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=-created_at&page=472",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=470",
"results": [
{
"id": "jvasp-112557",
"created_at": "2022-09-04T14:38:41.429439Z",
"updated_at": "2022-09-04T14:38:41.429465Z",
"structure_string": "U2 Al20 Ru4\n1.0\n6.838429 0.003276 0.000000\n-0.886949 6.780667 0.000000\n0.000000 -0.000000 9.139670\nU Al Ru\n2 20 4\ndirect\n0.878339 0.121662 0.750000 U\n0.121661 0.878339 0.250000 U\n0.218633 0.479917 0.750000 Al\n0.479917 0.218633 0.250000 Al\n0.781367 0.520084 0.250000 Al\n0.520083 0.781368 0.750000 Al\n0.856713 0.588247 0.750000 Al\n0.588246 0.856713 0.250000 Al\n0.143287 0.411754 0.250000 Al\n0.411754 0.143288 0.750000 Al\n0.155292 0.844708 0.898995 Al\n0.844708 0.155293 0.101005 Al\n0.844708 0.155293 0.398995 Al\n0.375841 0.624160 0.451525 Al\n0.624159 0.375841 0.548475 Al\n0.375841 0.624160 0.048475 Al\n0.624159 0.375841 0.951525 Al\n0.222538 0.222538 0.500000 Al\n0.222538 0.222538 -0.000000 Al\n0.777462 0.777463 0.500000 Al\n0.777462 0.777463 -0.000000 Al\n0.155292 0.844708 0.601005 Al\n0.500000 0.000000 0.500000 Ru\n0.500000 0.000000 -0.000000 Ru\n-0.000000 0.500000 -0.000000 Ru\n-0.000000 0.500000 0.500000 Ru\n",
"nsites": 26,
"nelements": 3,
"elements": [
"U",
"Al",
"Ru"
],
"chemical_system": "Al-Ru-U",
"density": 5.563413606266263,
"density_atomic": 0.061346086183005716,
"volume": 423.82491887807834,
"volume_molar": 9.816666611843727,
"formula_full": "U2 Al20 Ru4",
"formula_reduced": "U(Al5Ru)2",
"formula_anonymous": "AB2C10",
"energy_above_hull": 2.978945769230769,
"spacegroup": 63
},
{
"id": "jvasp-112085",
"created_at": "2022-09-04T14:38:41.429359Z",
"updated_at": "2022-09-04T14:38:41.429392Z",
"structure_string": "Al1 H8 C5 Cl1 O5\n1.0\n5.254432 -0.126352 0.507822\n1.429944 5.227233 0.911337\n-0.281040 -0.172319 7.178374\nAl H C Cl O\n1 8 5 1 5\ndirect\n0.179051 0.679716 0.395673 Al\n0.568277 0.210868 0.601001 H\n0.757903 0.915518 0.696508 H\n0.466526 0.885905 0.966474 H\n0.201514 0.108920 0.852321 H\n0.459203 0.446566 0.848193 H\n0.682051 0.237797 0.001625 H\n0.742661 0.954463 0.302948 H\n0.975797 0.109464 0.222570 H\n0.554057 0.028992 0.679238 C\n0.413671 0.063479 0.870677 C\n0.291073 0.376209 0.110822 C\n0.425581 0.901756 0.555088 C\n0.479541 0.280233 0.955866 C\n0.945423 0.433678 0.542956 Cl\n0.271493 0.760981 0.623369 O\n0.378703 0.506352 0.223618 O\n0.063219 0.348767 0.123360 O\n0.455462 0.920566 0.375616 O\n0.936125 0.942845 0.279771 O\n",
"nsites": 20,
"nelements": 5,
"elements": [
"Al",
"H",
"C",
"Cl",
"O"
],
"chemical_system": "Al-C-Cl-H-O",
"density": 1.748666101736721,
"density_atomic": 0.10003120876780205,
"volume": 199.93760193806216,
"volume_molar": 6.020261910439296,
"formula_full": "Al1 H8 C5 Cl1 O5",
"formula_reduced": "AlH8C5ClO5",
"formula_anonymous": "ABC5D5E8",
"energy_above_hull": 4.039540718375,
"spacegroup": 1
},
{
"id": "jvasp-111941",
"created_at": "2022-09-04T14:38:41.428481Z",
"updated_at": "2022-09-04T14:38:41.428519Z",
