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=-nelements&page=847",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=845",
"results": [
{
"id": "jvasp-118425",
"created_at": "2022-09-04T14:38:33.580445Z",
"updated_at": "2022-09-04T14:38:33.580481Z",
"structure_string": "H1 Pb1 I1\n1.0\n5.380114 -0.000000 0.000000\n-2.690057 4.659316 -0.000000\n0.000000 0.000000 3.725713\nH Pb I\n1 1 1\ndirect\n0.000000 0.000000 0.000000 H\n0.666665 0.333334 0.000000 Pb\n0.333332 0.666667 0.000000 I\n",
"nsites": 3,
"nelements": 3,
"elements": [
"H",
"Pb",
"I"
],
"chemical_system": "H-I-Pb",
"density": 5.958220446240988,
"density_atomic": 0.03212167721759964,
"volume": 93.39487411187494,
"volume_molar": 18.74790260547303,
"formula_full": "H1 Pb1 I1",
"formula_reduced": "HPbI",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9212123650000004,
"spacegroup": 187
},
{
"id": "jvasp-11237",
"created_at": "2022-09-04T14:38:33.582592Z",
"updated_at": "2022-09-04T14:38:33.582621Z",
"structure_string": "Al2 Co2 O6\n1.0\n1.539291 -2.666131 -0.000000\n1.539291 2.666131 -0.000000\n0.000000 0.000000 11.510431\nAl Co O\n2 2 6\ndirect\n0.000000 0.000000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.666666 0.333333 0.750000 Co\n0.333333 0.666666 0.250000 Co\n0.333333 0.666666 0.420977 O\n0.666666 0.333333 0.920977 O\n0.666666 0.333333 0.579023 O\n0.333333 0.666666 0.079023 O\n0.000000 0.000000 0.250000 O\n0.000000 0.000000 0.750000 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Al",
"Co",
"O"
],
"chemical_system": "Al-Co-O",
"density": 4.7073644267443555,
"density_atomic": 0.10584642735460104,
"volume": 94.476500056998,
"volume_molar": 5.6895078185539,
"formula_full": "Al2 Co2 O6",
"formula_reduced": "AlCoO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.1893828400000004,
"spacegroup": 194
},
{
"id": "jvasp-52114",
"created_at": "2022-09-04T14:38:33.593771Z",
"updated_at": "2022-09-04T14:38:33.593805Z",
"structure_string": "Co1 P2 O7\n1.0\n4.388114 -0.055213 -0.068027\n-0.676903 4.938736 0.020720\n-0.676793 -0.989106 4.838734\nCo P O\n1 2 7\ndirect\n0.723597 0.444820 0.947286 Co\n0.132104 0.004637 0.797254 P\n0.315091 0.594855 0.387469 P\n0.543206 0.675271 0.196003 O\n0.005711 0.395088 0.243885 O\n0.223596 0.886743 0.505362 O\n0.441484 0.148222 0.997019 O\n0.996165 0.766877 0.919943 O\n0.903989 0.196105 0.716837 O\n0.451032 0.472164 0.625229 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Co",
"P",
"O"
],
"chemical_system": "Co-O-P",
"density": 3.7004588171628323,
"density_atomic": 0.09569313375574284,
"volume": 104.50070561514941,
"volume_molar": 6.293179587337522,
"formula_full": "Co1 P2 O7",
"formula_reduced": "CoP2O7",
"formula_anonymous": "AB2C7",
"energy_above_hull": 2.9551386399999995,
"spacegroup": 5
},
{
"id": "jvasp-20925",
"created_at": "2022-09-04T14:38:33.594142Z",
"updated_at": "2022-09-04T14:38:33.594160Z",
