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_atomic&page=4197",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=4195",
"results": [
{
"id": "jvasp-20184",
"created_at": "2022-09-04T14:37:44.951508Z",
"updated_at": "2022-09-04T14:37:44.951531Z",
"structure_string": "Be8 Mo4\n1.0\n2.225083 -3.853957 -0.000000\n2.225083 3.853957 0.000000\n-0.000000 0.000000 7.311427\nBe Mo\n8 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.000000 0.000000 0.500000 Be\n0.338737 0.169368 0.250000 Be\n0.169368 0.338737 0.750000 Be\n0.169368 0.830631 0.750000 Be\n0.830631 0.169368 0.250000 Be\n0.830631 0.661262 0.250000 Be\n0.661262 0.830631 0.750000 Be\n0.333332 0.666667 0.062336 Mo\n0.666667 0.333332 0.562336 Mo\n0.666667 0.333332 0.937664 Mo\n0.333332 0.666667 0.437664 Mo\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Be",
"Mo"
],
"chemical_system": "Be-Mo",
"density": 6.036607454518217,
"density_atomic": 0.09569649285245936,
"volume": 125.39644497213781,
"volume_molar": 6.292958686881736,
"formula_full": "Be8 Mo4",
"formula_reduced": "Be2Mo",
"formula_anonymous": "AB2",
"energy_above_hull": 2.760546033333333,
"spacegroup": 194
},
{
"id": "jvasp-30230",
"created_at": "2022-09-04T14:38:00.845520Z",
"updated_at": "2022-09-04T14:38:00.845543Z",
"structure_string": "Co5 Sb1 O12\n1.0\n2.492246 4.329140 0.479935\n-2.520454 4.332954 0.239969\n0.414704 0.720360 8.743458\nCo Sb O\n5 1 12\ndirect\n0.166646 0.666708 0.500000 Co\n0.666669 0.666660 0.000000 Co\n0.333332 0.333338 0.000000 Co\n0.833354 0.333291 0.500001 Co\n0.500000 0.000000 0.500000 Co\n0.000000 0.000000 0.000000 Sb\n0.037642 0.352736 0.886450 O\n0.315103 -0.000000 0.113544 O\n0.609621 0.352735 0.113551 O\n0.799303 0.666935 0.602623 O\n0.131425 0.000000 0.605412 O\n0.200697 0.333064 0.397378 O\n0.533762 0.666935 0.397378 O\n0.684896 0.000000 0.886457 O\n0.390379 0.647264 0.886450 O\n0.962358 0.647263 0.113551 O\n0.466238 0.333064 0.602623 O\n0.868575 -0.000000 0.394589 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Co",
"Sb",
"O"
],
"chemical_system": "Co-O-Sb",
"density": 5.371429581125775,
"density_atomic": 0.09569972434868165,
"volume": 188.0883160584356,
"volume_molar": 6.292746192307042,
"formula_full": "Co5 Sb1 O12",
"formula_reduced": "Co5SbO12",
"formula_anonymous": "AB5C12",
"energy_above_hull": 3.220488477777778,
"spacegroup": 12
},
{
"id": "jvasp-85685",
"created_at": "2022-09-04T14:35:50.656310Z",
"updated_at": "2022-09-04T14:35:50.656338Z",
"structure_string": "Eu2 Mg2 H8\n1.0\n1.829036 6.216126 0.000000\n-1.829036 6.216126 0.000000\n0.000000 0.000000 5.514396\nEu Mg H\n2 2 8\ndirect\n0.837726 0.837726 0.764853 Eu\n0.162275 0.162275 0.264853 Eu\n0.578176 0.578176 0.714314 Mg\n0.421825 0.421825 0.214314 Mg\n0.673380 0.673380 -0.004976 H\n0.326620 0.326620 0.495025 H\n0.704990 0.704990 0.501712 H\n0.295011 0.295011 0.001712 H\n0.979920 0.979920 0.090931 H\n0.020080 0.020080 0.590931 H\n0.441768 0.441768 0.834168 H\n0.558233 0.558233 0.334167 H\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Eu",
"Mg",
"H"
],
"chemical_system": "Eu-H-Mg",
"density": 4.775365767476337,
"density_atomic": 0.09569984566509666,
"volume": 125.39205174890476,
"volume_molar": 6.292738215142572,
"formula_full": "Eu2 Mg2 H8",
"formula_reduced": "EuMgH4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.953833175,
