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=4386",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=4384",
"results": [
{
"id": "jvasp-101962",
"created_at": "2022-09-04T14:36:56.198411Z",
"updated_at": "2022-09-04T14:36:56.198433Z",
"structure_string": "Cd1 H14 C9 O4\n1.0\n4.065714 0.112645 0.006373\n1.661212 4.600241 0.421554\n-0.196405 -0.084424 11.801700\nCd H C O\n1 14 9 4\ndirect\n0.081011 0.991636 0.166704 Cd\n0.152708 0.674753 0.628172 H\n0.584718 0.420846 0.754432 H\n0.899389 0.555706 0.802519 H\n0.625172 0.004419 0.660717 H\n0.181719 0.230868 0.672875 H\n0.014757 -0.002148 0.535911 H\n0.763248 0.533944 0.547470 H\n0.885331 0.171147 0.940510 H\n0.913491 0.594420 0.019503 H\n0.099707 0.871349 0.818425 H\n0.426147 0.005107 0.861060 H\n0.354953 0.336684 0.458788 H\n0.122187 0.682690 0.382386 H\n0.601651 0.859820 0.454870 H\n0.431675 0.398952 0.017416 C\n0.662108 0.381327 0.933594 C\n0.634358 0.553095 0.820175 C\n0.366304 0.866714 0.800479 C\n0.522993 0.692594 0.502020 C\n0.244636 0.840608 0.586259 C\n0.383823 0.533352 0.416423 C\n0.626080 0.445962 0.318484 C\n0.362233 -0.000626 0.678208 C\n0.127230 0.651850 0.023320 O\n0.598362 0.633332 0.234091 O\n0.860035 0.187132 0.326032 O\n0.480486 0.189615 0.100409 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Cd",
"H",
"C",
"O"
],
"chemical_system": "C-Cd-H-O",
"density": 2.2677161270158765,
"density_atomic": 0.12805143846224118,
"volume": 218.66212778434678,
"volume_molar": 4.702907544280155,
"formula_full": "Cd1 H14 C9 O4",
"formula_reduced": "CdH14C9O4",
"formula_anonymous": "AB4C9D14",
"energy_above_hull": 4.481590133928571,
"spacegroup": 1
},
{
"id": "jvasp-113961",
"created_at": "2022-09-04T14:38:49.093021Z",
"updated_at": "2022-09-04T14:38:49.093042Z",
"structure_string": "Li2 B1 N2\n1.0\n2.667953 -0.000000 -0.000000\n-1.333977 2.310515 -0.000000\n-0.000000 0.000000 6.262985\nLi B N\n2 1 2\ndirect\n0.666666 0.333334 0.322236 Li\n0.333332 0.666667 0.677764 Li\n0.000000 0.000000 0.000000 B\n0.666666 0.333334 0.850485 N\n0.333332 0.666667 0.149516 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Li",
"B",
"N"
],
"chemical_system": "B-Li-N",
"density": 2.2669613337084655,
"density_atomic": 0.1295095116891643,
"volume": 38.6072029365727,
"volume_molar": 4.649960208678523,
"formula_full": "Li2 B1 N2",
"formula_reduced": "Li2BN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.4675478166666664,
"spacegroup": 164
},
{
"id": "jvasp-95175",
"created_at": "2022-09-04T14:35:56.552594Z",
"updated_at": "2022-09-04T14:35:56.552615Z",
"structure_string": "K4 N4 O4 F8\n1.0\n6.302075 0.000000 0.000000\n0.000000 6.890843 0.000000\n0.000000 0.000000 7.227023\nK N O F\n4 4 4 8\ndirect\n0.750001 0.885230 0.617170 K\n0.750001 0.385230 0.882829 K\n0.250000 0.614770 0.117171 K\n0.250000 0.114770 0.382829 K\n0.250000 0.019857 0.795351 N\n0.750001 0.980143 0.204648 N\n0.250000 0.519857 0.704648 N\n0.750001 0.480143 0.295352 N\n0.250000 0.050671 0.949431 O\n0.750001 0.949329 0.050569 O\n0.750001 0.449329 0.449431 O\n0.250000 0.550671 0.550568 O\n0.481253 0.672085 0.812030 F\n0.981254 0.327914 0.187970 F\n0.018747 0.672085 0.812030 F\n0.981254 0.827914 0.312030 F\n0.481253 0.172086 0.687970 F\n0.518747 0.827914 0.312030 F\n0.018747 0.172086 0.687970 F\n0.518747 0.327914 0.187970 F\n",
"nsites": 20,
"nelements": 4,
"elements": [
"K",
"N",
"O",
"F"
],
"chemical_system": "F-K-N-O",
"density": 2.266668933276088,
"density_atomic": 0.06372570317389473,
"volume": 313.84510494021526,