"structure_string": "Co8 O12 F4\n1.0\n5.234742 -0.002085 0.261848\n1.656029 4.965893 0.261848\n-0.069486 -0.050055 8.471573\nCo O F\n8 12 4\ndirect\n0.136634 0.136635 0.361150 Co\n0.863365 0.863366 0.638850 Co\n0.755081 0.755082 0.262663 Co\n0.499999 0.500001 0.500000 Co\n0.000000 0.000000 0.000000 Co\n0.392301 0.392301 0.133499 Co\n0.607698 0.607700 0.866501 Co\n0.244917 0.244919 0.737337 Co\n0.547540 0.939491 0.754900 O\n0.302389 0.697611 0.000000 O\n0.697610 0.302390 0.000000 O\n0.939489 0.547542 0.754900 O\n0.452458 0.060511 0.245100 O\n0.023376 0.023377 0.778012 O\n0.976623 0.976624 0.221988 O\n0.534795 0.534796 0.283065 O\n0.721925 0.721926 0.481113 O\n0.465204 0.465205 0.716935 O\n0.060510 0.452459 0.245100 O\n0.278074 0.278075 0.518887 O\n0.233161 0.233163 0.972313 F\n0.194316 0.805684 0.500000 F\n0.805683 0.194317 0.500000 F\n0.766838 0.766838 0.027688 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Co",
"O",
"F"
],
"chemical_system": "Co-F-O",
"density": 5.571524558895397,
"density_atomic": 0.10889958419128319,
"volume": 220.3865164245601,
"volume_molar": 5.529994264644804,
"formula_full": "Co8 O12 F4",
"formula_reduced": "Co2O3F",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.311117097083333,
"spacegroup": 12
},
{
"id": "jvasp-114502",
"created_at": "2022-09-04T14:38:41.426694Z",
"updated_at": "2022-09-04T14:38:41.426710Z",
"structure_string": "La1 B1 O2\n1.0\n3.777558 0.000000 -0.000000\n0.000000 3.777558 -0.000000\n0.000000 0.000000 4.381490\nLa B O\n1 1 2\ndirect\n0.500000 0.500000 0.562691 La\n0.000000 0.000000 0.046484 B\n0.000000 0.000000 0.343849 O\n0.500000 0.500000 0.056977 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"B",
"O"
],
"chemical_system": "B-La-O",
"density": 4.826101083751685,
"density_atomic": 0.06397582340413088,
"volume": 62.52361887915494,
"volume_molar": 9.41315084287161,
"formula_full": "La1 B1 O2",
"formula_reduced": "LaBO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.297626145833333,
"spacegroup": 99
},
{
"id": "jvasp-114430",
"created_at": "2022-09-04T14:38:41.425994Z",
"updated_at": "2022-09-04T14:38:41.426017Z",
"structure_string": "As1 S1 F1\n1.0\n2.633772 -0.000000 0.000000\n-0.000000 2.633772 -0.000000\n0.000000 -0.000000 7.604591\nAs S F\n1 1 1\ndirect\n0.000000 0.000000 0.294042 As\n0.000000 0.000000 0.664229 S\n0.000000 0.000000 0.057207 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"As",
"S",
"F"
],
"chemical_system": "As-F-S",
"density": 3.9658449873119763,
"density_atomic": 0.05687076115624502,
"volume": 52.7511842466446,
"volume_molar": 10.589168559666279,
"formula_full": "As1 S1 F1",
"formula_reduced": "AsSF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9964340108333332,
"spacegroup": 99
},
{
"id": "jvasp-111679",
"created_at": "2022-09-04T14:38:41.422441Z",
"updated_at": "2022-09-04T14:38:41.422470Z",
"structure_string": "Dy12 Os4\n1.0\n6.288364 0.000000 0.000000\n-0.000000 7.349970 0.000000\n0.000000 0.000000 9.019667\nDy Os\n12 4\ndirect\n0.333739 0.676492 0.062160 Dy\n0.166261 0.176492 0.437840 Dy\n0.666260 0.323508 0.562161 Dy\n0.833739 0.823508 0.937840 Dy\n0.666260 0.323508 0.937840 Dy\n0.833739 0.823508 0.562161 Dy\n0.333739 0.676492 0.437840 Dy\n0.166261 0.176492 0.062160 Dy\n0.871654 0.536902 0.250000 Dy\n0.628345 0.036902 0.250000 Dy\n0.128345 0.463098 0.750000 Dy\n0.371654 0.963098 0.750000 Dy\n0.041938 0.883409 0.250000 Os\n0.458061 0.383409 0.250000 Os\n0.958061 0.116591 0.750000 Os\n0.541938 0.616591 0.750000 Os\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Dy",
