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=-formula_reduced&page=3810",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=3808",
"results": [
{
"id": "jvasp-110758",
"created_at": "2022-09-04T14:38:48.496379Z",
"updated_at": "2022-09-04T14:38:48.496412Z",
"structure_string": "Ca2 Ge4 Pt4\n1.0\n4.343957 0.000000 0.000000\n0.000000 4.343989 0.003420\n0.000000 -0.007852 10.233111\nCa Ge Pt\n2 4 4\ndirect\n0.254406 0.249989 0.750539 Ca\n0.754406 0.750012 0.249461 Ca\n0.754326 0.750033 0.629426 Ge\n0.754464 0.249998 -0.000000 Ge\n0.254464 0.750003 0.000000 Ge\n0.254326 0.249967 0.370574 Ge\n0.254338 0.749958 0.500020 Pt\n0.754469 0.750007 0.870335 Pt\n0.254469 0.249993 0.129665 Pt\n0.754339 0.250043 0.499980 Pt\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ca",
"Ge",
"Pt"
],
"chemical_system": "Ca-Ge-Pt",
"density": 9.89832842274743,
"density_atomic": 0.05178665001328649,
"volume": 193.09995910981652,
"volume_molar": 11.628751345095592,
"formula_full": "Ca2 Ge4 Pt4",
"formula_reduced": "Ca(GePt)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.205283024,
"spacegroup": 129
},
{
"id": "jvasp-17382",
"created_at": "2022-09-04T14:38:31.165329Z",
"updated_at": "2022-09-04T14:38:31.165350Z",
"structure_string": "Ca1 Ge2 Pd2\n1.0\n4.044457 0.000000 -1.608555\n-0.639752 3.993539 -1.608555\n0.017037 0.019983 5.931689\nCa Ge Pd\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.375495 0.375494 0.750990 Ge\n0.624507 0.624506 0.249012 Ge\n0.250001 0.750000 0.500001 Pd\n0.750001 0.250000 0.500001 Pd\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Ge",
"Pd"
],
"chemical_system": "Ca-Ge-Pd",
"density": 6.882949901725557,
"density_atomic": 0.05204708859228793,
"volume": 96.06685282951396,
"volume_molar": 11.570562202190748,
"formula_full": "Ca1 Ge2 Pd2",
"formula_reduced": "Ca(GePd)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.816266744,
"spacegroup": 139
},
{
"id": "jvasp-27519",
"created_at": "2022-09-04T14:36:40.725286Z",
"updated_at": "2022-09-04T14:36:40.725320Z",
"structure_string": "Ca4 Ge4 O12\n1.0\n5.315456 -0.000000 0.000000\n0.000000 5.361686 0.000000\n0.000000 0.000000 7.531362\nCa Ge O\n4 4 12\ndirect\n0.991351 0.041188 0.250000 Ca\n0.491350 0.458812 0.750000 Ca\n0.508650 0.541188 0.250000 Ca\n0.008650 0.958813 0.750000 Ca\n0.000000 0.500000 0.000000 Ge\n0.500000 0.000000 0.000000 Ge\n0.500000 0.000000 0.500000 Ge\n0.000000 0.500000 0.500000 Ge\n0.574974 0.015862 0.750000 O\n0.074975 0.484139 0.250000 O\n0.709445 0.288874 0.038991 O\n0.209445 0.211127 0.961008 O\n0.790556 0.788874 0.461008 O\n0.209445 0.211127 0.538991 O\n0.290556 0.711127 0.961008 O\n0.790556 0.788874 0.038991 O\n0.425026 0.984139 0.250000 O\n0.709445 0.288874 0.461008 O\n0.290556 0.711127 0.538991 O\n0.925027 0.515862 0.750000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Ca",
"Ge",
"O"
],
"chemical_system": "Ca-Ge-O",
"density": 4.9733991675721,
"density_atomic": 0.09317825413099695,
"volume": 214.6423560574821,
"volume_molar": 6.463032406180979,
"formula_full": "Ca4 Ge4 O12",
"formula_reduced": "CaGeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.127167374,
"spacegroup": 62
},
{
"id": "jvasp-22970",
"created_at": "2022-09-04T14:37:33.480646Z",
"updated_at": "2022-09-04T14:37:33.480666Z",