"structure_string": "Ta8 Al2 C6\n1.0\n1.572538 -2.723715 -0.000000\n1.572538 2.723715 0.000000\n-0.000000 0.000000 24.260891\nTa Al C\n8 2 6\ndirect\n0.000000 0.000000 0.657626 Ta\n0.000000 0.000000 0.157626 Ta\n0.000000 0.000000 0.342374 Ta\n0.000000 0.000000 0.842374 Ta\n0.333333 0.666668 0.555244 Ta\n0.666668 0.333333 0.055244 Ta\n0.666668 0.333333 0.444756 Ta\n0.333333 0.666668 0.944756 Ta\n0.666668 0.333333 0.250000 Al\n0.333333 0.666668 0.750000 Al\n0.666668 0.333333 0.608154 C\n0.333333 0.666668 0.108154 C\n0.333333 0.666668 0.391846 C\n0.000000 0.000000 0.000000 C\n0.666668 0.333333 0.891846 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ta",
"Al",
"C"
],
"chemical_system": "Al-C-Ta",
"density": 12.573226467063229,
"density_atomic": 0.07698753755291274,
"volume": 207.8258443972619,
"volume_molar": 7.822228053288553,
"formula_full": "Ta8 Al2 C6",
"formula_reduced": "Ta4AlC3",
"formula_anonymous": "AB3C4",
"energy_above_hull": 6.71574495,
"spacegroup": 194
},
{
"id": "jvasp-25966",
"created_at": "2022-09-04T14:38:33.606003Z",
"updated_at": "2022-09-04T14:38:33.606027Z",
"structure_string": "Sr2 Ta8 O22\n1.0\n3.151655 -5.458826 -0.000000\n3.151655 5.458826 0.000000\n-0.000000 0.000000 12.456677\nSr Ta O\n2 8 22\ndirect\n0.666668 0.333334 0.250000 Sr\n0.333334 0.666668 0.750000 Sr\n0.357358 0.000000 0.000000 Ta\n0.642644 0.642644 0.000000 Ta\n0.357358 0.357358 0.500000 Ta\n0.000000 0.642643 0.500000 Ta\n0.000000 0.357358 0.000000 Ta\n0.666668 0.333334 0.750000 Ta\n0.333334 0.666668 0.250000 Ta\n0.642643 0.000000 0.500000 Ta\n0.629745 0.567530 0.845498 O\n0.370257 0.937786 0.154502 O\n0.629745 0.062216 0.654502 O\n0.432472 0.062216 0.845498 O\n0.937786 0.567530 0.654502 O\n0.432472 0.370256 0.654502 O\n0.370256 0.432472 0.345498 O\n0.062216 0.629745 0.345498 O\n0.937786 0.370257 0.845498 O\n0.567530 0.937786 0.345498 O\n0.245934 0.000000 0.500000 O\n0.754067 0.000000 0.000000 O\n0.245934 0.245934 0.000000 O\n0.754067 0.754067 0.500000 O\n0.567530 0.629745 0.154502 O\n0.000000 0.754067 0.000000 O\n0.333334 0.666668 0.965624 O\n0.666668 0.333334 0.465624 O\n0.666668 0.333334 0.034376 O\n0.333334 0.666668 0.534376 O\n0.000000 0.245934 0.500000 O\n0.062216 0.432472 0.154502 O\n",
"nsites": 32,
"nelements": 3,
"elements": [
"Sr",
"Ta",
"O"
],
"chemical_system": "O-Sr-Ta",
"density": 7.650754364990621,
"density_atomic": 0.0746586026281175,
"volume": 428.61771950642344,
"volume_molar": 8.066238247180875,
"formula_full": "Sr2 Ta8 O22",
"formula_reduced": "SrTa4O11",
"formula_anonymous": "AB4C11",
"energy_above_hull": 3.921091975625,
"spacegroup": 182
},
{
"id": "jvasp-59592",
"created_at": "2022-09-04T14:38:33.606800Z",
"updated_at": "2022-09-04T14:38:33.606823Z",
"structure_string": "Cr4 Ni2 O8\n1.0\n5.090526 0.000000 2.939016\n1.696842 4.799394 2.939016\n0.000000 0.000000 5.878033\nCr Ni O\n4 2 8\ndirect\n0.500000 0.000000 0.000000 Cr\n0.000000 0.000000 0.000000 Cr\n1.000000 0.500001 0.000001 Cr\n0.000000 0.000000 0.500000 Cr\n0.625001 0.624998 0.625002 Ni\n0.375000 0.375001 0.375000 Ni\n0.761920 0.761918 0.761920 O\n0.238079 0.238081 0.785760 O\n0.238080 0.785758 0.238082 O\n0.785759 0.238081 0.238081 O\n0.761920 0.214241 0.761920 O\n0.214241 0.761918 0.761921 O\n0.238079 0.238081 0.238080 O\n0.761920 0.761918 0.214243 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Cr",
"Ni",
"O"
],
"chemical_system": "Cr-Ni-O",
"density": 5.242245357869466,
"density_atomic": 0.0974870551417987,
"volume": 143.6088102121503,
"volume_molar": 6.177374781954962,