"spacegroup": 36
},
{
"id": "jvasp-70432",
"created_at": "2022-09-04T14:36:13.205479Z",
"updated_at": "2022-09-04T14:36:13.205494Z",
"structure_string": "Be2 Ni1 Pd1\n1.0\n2.790740 0.000000 0.000000\n0.000000 2.790740 0.000000\n0.000000 0.000000 5.365905\nBe Ni Pd\n2 1 1\ndirect\n0.000000 0.000000 0.023508 Be\n0.500000 0.500000 0.249376 Be\n0.000000 0.000000 0.441596 Ni\n0.500000 0.500000 0.785519 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Ni",
"Pd"
],
"chemical_system": "Be-Ni-Pd",
"density": 7.276880967480552,
"density_atomic": 0.09571461513547135,
"volume": 41.79090094379558,
"volume_molar": 6.291767199268845,
"formula_full": "Be2 Ni1 Pd1",
"formula_reduced": "Be2NiPd",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.5153850750000002,
"spacegroup": 99
},
{
"id": "jvasp-41813",
"created_at": "2022-09-04T14:37:37.916999Z",
"updated_at": "2022-09-04T14:37:37.917019Z",
"structure_string": "Pa1 O3\n1.0\n-1.840223 1.840223 3.084961\n1.840223 -1.840223 3.084961\n1.840223 1.840223 -3.084961\nPa O\n1 3\ndirect\n0.000000 0.000000 0.000000 Pa\n0.749999 0.250001 0.499998 O\n0.250001 0.749999 0.499998 O\n0.499999 0.499999 0.000000 O\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pa",
"O"
],
"chemical_system": "O-Pa",
"density": 11.088065137517658,
"density_atomic": 0.09572148181649458,
"volume": 41.78790302962826,
"volume_molar": 6.291315852741295,
"formula_full": "Pa1 O3",
"formula_reduced": "PaO3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.277408400000001,
"spacegroup": 139
},
{
"id": "jvasp-46710",
"created_at": "2022-09-04T14:38:34.549546Z",
"updated_at": "2022-09-04T14:38:34.549574Z",
"structure_string": "Li2 Mn2 P4 O16\n1.0\n0.000000 4.748515 0.049240\n8.412595 0.000000 0.000000\n0.000000 -4.397196 -6.321840\nLi Mn P O\n2 2 4 16\ndirect\n0.000000 0.500000 0.000000 Li\n-0.000000 0.000000 0.500000 Li\n0.499999 0.500000 0.500000 Mn\n0.500000 0.000000 0.000000 Mn\n0.770141 0.172117 0.750518 P\n0.229857 0.672117 0.749482 P\n0.770141 0.327882 0.250518 P\n0.229857 0.827882 0.249482 P\n0.506567 0.626830 0.711011 O\n0.871916 0.878911 0.051297 O\n0.493431 0.126830 0.788989 O\n0.128082 0.378912 0.448703 O\n0.677322 0.398966 0.039747 O\n0.798607 0.144314 0.228874 O\n0.201391 0.855686 0.771126 O\n0.128082 0.121088 0.948703 O\n0.871916 0.621088 0.551297 O\n0.506568 0.873169 0.211011 O\n0.322676 0.898965 0.460253 O\n0.493431 0.373169 0.288989 O\n0.677322 0.101034 0.539747 O\n0.798607 0.355686 0.728874 O\n0.322676 0.601034 0.960253 O\n0.201391 0.644314 0.271126 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Mn",
"P",
"O"
],
"chemical_system": "Li-Mn-O-P",
"density": 3.3356833424612238,
"density_atomic": 0.09572462955431342,
"volume": 250.719173443054,
"volume_molar": 6.291108973770521,
"formula_full": "Li2 Mn2 P4 O16",
"formula_reduced": "LiMn(PO4)2",
"formula_anonymous": "ABC2D8",
"energy_above_hull": 2.899902186781609,
"spacegroup": 14
},
{
"id": "jvasp-49976",
"created_at": "2022-09-04T14:38:11.476390Z",
"updated_at": "2022-09-04T14:38:11.476407Z",
"structure_string": "Li1 Ti3 O6\n1.0\n7.126748 1.480727 0.060727\n-7.126748 1.480727 -0.060727\n-0.191395 0.000000 4.948054\nLi Ti O\n1 3 6\ndirect\n0.779934 0.220068 0.934593 Li\n0.348988 0.651014 0.476590 Ti\n0.003759 0.996243 0.998885 Ti\n0.653899 0.346104 0.512990 Ti\n0.099037 0.900965 0.302334 O\n0.229601 0.770401 0.710521 O\n0.434964 0.565038 0.187368 O\n0.565552 0.434450 0.806032 O\n0.774055 0.225947 0.302305 O\n0.898024 0.101979 0.708077 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Li",