"Os"
],
"chemical_system": "Dy-Os",
"density": 10.798217127503037,
"density_atomic": 0.038380112151646564,
"volume": 416.88257545421413,
"volume_molar": 15.69078468610374,
"formula_full": "Dy12 Os4",
"formula_reduced": "Dy3Os",
"formula_anonymous": "AB3",
"energy_above_hull": 2.462923625,
"spacegroup": 62
},
{
"id": "jvasp-114601",
"created_at": "2022-09-04T14:38:41.420373Z",
"updated_at": "2022-09-04T14:38:41.420401Z",
"structure_string": "Be1 As2\n1.0\n4.719045 -0.000000 0.000000\n-2.359522 4.086813 -0.000000\n0.000000 0.000000 2.696816\nBe As\n1 2\ndirect\n0.000000 0.000000 0.000000 Be\n0.333333 0.666665 0.000000 As\n0.666665 0.333333 0.000000 As\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Be",
"As"
],
"chemical_system": "As-Be",
"density": 5.071784938553455,
"density_atomic": 0.057680770579693424,
"volume": 52.010400864099296,
"volume_molar": 10.440465166254388,
"formula_full": "Be1 As2",
"formula_reduced": "BeAs2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.093749866666667,
"spacegroup": 191
},
{
"id": "jvasp-114327",
"created_at": "2022-09-04T14:38:41.418307Z",
"updated_at": "2022-09-04T14:38:41.418332Z",
"structure_string": "Li2 Bi1\n1.0\n4.943357 -0.000000 -0.000000\n-2.471678 4.281072 0.000000\n-0.000000 -0.000000 3.470053\nLi Bi\n2 1\ndirect\n0.333332 0.666666 0.000000 Li\n0.666667 0.333333 0.000000 Li\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"Bi"
],
"chemical_system": "Bi-Li",
"density": 5.039358846623089,
"density_atomic": 0.04085174752448554,
"volume": 73.43627095026653,
"volume_molar": 14.741452018400132,
"formula_full": "Li2 Bi1",
"formula_reduced": "Li2Bi",
"formula_anonymous": "AB2",
"energy_above_hull": 0.5353181,
"spacegroup": 191
},
{
"id": "jvasp-116134",
"created_at": "2022-09-04T14:38:41.414582Z",
"updated_at": "2022-09-04T14:38:41.414611Z",
"structure_string": "Li2 P1 H1\n1.0\n-2.117110 3.219015 1.909938\n2.117110 -3.219015 1.909938\n2.117110 3.219015 -1.909938\nLi P H\n2 1 1\ndirect\n0.320100 0.607373 0.712724 Li\n0.894647 0.607373 0.287274 Li\n0.094204 0.094204 -0.000000 P\n0.471045 0.471045 -0.000000 H\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"P",
"H"
],
"chemical_system": "H-Li-P",
"density": 1.4627581267911653,
"density_atomic": 0.07682707637001919,
"volume": 52.06497746621203,
"volume_molar": 7.8385655741939235,
"formula_full": "Li2 P1 H1",
"formula_reduced": "Li2PH",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.603833875,
"spacegroup": 44
},
{
"id": "jvasp-111924",
"created_at": "2022-09-04T14:38:41.411854Z",
"updated_at": "2022-09-04T14:38:41.411879Z",
