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=volume_molar&page=924",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume_molar&page=922",
"results": [
{
"id": "jvasp-36171",
"created_at": "2022-09-04T14:37:30.652536Z",
"updated_at": "2022-09-04T14:37:30.652557Z",
"structure_string": "Cr1 Co2 As1\n1.0\n2.891584 2.891584 0.000000\n2.891584 -0.000000 -2.891584\n0.000000 2.891584 -2.891584\nCr Co As\n1 2 1\ndirect\n0.749999 0.749999 0.749999 Cr\n0.000000 0.000000 0.000000 Co\n0.499999 0.499999 0.499999 Co\n0.250000 0.250000 0.250000 As\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cr",
"Co",
"As"
],
"chemical_system": "As-Co-Cr",
"density": 8.406105761101202,
"density_atomic": 0.08272229155790724,
"volume": 48.35455987337973,
"volume_molar": 7.279949148633514,
"formula_full": "Cr1 Co2 As1",
"formula_reduced": "CrCo2As",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.4347752375,
"spacegroup": 225
},
{
"id": "jvasp-96513",
"created_at": "2022-09-04T14:35:58.177912Z",
"updated_at": "2022-09-04T14:35:58.177925Z",
"structure_string": "Cd6 B4 O12\n1.0\n4.826968 0.000000 0.000000\n0.000000 6.046836 0.000000\n0.000000 0.000000 9.111821\nCd B O\n6 4 12\ndirect\n0.000000 0.000000 0.000000 Cd\n0.500000 0.000000 0.689206 Cd\n0.000000 0.500000 0.810794 Cd\n0.500000 0.000000 0.310794 Cd\n0.000000 0.500000 0.189206 Cd\n0.500000 0.500000 0.500000 Cd\n0.033528 0.239860 0.500000 B\n0.533528 0.260140 0.000000 B\n0.966473 0.760141 0.500000 B\n0.466472 0.739860 0.000000 B\n0.678149 0.217904 0.130339 O\n0.821852 0.717904 0.369661 O\n0.178149 0.282096 0.369661 O\n0.821852 0.717904 0.630339 O\n0.242094 0.821320 0.500000 O\n0.757907 0.178680 0.500000 O\n0.257906 0.321320 0.000000 O\n0.678149 0.217904 0.869660 O\n0.178149 0.282096 0.630339 O\n0.321851 0.782097 0.869660 O\n0.321851 0.782097 0.130339 O\n0.742094 0.678681 0.000000 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Cd",
"B",
"O"
],
"chemical_system": "B-Cd-O",
"density": 5.679901962637372,
"density_atomic": 0.08272083156654106,
"volume": 265.95477322182245,
"volume_molar": 7.280077636980425,
"formula_full": "Cd6 B4 O12",
"formula_reduced": "Cd3(BO3)2",
"formula_anonymous": "A2B3C6",
"energy_above_hull": 1.7802550378787876,
"spacegroup": 58
},
{
"id": "jvasp-47301",
"created_at": "2022-09-04T14:38:07.266379Z",
"updated_at": "2022-09-04T14:38:07.266401Z",
"structure_string": "Li2 V2 F12\n1.0\n4.750979 0.000000 0.000000\n-0.000000 4.750979 0.000000\n0.000000 0.000000 8.569181\nLi V F\n2 2 12\ndirect\n0.000000 0.000000 0.350587 Li\n0.500000 0.500000 0.850587 Li\n0.000000 0.000000 0.995435 V\n0.500000 0.500000 0.495435 V\n0.180777 0.819224 0.151760 F\n0.198003 0.801997 0.853299 F\n0.230798 0.769202 0.489494 F\n0.269202 0.269202 0.989494 F\n0.301997 0.301997 0.353299 F\n0.319224 0.319224 0.651760 F\n0.698003 0.698003 0.353299 F\n0.680777 0.680777 0.651760 F\n0.730798 0.730798 0.989494 F\n0.769202 0.230798 0.489494 F\n0.819224 0.180777 0.151760 F\n0.801997 0.198003 0.853299 F\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Li",
"V",
"F"
],
"chemical_system": "F-Li-V",
"density": 2.951080176160752,
"density_atomic": 0.08272074648524248,
"volume": 193.42185219344492,
"volume_molar": 7.28008512480525,
"formula_full": "Li2 V2 F12",
"formula_reduced": "LiVF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.2423594868749999,
"spacegroup": 102
},
{
"id": "jvasp-272",
"created_at": "2022-09-04T14:37:45.782200Z",
"updated_at": "2022-09-04T14:37:45.782222Z",
"structure_string": "Pt2 O4\n1.0\n1.580324 -2.737202 0.000000\n1.580324 2.737202 0.000000\n-0.000000 0.000000 8.384086\nPt O\n2 4\ndirect\n0.666666 0.333332 0.499936 Pt\n0.333332 0.666666 0.999936 Pt\n0.000000 0.000000 0.111880 O\n0.000000 0.000000 0.611880 O\n0.333332 0.666666 0.388186 O\n0.666666 0.333332 0.888186 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Pt",
"O"
],