"structure_string": "Ca6 Ge6 O18\n1.0\n7.353363 0.001620 0.036839\n-0.017464 7.590925 0.003490\n-0.677921 -1.913904 7.944838\nCa Ge O\n6 6 18\ndirect\n0.969643 0.245832 0.986297 Ca\n0.030358 0.754169 0.013703 Ca\n0.261602 0.925418 0.708614 Ca\n0.738398 0.074583 0.291387 Ca\n0.259052 0.427074 0.709000 Ca\n0.740949 0.572928 0.291000 Ca\n0.552527 0.727114 0.908678 Ge\n0.447473 0.272888 0.091322 Ge\n0.775726 0.395006 0.681234 Ge\n0.778905 0.942657 0.676793 Ge\n0.221095 0.057344 0.323207 Ge\n0.224274 0.604995 0.318766 Ge\n0.024811 0.074722 0.191161 O\n0.712337 0.775570 0.083283 O\n0.287663 0.224431 0.916718 O\n0.313972 0.729705 0.904586 O\n0.686028 0.270297 0.095414 O\n0.423105 0.498272 0.224180 O\n0.576896 0.501729 0.775821 O\n0.975189 0.925279 0.808839 O\n0.769821 0.373671 0.466176 O\n0.579244 0.870802 0.761199 O\n0.224177 0.137942 0.540354 O\n0.775823 0.862059 0.459647 O\n0.230179 0.626330 0.533825 O\n0.026651 0.522307 0.187075 O\n0.257817 0.819378 0.268754 O\n0.742183 0.180623 0.731247 O\n0.420757 0.129199 0.238802 O\n0.973349 0.477694 0.812925 O\n",
"nsites": 30,
"nelements": 3,
"elements": [
"Ca",
"Ge",
"O"
],
"chemical_system": "Ca-Ge-O",
"density": 3.608769467327507,
"density_atomic": 0.0676114719927013,
"volume": 443.7116825860339,
"volume_molar": 8.906980697965121,
"formula_full": "Ca6 Ge6 O18",
"formula_reduced": "CaGeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.120317374,
"spacegroup": 2
},
{
"id": "jvasp-36622",
"created_at": "2022-09-04T14:37:29.529110Z",
"updated_at": "2022-09-04T14:37:29.529125Z",
"structure_string": "Ca1 Ge1 O3\n1.0\n3.774552 -0.000000 -0.000000\n0.000000 3.774552 -0.000000\n-0.000000 -0.000000 3.774552\nCa Ge O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 Ge\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Ge",
"O"
],
"chemical_system": "Ca-Ge-O",
"density": 4.962637059654238,
"density_atomic": 0.09297662253201043,
"volume": 53.77695880788288,
"volume_molar": 6.4770483117158495,
"formula_full": "Ca1 Ge1 O3",
"formula_reduced": "CaGeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.140891374,
"spacegroup": 221
},
{
"id": "jvasp-113549",
"created_at": "2022-09-04T14:38:48.215073Z",
"updated_at": "2022-09-04T14:38:48.215098Z",
"structure_string": "Ca1 Ge1 O1\n1.0\n6.393160 1.077170 0.000000\n1.568636 3.345798 0.000000\n0.000000 0.000000 3.462254\nCa Ge O\n1 1 1\ndirect\n-0.137409 -0.001023 0.000000 Ca\n0.417465 -0.055699 0.000000 Ge\n0.074415 0.287474 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Ge",
"O"
],
"chemical_system": "Ca-Ge-O",
"density": 3.1336423335183685,
"density_atomic": 0.04398294689870361,
"volume": 68.20825368771332,
"volume_molar": 13.691990156706625,
"formula_full": "Ca1 Ge1 O1",
"formula_reduced": "CaGeO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.3742166233333333,
"spacegroup": 25
},
{
"id": "jvasp-113550",
"created_at": "2022-09-04T14:38:46.396801Z",
"updated_at": "2022-09-04T14:38:46.396843Z",
"structure_string": "Ca1 Ge1 O1\n1.0\n4.602508 -0.000000 -0.000000\n-2.301254 3.985889 0.000000\n-0.000000 0.000000 3.333009\nCa Ge O\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ca\n0.333334 0.666666 0.000000 Ge\n0.666666 0.333333 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Ge",
"O"
],
"chemical_system": "Ca-Ge-O",
"density": 3.4956675061317526,
"density_atomic": 0.04906423322571422,
"volume": 61.144336775810885,
"volume_molar": 12.273993424692591,
"formula_full": "Ca1 Ge1 O1",
"formula_reduced": "CaGeO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.7503399566666666,
"spacegroup": 187
},
{
"id": "jvasp-2646",
"created_at": "2022-09-04T14:37:01.466681Z",
"updated_at": "2022-09-04T14:37:01.466712Z",
"structure_string": "Ca2 Ge2 N4\n1.0\n4.672081 0.008100 -2.447757\n-2.963900 4.346450 -0.378936\n0.005523 -0.008100 5.274449\nCa Ge N\n2 2 4\ndirect\n0.499999 0.250000 0.749999 Ca\n-0.000000 0.500000 0.499999 Ca\n0.000000 0.000000 0.000000 Ge\n0.500000 0.750000 0.249999 Ge\n0.576070 0.875000 0.951069 N\n0.923929 0.048930 0.624999 N\n0.423929 0.375000 0.298929 N\n0.076070 0.701071 0.124999 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ca",