"volume_molar": 9.45009699393474,
"formula_full": "K4 N4 O4 F8",
"formula_reduced": "KNOF2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 1.057411063,
"spacegroup": 62
},
{
"id": "jvasp-29885",
"created_at": "2022-09-04T14:37:30.219651Z",
"updated_at": "2022-09-04T14:37:30.219675Z",
"structure_string": "C2\n1.0\n1.811323 2.542151 9.260628\n-0.679582 1.535866 3.225388\n-1.425584 -2.318537 -4.241080\nC\n2\ndirect\n0.833397 0.333026 0.000001 C\n0.166602 0.666976 -0.000002 C\n",
"nsites": 2,
"nelements": 1,
"elements": [
"C"
],
"chemical_system": "C",
"density": 2.266563767524333,
"density_atomic": 0.11364505028236863,
"volume": 17.598654715103667,
"volume_molar": 5.299078794049598,
"formula_full": "C2",
"formula_reduced": "C",
"formula_anonymous": "A",
"energy_above_hull": 0.0014500000000001,
"spacegroup": 166
},
{
"id": "jvasp-123554",
"created_at": "2022-09-04T14:38:51.813148Z",
"updated_at": "2022-09-04T14:38:51.813185Z",
"structure_string": "B1 P3\n1.0\n3.090879 -0.000000 -0.989738\n-0.023917 4.709834 -0.074692\n-0.028787 -0.054626 5.231262\nB P\n1 3\ndirect\n0.440320 0.836319 0.880645 B\n0.581480 0.106883 0.162959 P\n0.092734 0.420317 0.185468 P\n0.885462 0.636477 0.770927 P\n",
"nsites": 4,
"nelements": 2,
"elements": [
"B",
"P"
],
"chemical_system": "B-P",
"density": 2.2662841020607125,
"density_atomic": 0.052627325187748125,
"volume": 76.00614292537173,
"volume_molar": 11.442992283031668,
"formula_full": "B1 P3",
"formula_reduced": "BP3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.394822270833334,
"spacegroup": 8
},
{
"id": "jvasp-38255",
"created_at": "2022-09-04T14:37:54.183203Z",
"updated_at": "2022-09-04T14:37:54.183213Z",
"structure_string": "Rb3 Cr1\n1.0\n6.091299 0.000000 -0.000000\n0.000000 6.091299 -0.000000\n0.000000 0.000000 6.091299\nRb Cr\n3 1\ndirect\n0.000000 0.500000 0.500000 Rb\n0.500000 0.000000 0.500000 Rb\n0.500000 0.500000 0.000000 Rb\n0.000000 0.000000 0.000000 Cr\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"Cr"
],
"chemical_system": "Cr-Rb",
"density": 2.2658596663690638,
"density_atomic": 0.017698246408306986,
"volume": 226.0110921567082,
"volume_molar": 34.02676525722572,
"formula_full": "Rb3 Cr1",
"formula_reduced": "Rb3Cr",
"formula_anonymous": "AB3",
"energy_above_hull": 0.66455185,
"spacegroup": 221
},
{
"id": "jvasp-24017",
"created_at": "2022-09-04T14:37:39.436571Z",
"updated_at": "2022-09-04T14:37:39.436595Z",
"structure_string": "Li1 H1 F2\n1.0\n2.836610 0.014664 3.796699\n1.272200 2.535366 3.796699\n0.023629 0.014664 4.739274\nLi H F\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.499999 0.500000 H\n0.413374 0.413373 0.413374 F\n0.586627 0.586625 0.586627 F\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"H",
"F"
],
"chemical_system": "F-H-Li",
"density": 2.265116001745004,
"density_atomic": 0.11875612846677625,
"volume": 33.68247223653016,
"volume_molar": 5.071014723829416,
"formula_full": "Li1 H1 F2",
"formula_reduced": "LiHF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1389951412499999,
"spacegroup": 166
},
{
"id": "jvasp-88220",
"created_at": "2022-09-04T14:36:08.101257Z",
"updated_at": "2022-09-04T14:36:08.101282Z",
"structure_string": "S18\n1.0\n11.645385 -0.000014 -0.000000\n-5.822680 10.085206 0.000000\n-0.000000 -0.000000 3.603200\nS\n18\ndirect\n0.222090 0.656059 0.761317 S\n0.764226 0.608867 0.141963 S\n0.681053 0.806857 0.577464 S\n0.867279 0.393153 -0.178526 S\n0.439959 0.362398 0.139652 S\n0.525873 0.132721 -0.178526 S\n0.193144 0.874197 0.577464 S\n0.922440 0.560042 0.139652 S\n0.606848 0.474128 -0.178526 S\n0.433970 0.777911 0.761317 S\n0.637603 0.077561 0.139652 S\n0.343942 0.566031 0.761317 S\n0.125804 0.318948 0.577464 S\n0.834992 0.980573 0.572132 S\n0.019428 0.854419 0.572132 S\n0.145582 0.165009 0.572132 S\n0.391133 0.155357 0.141963 S\n0.844643 0.235775 0.141963 S\n",