"structure_string": "Li4 Ti4 Co4 O16\n1.0\n5.904391 0.000143 -0.000081\n-0.000378 8.244437 0.000067\n0.000027 -0.000030 5.904419\nLi Ti Co O\n4 4 4 16\ndirect\n0.227047 -0.000001 0.000000 Li\n0.772950 0.500002 -0.000000 Li\n0.000001 0.249999 0.227051 Li\n-0.000000 0.750001 0.772952 Li\n0.500000 0.249998 0.223309 Ti\n0.223310 -0.000002 0.500002 Ti\n0.776691 0.500005 0.500001 Ti\n0.499999 0.750000 0.776688 Ti\n0.744114 0.875000 0.255883 Co\n0.255884 0.625000 0.255881 Co\n0.744121 0.125000 0.744118 Co\n0.255881 0.375001 0.744118 Co\n0.737064 0.737915 0.513279 O\n0.262936 0.762085 0.513275 O\n0.737066 0.262084 0.486723 O\n0.262937 0.237916 0.486724 O\n0.513277 0.487916 0.262935 O\n0.486722 0.012083 0.262936 O\n0.736549 0.754898 0.989537 O\n0.736548 0.245105 0.010468 O\n0.989534 0.495104 0.736550 O\n0.010468 0.004898 0.736546 O\n0.989532 0.504896 0.263454 O\n0.010466 0.995104 0.263451 O\n0.513276 0.512085 0.737064 O\n0.263449 0.254895 0.010468 O\n0.263454 0.745103 0.989534 O\n0.486725 0.987917 0.737065 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Ti",
"Co",
"O"
],
"chemical_system": "Co-Li-O-Ti",
"density": 4.107504400723132,
"density_atomic": 0.09741924253180435,
"volume": 287.417549883524,
"volume_molar": 6.181674793903224,
"formula_full": "Li4 Ti4 Co4 O16",
"formula_reduced": "LiTiCoO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.529093319047619,
"spacegroup": 95
},
{
"id": "jvasp-112501",
"created_at": "2022-09-04T14:38:41.403420Z",
"updated_at": "2022-09-04T14:38:41.403446Z",
"structure_string": "Li4 Mn3 Co1 O8\n1.0\n4.967984 0.019784 2.929327\n1.682844 4.674323 2.929327\n0.028031 0.019784 5.767239\nLi Mn Co O\n4 3 1 8\ndirect\n0.499999 0.499999 0.500002 Li\n-0.000000 0.500000 0.000001 Li\n0.500000 -0.000000 0.000001 Li\n0.000000 -0.000000 0.500000 Li\n0.500000 -0.000001 0.500001 Mn\n-0.000000 0.499999 0.500001 Mn\n0.499999 0.499999 0.000001 Mn\n0.000000 0.000000 0.000000 Co\n0.256804 0.256804 0.256805 O\n0.755912 0.262693 0.755915 O\n0.262694 0.755911 0.755914 O\n0.755912 0.755911 0.262696 O\n0.743195 0.743194 0.743198 O\n0.244087 0.737305 0.244088 O\n0.737305 0.244086 0.244089 O\n0.244087 0.244086 0.737307 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Co",
"O"
],
"chemical_system": "Co-Li-Mn-O",
"density": 4.73247138763929,
"density_atomic": 0.12015438616620455,
"volume": 133.16201356035282,
"volume_molar": 5.01200243465921,
"formula_full": "Li4 Mn3 Co1 O8",
"formula_reduced": "Li4Mn3CoO8",
"formula_anonymous": "AB3C4D8",
"energy_above_hull": 2.8468719140086205,
"spacegroup": 166
},
{
"id": "jvasp-116141",
"created_at": "2022-09-04T14:38:41.402198Z",
"updated_at": "2022-09-04T14:38:41.402232Z",
"structure_string": "Li1 H1 S1\n1.0\n4.158449 -0.440954 0.000000\n-2.512573 3.762297 0.000000\n0.000000 0.000000 4.330880\nLi H S\n1 1 1\ndirect\n0.018930 0.334513 0.000000 Li\n0.197819 -0.018710 0.000000 H\n0.783253 0.684199 0.000000 S\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"H",
"S"
],
"chemical_system": "H-Li-S",
"density": 1.0553530987525377,
"density_atomic": 0.04764953099634489,
"volume": 62.95969629229141,
"volume_molar": 12.638405109300965,
"formula_full": "Li1 H1 S1",
"formula_reduced": "LiHS",
"formula_anonymous": "ABC",
"energy_above_hull": 1.3273900000000003,
"spacegroup": 6
}
]
}