419226 H\n0.779343 0.360118 0.918609 H\n0.441508 0.860734 0.081391 H\n0.811926 0.892918 0.422840 H\n0.470079 0.389087 0.577161 H\n0.107082 0.529922 0.919008 H\n0.610913 0.188073 0.080992 H\n0.583153 0.750919 0.352043 H\n0.398877 0.231111 0.647958 H\n0.249081 0.601124 0.832234 H\n0.768889 0.416846 0.167766 H\n0.229982 0.953889 0.276021 C\n0.677867 0.953961 0.723979 C\n0.046039 0.770018 0.723907 C\n0.046111 0.322132 0.276094 C\n0.558742 0.795921 0.777952 C\n0.219209 0.441258 0.237179 C\n0.204079 0.982031 0.762821 C\n0.017969 0.780790 0.222049 C\n0.851891 0.411851 0.852815 O\n0.559037 -0.000924 0.147186 O\n0.694459 0.754086 0.358935 O\n0.395152 0.335525 0.641066 O\n0.245914 0.604848 0.940373 O\n0.664475 0.305540 0.059627 O\n0.352872 0.969351 0.394249 O\n0.575103 0.958624 0.605752 O\n0.030649 0.424897 0.383522 O\n0.041376 0.647127 0.616479 O\n0.268137 0.064562 0.205111 O\n0.935438 0.140548 0.203575 O\n0.936974 0.731863 0.796426 O\n0.886056 0.748662 0.106375 O\n0.642287 0.779682 0.893625 O\n0.251337 0.357713 0.137395 O\n0.220319 0.113943 0.862606 O\n-0.002783 0.678977 0.306553 O\n0.372424 0.690665 0.693448 O\n0.321023 0.627576 0.318241 O\n0.309336 0.002783 0.681760 O\n0.588148 0.440962 0.440039 O\n0.859452 0.063026 0.794890 O\n0.000924 0.148110 0.559961 O\n",
"nsites": 52,
"nelements": 6,
"elements": [
"K",
"Zr",
"Cd",
"H",
"C",
"O"
],
"chemical_system": "C-Cd-H-K-O-Zr",
"density": 2.3325240887156258,
"density_atomic": 0.09388238842431879,
"volume": 553.8845024369896,
"volume_molar": 6.414558535496374,
"formula_full": "K2 Zr1 Cd1 H16 C8 O24",
"formula_reduced": "K2ZrCdH16(CO3)8",
"formula_anonymous": "ABC2D8E16F24",
"energy_above_hull": 3.6852079663461534,
"spacegroup": 82
},
{
"id": "jvasp-97953",
"created_at": "2022-09-04T14:35:43.116032Z",
"updated_at": "2022-09-04T14:35:43.116054Z",
"structure_string": "K8 P8 H8 O28\n1.0\n8.004307 -0.000688 -0.790269\n0.066645 8.084261 -1.066224\n-0.021036 -0.010180 11.188367\nK P H O\n8 8 8 28\ndirect\n0.747805 0.297405 0.945862 K\n0.252195 0.702595 0.054138 K\n0.287426 0.121869 0.929215 K\n0.712575 0.878131 0.070785 K\n0.388744 0.297629 0.567299 K\n0.611256 0.702371 0.432702 K\n0.175317 0.781647 0.548418 K\n0.824683 0.218353 0.451583 K\n0.524526 0.287834 0.217723 P\n0.475474 0.712166 0.782278 P\n0.215156 0.459438 0.286719 P\n0.784845 0.540562 0.713282 P\n0.375825 0.994115 0.297186 P\n0.945721 0.860633 0.804288 P\n0.624175 0.005885 0.702814 P\n0.054279 0.139367 0.195713 P\n0.923142 0.884612 0.333903 H\n0.975211 0.701269 0.318817 H\n0.024789 0.298731 0.681184 H\n0.076859 0.115388 0.666098 H\n0.096881 0.439841 0.862649 H\n0.733245 0.519091 0.178788 H\n0.266756 0.480908 0.821212 H\n0.903120 0.560159 0.137352 H\n0.896719 0.423689 0.777771 O\n0.781953 0.565519 0.112624 O\n0.218047 0.434481 0.887377 O\n0.348427 0.388190 0.192016 O\n0.651574 0.611809 0.807985 O\n0.479405 0.170109 0.316959 O\n0.520595 0.829890 0.683041 O\n0.553459 0.187966 0.099692 O\n0.446542 0.812033 0.900308 O\n0.653536 0.405645 0.283656 O\n0.346464 0.594354 0.716345 O\n0.103281 0.576311 0.222230 O\n0.300517 0.518612 