"nsites": 18,
"nelements": 1,
"elements": [
"S"
],
"chemical_system": "S",
"density": 2.26478069730041,
"density_atomic": 0.0425349388878444,
"volume": 423.1815178449457,
"volume_molar": 14.15810370829286,
"formula_full": "S18",
"formula_reduced": "S",
"formula_anonymous": "A",
"energy_above_hull": 0.2616300000000002,
"spacegroup": 143
},
{
"id": "jvasp-48",
"created_at": "2022-09-04T14:38:05.522137Z",
"updated_at": "2022-09-04T14:38:05.522165Z",
"structure_string": "C4\n1.0\n1.232501 -2.134753 0.000000\n1.232501 2.134753 0.000000\n0.000000 0.000000 6.696269\nC\n4\ndirect\n0.000000 0.000000 0.250000 C\n0.000000 0.000000 0.750000 C\n0.333333 0.666667 0.250000 C\n0.666667 0.333333 0.750000 C\n",
"nsites": 4,
"nelements": 1,
"elements": [
"C"
],
"chemical_system": "C",
"density": 2.264016606297527,
"density_atomic": 0.11351733613205647,
"volume": 35.23690861937368,
"volume_molar": 5.305040591328138,
"formula_full": "C4",
"formula_reduced": "C",
"formula_anonymous": "A",
"energy_above_hull": 0.0007099999999997,
"spacegroup": 194
},
{
"id": "jvasp-25104",
"created_at": "2022-09-04T14:37:43.168780Z",
"updated_at": "2022-09-04T14:37:43.168790Z",
"structure_string": "Cl4\n1.0\n0.000000 -4.091472 0.000000\n-3.142966 2.045735 -0.000000\n0.000000 -0.000000 -8.088829\nCl\n4\ndirect\n0.872214 0.000000 0.392111 Cl\n0.127786 0.000000 0.607889 Cl\n0.627785 0.000000 0.892111 Cl\n0.372214 0.000000 0.107889 Cl\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Cl"
],
"chemical_system": "Cl",
"density": 2.263899578913901,
"density_atomic": 0.03845519965993201,
"volume": 104.01714294485274,
"volume_molar": 15.660146906673601,
"formula_full": "Cl4",
"formula_reduced": "Cl",
"formula_anonymous": "A",
"energy_above_hull": 4.067500000010105e-06,
"spacegroup": 64
},
{
"id": "jvasp-25183",
"created_at": "2022-09-04T14:38:33.166798Z",
"updated_at": "2022-09-04T14:38:33.166808Z",
"structure_string": "C4\n1.0\n2.465029 0.000000 0.000000\n-1.232515 2.134778 0.000000\n-0.000000 0.000000 6.696663\nC\n4\ndirect\n0.000000 0.000000 0.250000 C\n0.000000 0.000000 0.750000 C\n0.333332 0.666668 0.250000 C\n0.666667 0.333333 0.750000 C\n",
"nsites": 4,
"nelements": 1,
"elements": [
"C"
],
"chemical_system": "C",
"density": 2.2638320938128964,
"density_atomic": 0.1135080847132815,
"volume": 35.23978058570803,
"volume_molar": 5.305472975966226,
"formula_full": "C4",
"formula_reduced": "C",
"formula_anonymous": "A",
"energy_above_hull": 0.0007199999999993,
"spacegroup": 194
},
{
"id": "jvasp-14740",
"created_at": "2022-09-04T14:35:45.193730Z",
"updated_at": "2022-09-04T14:35:45.193757Z",
"structure_string": "C4\n1.0\n1.232515 -2.134779 -0.000000\n1.232515 2.134779 0.000000\n0.000000 0.000000 6.696678\nC\n4\ndirect\n0.000000 0.000000 0.250000 C\n0.000000 0.000000 0.750000 C\n0.333335 0.666669 0.250000 C\n0.666669 0.333335 0.750000 C\n",
"nsites": 4,
"nelements": 1,
"elements": [
"C"
],
"chemical_system": "C",
"density": 2.2638250441909493,
"density_atomic": 0.11350773124665851,
"volume": 35.23989032348626,
"volume_molar": 5.3054894973749045,
"formula_full": "C4",
"formula_reduced": "C",
"formula_anonymous": "A",
"energy_above_hull": 0.0007099999999997,
"spacegroup": 194
}
]
}