"Ti",
"O"
],
"chemical_system": "Li-O-Ti",
"density": 3.918859800659672,
"density_atomic": 0.09572515010413679,
"volume": 104.4657541839451,
"volume_molar": 6.291074762952762,
"formula_full": "Li1 Ti3 O6",
"formula_reduced": "LiTi3O6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 2.8806496,
"spacegroup": 8
},
{
"id": "jvasp-9094",
"created_at": "2022-09-04T14:37:08.929414Z",
"updated_at": "2022-09-04T14:37:08.929435Z",
"structure_string": "Ti4 O8\n1.0\n4.573359 0.000000 0.000000\n-0.000000 4.931559 0.000000\n0.000000 0.000000 5.558205\nTi O\n4 8\ndirect\n0.500000 0.750000 0.675228 Ti\n0.000000 0.250000 0.824773 Ti\n0.500000 0.250000 0.324773 Ti\n0.000000 0.750000 0.175227 Ti\n0.729178 0.081187 0.618100 O\n0.229178 0.918813 0.881901 O\n0.770822 0.581187 0.881901 O\n0.270822 0.418813 0.618100 O\n0.729178 0.581187 0.381900 O\n0.229178 0.418813 0.118100 O\n0.770822 0.081187 0.118100 O\n0.270822 0.918813 0.381900 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ti",
"O"
],
"chemical_system": "O-Ti",
"density": 4.231709507339912,
"density_atomic": 0.09572539303721209,
"volume": 125.35858688336903,
"volume_molar": 6.29105879738615,
"formula_full": "Ti4 O8",
"formula_reduced": "TiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.4749651111111115,
"spacegroup": 60
},
{
"id": "jvasp-46752",
"created_at": "2022-09-04T14:38:03.817140Z",
"updated_at": "2022-09-04T14:38:03.817158Z",
"structure_string": "Li6 Mn1 Cr1 P2 C2 O14\n1.0\n0.000000 4.934712 0.075261\n6.370040 0.000000 0.000000\n0.000000 -0.776443 -8.651599\nLi Mn Cr P C O\n6 1 1 2 2 14\ndirect\n0.804086 0.500000 0.887377 Li\n0.277422 0.268142 0.735220 Li\n0.277422 0.731858 0.735220 Li\n0.718901 0.767402 0.264439 Li\n0.718901 0.232599 0.264439 Li\n0.193962 0.000000 0.104652 Li\n0.777324 0.000000 0.653932 Mn\n0.195440 0.500000 0.334253 Cr\n0.265762 0.000000 0.406880 P\n0.745714 0.500000 0.595542 P\n0.668395 0.000000 0.960574 C\n0.323096 0.500000 0.040564 C\n0.485161 0.500000 0.172043 O\n0.149225 0.811742 0.306000 O\n0.149225 0.188259 0.306000 O\n0.832452 0.500000 0.429922 O\n0.583806 0.000000 0.417244 O\n0.431460 0.500000 0.588419 O\n0.921730 0.000000 0.940904 O\n0.865508 0.688503 0.694819 O\n0.865508 0.311497 0.694819 O\n0.489226 0.000000 0.837938 O\n0.424126 0.500000 0.909039 O\n0.586571 0.000000 0.098502 O\n0.183067 0.000000 0.571662 O\n0.066514 0.500000 0.049602 O\n",
"nsites": 26,
"nelements": 6,
"elements": [
"Li",
"Mn",
"Cr",
"P",
"C",
"O"
],
"chemical_system": "C-Cr-Li-Mn-O-P",
"density": 2.803634845607705,
"density_atomic": 0.09573436022287798,
"volume": 271.5848305610412,
"volume_molar": 6.290469530459,
"formula_full": "Li6 Mn1 Cr1 P2 C2 O14",
"formula_reduced": "Li6MnCrP2(CO7)2",
"formula_anonymous": "ABC2D2E6F14",
"energy_above_hull": 3.1171717169761277,
"spacegroup": 6
},
{
"id": "jvasp-71194",
"created_at": "2022-09-04T14:36:15.754923Z",
"updated_at": "2022-09-04T14:36:15.754950Z",
"structure_string": "Be2 Fe1 Tc1\n1.0\n4.059480 0.000000 -0.000000\n-0.000000 4.059480 0.000000\n0.000000 -0.000000 2.535291\nBe Fe Tc\n2 1 1\ndirect\n0.500000 0.000000 0.000000 Be\n0.000000 0.500000 0.000000 Be\n0.500000 0.500000 0.500000 Fe\n0.000000 0.000000 0.500000 Tc\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Fe",