"Ge",
"N"
],
"chemical_system": "Ca-Ge-N",
"density": 4.359061430210471,
"density_atomic": 0.07461272046831373,
"volume": 107.22032315384361,
"volume_molar": 8.071198479564167,
"formula_full": "Ca2 Ge2 N4",
"formula_reduced": "CaGeN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.4678607175,
"spacegroup": 122
},
{
"id": "jvasp-103737",
"created_at": "2022-09-04T14:36:49.444300Z",
"updated_at": "2022-09-04T14:36:49.444326Z",
"structure_string": "Ca1 Ge2 N2\n1.0\n3.200366 -0.000079 0.000126\n-1.600155 2.771437 0.000162\n-0.000263 -0.000370 8.729108\nCa Ge N\n1 2 2\ndirect\n0.000007 -0.000007 0.500000 Ca\n0.666697 0.333317 0.192874 Ge\n0.333340 0.666648 0.807126 Ge\n0.666648 0.333285 0.680526 N\n0.333365 0.666706 0.319474 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Ge",
"N"
],
"chemical_system": "Ca-Ge-N",
"density": 4.576326128391492,
"density_atomic": 0.06458053918745273,
"volume": 77.42270446963757,
"volume_molar": 9.32500848672077,
"formula_full": "Ca1 Ge2 N2",
"formula_reduced": "Ca(GeN)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.356259764,
"spacegroup": 164
},
{
"id": "jvasp-113545",
"created_at": "2022-09-04T14:38:49.927208Z",
"updated_at": "2022-09-04T14:38:49.927240Z",
"structure_string": "Ca1 Ge1 N1\n1.0\n4.491241 0.000000 -0.000000\n-2.245621 3.889529 0.000000\n0.000000 0.000000 3.717897\nCa Ge N\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ca\n0.333333 0.666668 0.000000 Ge\n0.666666 0.333334 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Ge",
"N"
],
"chemical_system": "Ca-Ge-N",
"density": 3.2400345508437787,
"density_atomic": 0.04619133635160515,
"volume": 64.9472441577402,
"volume_molar": 13.037381543066639,
"formula_full": "Ca1 Ge1 N1",
"formula_reduced": "CaGeN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.9314898733333328,
"spacegroup": 187
},
{
"id": "jvasp-17381",
"created_at": "2022-09-04T14:38:30.533661Z",
"updated_at": "2022-09-04T14:38:30.533680Z",
"structure_string": "Ca1 Ge2 Ir2\n1.0\n3.931461 0.000000 -1.466686\n-0.547168 3.893199 -1.466686\n-0.002036 -0.002342 5.997039\nCa Ge Ir\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.375821 0.375823 0.751644 Ge\n0.624177 0.624178 0.248355 Ge\n0.749999 0.250000 0.499999 Ir\n0.249999 0.750000 0.499999 Ir\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Ge",
"Ir"
],
"chemical_system": "Ca-Ge-Ir",
"density": 10.310881808135102,
"density_atomic": 0.05448793737870232,
"volume": 91.76342949539412,
"volume_molar": 11.052245780831983,
"formula_full": "Ca1 Ge2 Ir2",
"formula_reduced": "Ca(GeIr)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.083446904,
"spacegroup": 139
},
{
"id": "jvasp-114162",
"created_at": "2022-09-04T14:38:40.696792Z",
"updated_at": "2022-09-04T14:38:40.696819Z",
"structure_string": "Ca1 Ge1 H2\n1.0\n0.000000 2.962132 2.962132\n2.962132 -0.000000 2.962132\n2.962132 2.962132 0.000000\nCa Ge H\n1 1 2\ndirect\n0.499999 0.499999 0.499999 Ca\n0.000000 0.000000 0.000000 Ge\n0.250000 0.250000 0.250000 H\n0.749999 0.749999 0.749999 H\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Ge",
"H"
],
"chemical_system": "Ca-Ge-H",
"density": 3.66519899449052,
"density_atomic": 0.07695144369164578,
"volume": 51.98083113331192,
"volume_molar": 7.825897047664869,
"formula_full": "Ca1 Ge1 H2",
"formula_reduced": "CaGeH2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.3869140925,
"spacegroup": 225
}
]
}