0.409118 O\n0.227338 0.029268 0.191701 O\n0.111418 0.293964 0.300157 O\n0.888582 0.706036 0.699844 O\n0.019393 0.193208 0.073522 O\n0.980608 0.806792 0.926478 O\n0.925017 0.048442 0.248216 O\n0.074983 0.951558 0.751785 O\n0.479551 0.858226 0.238208 O\n0.520450 0.141774 0.761793 O\n0.311072 0.983103 0.416067 O\n0.688928 0.016897 0.583934 O\n0.083279 0.216617 0.626635 O\n0.772663 0.970732 0.808299 O\n0.699483 0.481388 0.590883 O\n0.916721 0.783382 0.373365 O\n",
"nsites": 52,
"nelements": 4,
"elements": [
"K",
"P",
"H",
"O"
],
"chemical_system": "H-K-O-P",
"density": 2.332440037545095,
"density_atomic": 0.07184635017335053,
"volume": 723.766758847661,
"volume_molar": 8.381971729210749,
"formula_full": "K8 P8 H8 O28",
"formula_reduced": "K2P2H2O7",
"formula_anonymous": "A2B2C2D7",
"energy_above_hull": 2.309973961538461,
"spacegroup": 2
},
{
"id": "jvasp-74887",
"created_at": "2022-09-04T14:35:45.175452Z",
"updated_at": "2022-09-04T14:35:45.175474Z",
"structure_string": "K2 Y1 Be1\n1.0\n-2.808596 2.808596 3.973803\n2.808596 -2.808596 3.973803\n2.808596 2.808596 -3.973803\nK Y Be\n2 1 1\ndirect\n0.000000 0.000000 0.000000 K\n0.250000 0.750001 0.500001 K\n0.500000 0.500000 0.000000 Y\n0.750001 0.250000 0.500001 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Y",
"Be"
],
"chemical_system": "Be-K-Y",
"density": 2.3323819213982038,
"density_atomic": 0.03190179505719483,
"volume": 125.38479395371446,
"volume_molar": 18.877121958821636,
"formula_full": "K2 Y1 Be1",
"formula_reduced": "K2YBe",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9266918875,
"spacegroup": 216
},
{
"id": "jvasp-38364",
"created_at": "2022-09-04T14:37:50.038055Z",
"updated_at": "2022-09-04T14:37:50.038077Z",
"structure_string": "Rb1 Al1\n1.0\n4.310354 0.000000 0.000000\n0.000000 4.310354 0.000000\n-0.000000 0.000000 4.310354\nRb Al\n1 1\ndirect\n0.499999 0.499999 0.499999 Rb\n0.000000 0.000000 0.000000 Al\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Rb",
"Al"
],
"chemical_system": "Al-Rb",
"density": 2.3316705368649653,
"density_atomic": 0.02497417656451753,
"volume": 80.08272043858025,
"volume_molar": 24.113470746242957,
"formula_full": "Rb1 Al1",
"formula_reduced": "RbAl",
"formula_anonymous": "AB",
"energy_above_hull": 0.6244692666666667,
"spacegroup": 221
},
{
"id": "jvasp-8602",
"created_at": "2022-09-04T14:37:04.926112Z",
"updated_at": "2022-09-04T14:37:04.926137Z",
"structure_string": "Rb1 Ca1 H3\n1.0\n4.508029 -0.000000 0.000000\n0.000000 4.508029 0.000000\n0.000000 -0.000000 4.508029\nRb Ca H\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 Ca\n0.500000 0.000000 0.500000 H\n0.500000 0.500000 0.000000 H\n0.000000 0.500000 0.500000 H\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"Ca",
"H"
],
"chemical_system": "Ca-H-Rb",
"density": 2.3303832722476763,
"density_atomic": 0.05457703030885027,
"volume": 91.61363254294169,
"volume_molar": 11.034203814170233,
"formula_full": "Rb1 Ca1 H3",
"formula_reduced": "RbCaH3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.248348084,
"spacegroup": 221
},
{