"chemical_system": "O-Pt",
"density": 10.397397058802243,
"density_atomic": 0.08272038478566676,
"volume": 72.53351172805037,
"volume_molar": 7.280116957390503,
"formula_full": "Pt2 O4",
"formula_reduced": "PtO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.008696133333334,
"spacegroup": 186
},
{
"id": "jvasp-11407",
"created_at": "2022-09-04T14:38:16.166397Z",
"updated_at": "2022-09-04T14:38:16.166418Z",
"structure_string": "Ta2 P2 O10\n1.0\n6.496344 -0.000000 -0.000000\n0.000000 6.496344 0.000000\n0.000000 -0.000000 4.010383\nTa P O\n2 2 10\ndirect\n-0.000000 0.500000 0.233576 Ta\n0.500000 0.000000 0.766424 Ta\n0.500000 0.500000 0.500000 P\n0.000000 0.000000 0.500000 P\n0.694102 0.501449 0.280991 O\n0.001449 0.805897 0.280991 O\n0.500000 0.000000 0.224641 O\n-0.000000 0.500000 0.775358 O\n0.998551 0.194102 0.280991 O\n0.305898 0.498551 0.280991 O\n0.194102 0.001449 0.719008 O\n0.501449 0.305898 0.719008 O\n0.498551 0.694102 0.719008 O\n0.805897 0.998551 0.719008 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ta",
"P",
"O"
],
"chemical_system": "O-P-Ta",
"density": 5.728185117077112,
"density_atomic": 0.08271878697081483,
"volume": 169.24812987090266,
"volume_molar": 7.280257581780975,
"formula_full": "Ta2 P2 O10",
"formula_reduced": "TaPO5",
"formula_anonymous": "ABC5",
"energy_above_hull": 3.157167457142857,
"spacegroup": 129
},
{
"id": "jvasp-62904",
"created_at": "2022-09-04T14:35:57.699039Z",
"updated_at": "2022-09-04T14:35:57.699055Z",
"structure_string": "Cd6 B4 O12\n1.0\n4.827212 -0.000000 0.000000\n-0.000000 6.046765 0.000000\n0.000000 0.000000 9.111875\nCd B O\n6 4 12\ndirect\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.500000 Cd\n0.500000 0.000000 0.689208 Cd\n0.000000 0.500000 0.810791 Cd\n0.500000 0.000000 0.310791 Cd\n0.000000 0.500000 0.189208 Cd\n0.466491 0.739877 0.000000 B\n0.533508 0.260124 0.000000 B\n0.966491 0.760125 0.500000 B\n0.033509 0.239876 0.500000 B\n0.678127 0.217905 0.130337 O\n0.321872 0.782096 0.130337 O\n0.821872 0.717905 0.630337 O\n0.178127 0.282095 0.630337 O\n0.321872 0.782096 0.869663 O\n0.257886 0.321281 0.000000 O\n0.242114 0.821282 0.500000 O\n0.757886 0.178719 0.500000 O\n0.742114 0.678720 0.000000 O\n0.821872 0.717905 0.369663 O\n0.678127 0.217905 0.869663 O\n0.178127 0.282095 0.369663 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Cd",
"B",
"O"
],
"chemical_system": "B-Cd-O",
"density": 5.679647891219463,
"density_atomic": 0.08271713132680016,
"volume": 265.966670351297,
"volume_molar": 7.28040330147286,
"formula_full": "Cd6 B4 O12",
"formula_reduced": "Cd3(BO3)2",
"formula_anonymous": "A2B3C6",
"energy_above_hull": 1.7802504924242422,
"spacegroup": 58
},
{
"id": "jvasp-102435",
"created_at": "2022-09-04T14:37:01.185106Z",
"updated_at": "2022-09-04T14:37:01.185132Z",
"structure_string": "Li1 Ho1 O2\n1.0\n3.166532 -0.006435 4.325350\n1.409404 2.835585 4.325350\n-0.010407 -0.006435 5.360547\nLi Ho O\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.499998 0.500002 0.500000 Ho\n0.245988 0.245990 0.245989 O\n0.754007 0.754014 0.754011 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Ho",
"O"
],
"chemical_system": "Ho-Li-O",
"density": 7.000635949415715,
"density_atomic": 0.08271700651663295,
"volume": 48.3576493933647,
"volume_molar": 7.280414286739272,
"formula_full": "Li1 Ho1 O2",
"formula_reduced": "LiHoO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9448956416666664,
"spacegroup": 166
},
{
"id": "jvasp-74312",
"created_at": "2022-09-04T14:36:18.136459Z",
"updated_at": "2022-09-04T14:36:18.136483Z",
"structure_string": "Hf1 Be2 Ni1\n1.0\n2.822335 0.000000 0.000000\n0.000000 2.822335 0.000000\n0.000000 -0.000000 6.070888\nHf Be Ni\n1 2 1\ndirect\n0.000000 0.000000 0.502225 Hf\n0.000000 0.000000 0.002267 Be\n0.499999 0.499999 0.186575 Be\n0.499999 0.499999 0.808933 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Be",
"Ni"