"Tc"
],
"chemical_system": "Be-Fe-Tc",
"density": 6.830915930635334,
"density_atomic": 0.09573954615490021,
"volume": 41.780018400424275,
"volume_molar": 6.290128794068625,
"formula_full": "Be2 Fe1 Tc1",
"formula_reduced": "Be2FeTc",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.1301648,
"spacegroup": 123
},
{
"id": "jvasp-101791",
"created_at": "2022-09-04T14:36:39.337334Z",
"updated_at": "2022-09-04T14:36:39.337359Z",
"structure_string": "H10 C18 S3\n1.0\n3.866327 0.008939 0.281604\n1.916818 5.739772 0.202334\n0.139200 -0.197176 14.609879\nH C S\n10 18 3\ndirect\n0.278547 0.842368 0.050690 H\n0.885579 0.985626 0.708650 H\n0.005703 0.077269 0.313475 H\n0.647362 0.088734 0.050056 H\n0.641851 0.148234 0.472022 H\n0.937028 0.842353 0.199389 H\n0.978442 0.077447 0.935251 H\n0.270813 0.148392 0.776804 H\n0.185339 0.985627 0.541623 H\n0.324841 0.088751 0.198623 H\n0.370156 0.604766 0.544004 C\n0.096518 0.675342 0.167449 C\n0.034481 0.826742 0.670252 C\n0.286840 0.675342 0.082338 C\n0.196282 0.826743 0.579758 C\n0.564541 0.520351 0.457368 C\n0.102085 0.465765 0.212346 C\n0.084099 0.604780 0.705656 C\n0.912439 0.452128 0.301008 C\n0.886180 0.250262 0.343734 C\n0.691980 0.287920 0.430082 C\n0.308842 0.256128 0.166715 C\n0.495416 0.256116 0.082287 C\n0.974558 0.520404 0.792150 C\n0.695135 0.452185 0.948385 C\n0.080568 0.288043 0.819019 C\n0.924162 0.250390 0.905296 C\n0.491749 0.465769 0.037061 C\n0.331927 0.396696 0.624669 S\n0.680171 0.691919 0.878299 S\n0.686631 0.691911 0.371533 S\n",
"nsites": 31,
"nelements": 3,
"elements": [
"H",
"C",
"S"
],
"chemical_system": "C-H-S",
"density": 1.6537399768033776,
"density_atomic": 0.09574024711052978,
"volume": 323.79277195943786,
"volume_molar": 6.290082741323601,
"formula_full": "H10 C18 S3",
"formula_reduced": "H10(C6S)3",
"formula_anonymous": "A3B10C18",
"energy_above_hull": 5.819412580645161,
"spacegroup": 5
},
{
"id": "jvasp-51005",
"created_at": "2022-09-04T14:36:43.677600Z",
"updated_at": "2022-09-04T14:36:43.677617Z",
"structure_string": "V6 H4 O13\n1.0\n6.023185 2.005546 -1.131810\n-6.023185 2.005546 1.131810\n-0.048441 0.000000 9.952182\nV H O\n6 4 13\ndirect\n0.643284 0.356718 0.997491 V\n0.356718 0.643284 0.002509 V\n0.593382 0.406620 0.630248 V\n0.406620 0.593382 0.369752 V\n0.289864 0.710137 0.627655 V\n0.710138 0.289864 0.372345 V\n0.811792 0.188209 0.877721 H\n0.188210 0.811792 0.122279 H\n0.091867 0.908135 0.496960 H\n0.908135 0.091867 0.503040 H\n0.685620 0.314382 0.195937 O\n0.314382 0.685620 0.804063 O\n0.379836 0.620166 0.193433 O\n0.620166 0.379836 0.806567 O\n0.500001 0.500001 0.000000 O\n0.179968 0.820034 0.021641 O\n0.753593 0.246409 0.594562 O\n0.888221 0.111781 0.401904 O\n0.111781 0.888221 0.598095 O\n0.433499 0.566503 0.585167 O\n0.820034 0.179968 0.978358 O\n0.246409 0.753593 0.405437 O\n0.566503 0.433499 0.414833 O\n",
"nsites": 23,
"nelements": 3,
"elements": [
"V",
"H",
"O"
],
"chemical_system": "H-O-V",
"density": 3.5784490681761865,
"density_atomic": 0.09574543973967377,
"volume": 240.22031819516053,
"volume_molar": 6.289741606883678,
"formula_full": "V6 H4 O13",
"formula_reduced": "V6H4O13",
"formula_anonymous": "A4B6C13",
"energy_above_hull": 3.661993508695653,
"spacegroup": 12
}
]
}