"id": "jvasp-107548",
"created_at": "2022-09-04T14:36:58.825087Z",
"updated_at": "2022-09-04T14:36:58.825114Z",
"structure_string": "Mg1 Al2\n1.0\n3.017413 -0.000000 0.000000\n-1.508706 2.613157 0.000000\n-0.000000 -0.000000 7.073497\nMg Al\n1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.333333 0.666668 0.656970 Al\n0.666666 0.333334 0.343031 Al\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Mg",
"Al"
],
"chemical_system": "Al-Mg",
"density": 2.3302328922823645,
"density_atomic": 0.053788176435829775,
"volume": 55.774339246824105,
"volume_molar": 11.196030724678906,
"formula_full": "Mg1 Al2",
"formula_reduced": "MgAl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.9817312571428574,
"spacegroup": 164
},
{
"id": "jvasp-109440",
"created_at": "2022-09-04T14:38:19.318427Z",
"updated_at": "2022-09-04T14:38:19.318452Z",
"structure_string": "Li2 Sc1 Cu1 Cl6\n1.0\n6.031410 -0.000000 3.482236\n2.010470 5.686468 3.482236\n-0.000000 -0.000000 6.964472\nLi Sc Cu Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Li\n0.250000 0.250000 0.250000 Li\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500000 Cu\n0.749690 0.250310 0.250310 Cl\n0.250310 0.250310 0.749690 Cl\n0.250310 0.749690 0.749690 Cl\n0.250310 0.749690 0.250310 Cl\n0.749690 0.250310 0.749690 Cl\n0.749690 0.749690 0.250311 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Li",
"Sc",
"Cu",
"Cl"
],
"chemical_system": "Cl-Cu-Li-Sc",
"density": 2.3295731672886197,
"density_atomic": 0.04186492832956209,
"volume": 238.86342098282535,
"volume_molar": 14.384691435737118,
"formula_full": "Li2 Sc1 Cu1 Cl6",
"formula_reduced": "Li2ScCuCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.3502300105000001,
"spacegroup": 225
},
{
"id": "jvasp-120964",
"created_at": "2022-09-04T14:38:51.273732Z",
"updated_at": "2022-09-04T14:38:51.273760Z",
"structure_string": "Li1 Ga1 Cl1\n1.0\n3.387739 -0.000000 0.000000\n0.000000 3.387739 0.000000\n0.000000 -0.000000 6.964625\nLi Ga Cl\n1 1 1\ndirect\n0.000000 0.000000 -0.104681 Li\n0.000000 0.000000 0.541338 Ga\n0.000000 0.000000 0.204619 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Ga",
"Cl"
],
"chemical_system": "Cl-Ga-Li",
"density": 2.3291794027050075,
"density_atomic": 0.037532166102989525,
"volume": 79.93143779039822,
"volume_molar": 16.045278984098715,
"formula_full": "Li1 Ga1 Cl1",
"formula_reduced": "LiGaCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-113443",
"created_at": "2022-09-04T14:38:48.049050Z",
"updated_at": "2022-09-04T14:38:48.049073Z",
"structure_string": "B1 O1\n1.0\n3.541705 0.517719 0.117604\n-1.597421 -2.038484 0.040734\n0.931538 0.862323 -2.997418\nB O\n1 1\ndirect\n0.990217 0.940971 0.110599 B\n0.490988 0.347276 -0.077699 O\n",
"nsites": 2,
"nelements": 2,
"elements": [
"B",
"O"
],
"chemical_system": "B-O",
"density": 2.3286639030653458,
"density_atomic": 0.10461270112968657,
"volume": 19.118137457521858,
"volume_molar": 5.756605741911258,
"formula_full": "B1 O1",
"formula_reduced": "BO",
"formula_anonymous": "AB",
"energy_above_hull": 1.8719630416666664,
"spacegroup": 38
}
]
}