],
"chemical_system": "Be-Hf-Ni",
"density": 8.763420196299569,
"density_atomic": 0.08271621388349391,
"volume": 48.358112783474525,
"volume_molar": 7.280484051750975,
"formula_full": "Hf1 Be2 Ni1",
"formula_reduced": "HfBe2Ni",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.5125469,
"spacegroup": 99
},
{
"id": "jvasp-123755",
"created_at": "2022-09-04T14:38:55.158475Z",
"updated_at": "2022-09-04T14:38:55.158500Z",
"structure_string": "Hf1 O1\n1.0\n1.494996 -2.589410 0.000000\n1.494996 2.589410 0.000000\n-0.000000 0.000000 3.123136\nHf O\n1 1\ndirect\n0.333335 0.666668 0.750001 Hf\n0.666668 0.333335 0.250000 O\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Hf",
"O"
],
"chemical_system": "Hf-O",
"density": 13.35621158441729,
"density_atomic": 0.08271194852727136,
"volume": 24.180303276745683,
"volume_molar": 7.280859497602586,
"formula_full": "Hf1 O1",
"formula_reduced": "HfO",
"formula_anonymous": "AB",
"energy_above_hull": null,
"spacegroup": 187
},
{
"id": "jvasp-7740",
"created_at": "2022-09-04T14:37:06.162105Z",
"updated_at": "2022-09-04T14:37:06.162141Z",
"structure_string": "Cr3 Si6\n1.0\n2.217227 -3.840349 0.000000\n2.217227 3.840349 0.000000\n-0.000000 -0.000000 6.389550\nCr Si\n3 6\ndirect\n0.500000 0.000000 0.500000 Cr\n0.500001 0.500001 0.833333 Cr\n0.000000 0.500000 0.166667 Cr\n0.332816 0.166409 0.166667 Si\n0.166409 0.833592 0.833333 Si\n0.166409 0.332816 0.500000 Si\n0.667185 0.833593 0.166667 Si\n0.833592 0.166409 0.833333 Si\n0.833593 0.667185 0.500000 Si\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Cr",
"Si"
],
"chemical_system": "Cr-Si",
"density": 4.952043120488199,
"density_atomic": 0.08271064140059793,
"volume": 108.81308435766691,
"volume_molar": 7.280974561462492,
"formula_full": "Cr3 Si6",
"formula_reduced": "CrSi2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.2042915333333326,
"spacegroup": 180
},
{
"id": "jvasp-7697",
"created_at": "2022-09-04T14:37:06.276442Z",
"updated_at": "2022-09-04T14:37:06.276466Z",
"structure_string": "Cr3 Si6\n1.0\n2.217226 -3.840350 -0.000000\n2.217226 3.840350 0.000000\n-0.000000 -0.000000 6.389554\nCr Si\n3 6\ndirect\n0.000000 0.500000 0.833333 Cr\n0.500000 0.000000 0.500000 Cr\n0.500001 0.500001 0.166667 Cr\n0.833593 0.166409 0.166667 Si\n0.166408 0.332816 0.500000 Si\n0.667185 0.833593 0.833333 Si\n0.166409 0.833593 0.166667 Si\n0.833593 0.667185 0.500000 Si\n0.332816 0.166408 0.833333 Si\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Cr",
"Si"
],
"chemical_system": "Cr-Si",
"density": 4.952040964363969,
"density_atomic": 0.0827106053883069,
"volume": 108.81313173500678,
"volume_molar": 7.2809777316070425,
"formula_full": "Cr3 Si6",
"formula_reduced": "CrSi2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.2042915333333326,
"spacegroup": 181
},
{
"id": "jvasp-42908",
"created_at": "2022-09-04T14:38:09.701272Z",
"updated_at": "2022-09-04T14:38:09.701297Z",
"structure_string": "Li2 Mn2 P2 O8\n1.0\n4.989563 0.000000 -0.000000\n-2.494781 1.440362 7.850820\n2.494781 -4.321088 -0.000000\nLi Mn P O\n2 2 2 8\ndirect\n0.141710 0.425130 0.141710 Li\n0.433798 0.301397 0.433799 Li\n0.012989 0.038966 0.012989 Mn\n0.562516 0.687547 0.562517 Mn\n0.864430 0.593290 0.864431 P\n0.711072 0.133220 0.711073 P\n0.149437 0.531427 0.557581 O\n0.017923 0.195084 0.751094 O\n0.426066 0.195084 0.017924 O\n0.645623 0.936870 0.645625 O\n0.824407 0.531427 0.149437 O\n0.557580 0.531427 0.824408 O\n0.751093 0.195084 0.426066 O\n0.929879 0.789639 0.929881 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Mn",
"P",
"O"
],
"chemical_system": "Li-Mn-O-P",
"density": 3.07747193765531,
"density_atomic": 0.08270988063129714,
"volume": 169.2663547951301,
"volume_molar": 7.281041532202675,
"formula_full": "Li2 Mn2 P2 O8",
"formula_reduced": "LiMnPO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.553359534482759,
"spacegroup": 148
}
]
}