"formula_full": "Cr4 Ni2 O8",
"formula_reduced": "Cr2NiO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 3.049320171428572,
"spacegroup": 227
},
{
"id": "jvasp-116781",
"created_at": "2022-09-04T14:38:33.609677Z",
"updated_at": "2022-09-04T14:38:33.609704Z",
"structure_string": "Ca4 Cr4 O12\n1.0\n5.277239 0.000020 -0.000012\n-0.000021 5.352970 -0.000028\n0.000007 0.000037 7.483744\nCa Cr O\n4 4 12\ndirect\n0.991643 0.042138 0.249999 Ca\n0.491640 0.457861 0.750000 Ca\n0.508357 0.542143 0.249999 Ca\n0.008361 0.957857 0.750000 Ca\n0.500005 -0.000001 -0.000000 Cr\n-0.000004 0.500001 -0.000001 Cr\n0.000003 0.500004 0.500002 Cr\n0.499997 -0.000005 0.500001 Cr\n0.208867 0.209790 0.962074 O\n0.708866 0.290212 0.037926 O\n0.291135 0.709789 0.962074 O\n0.791136 0.790212 0.037926 O\n0.208865 0.209790 0.537925 O\n0.427386 0.985954 0.249999 O\n0.072615 0.485953 0.249999 O\n0.572617 0.014049 0.749999 O\n0.291134 0.709789 0.537925 O\n0.927384 0.514046 0.750000 O\n0.708865 0.290212 0.462074 O\n0.791134 0.790212 0.462074 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Ca",
"Cr",
"O"
],
"chemical_system": "Ca-Cr-O",
"density": 4.4008934391240215,
"density_atomic": 0.09460400011038639,
"volume": 211.407551231063,
"volume_molar": 6.365630156201863,
"formula_full": "Ca4 Cr4 O12",
"formula_reduced": "CaCrO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.9337856639999995,
"spacegroup": 62
},
{
"id": "jvasp-53524",
"created_at": "2022-09-04T14:38:33.610836Z",
"updated_at": "2022-09-04T14:38:33.610860Z",
"structure_string": "Cd2 In4 O8\n1.0\n5.718877 -0.017216 3.220858\n1.890061 5.397547 3.220858\n-0.000000 -0.000000 6.441715\nCd In O\n2 4 8\ndirect\n0.625000 0.625000 0.125000 Cd\n0.625000 0.625000 0.625001 Cd\n0.009399 0.009399 0.990602 In\n0.240601 0.240601 0.259399 In\n0.125000 0.625000 0.625001 In\n0.625000 0.125000 0.625001 In\n0.373243 0.373243 0.394448 O\n0.373243 0.373243 0.859067 O\n0.362777 0.853887 0.391669 O\n0.853887 0.362777 0.391669 O\n0.396113 0.887223 0.858333 O\n0.887223 0.396113 0.858333 O\n0.876757 0.876757 0.390934 O\n0.876757 0.876757 0.855553 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Cd",
"In",
"O"
],
"chemical_system": "Cd-In-O",
"density": 6.774645402492447,
"density_atomic": 0.07033342583276977,
"volume": 199.0518709167884,
"volume_molar": 8.562274180016072,
"formula_full": "Cd2 In4 O8",
"formula_reduced": "CdIn2O4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.8852162414285711,
"spacegroup": 74
},
{
"id": "jvasp-29974",
"created_at": "2022-09-04T14:38:33.643370Z",
"updated_at": "2022-09-04T14:38:33.643395Z",
"structure_string": "Ag6 S2 I2\n1.0\n4.235606 0.825032 -2.070976\n-1.626587 3.915334 -1.766401\n-2.000862 -3.896795 16.480554\nAg S I\n6 2 2\ndirect\n0.338452 0.814501 0.910018 Ag\n0.612520 0.857152 0.791955 Ag\n0.394616 0.213286 0.433134 Ag\n0.326088 0.563709 0.058607 Ag\n0.648449 0.255202 0.315003 Ag\n0.041603 0.506304 0.166379 Ag\n0.980045 0.121056 0.232872 S\n-0.001528 0.948975 0.992107 S\n0.957513 -0.002036 0.713740 I\n0.052240 0.071836 0.511180 I\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ag",
"S",
"I"
],
"chemical_system": "Ag-I-S",
"density": 6.6823109551027295,
"density_atomic": 0.04169496424416814,
"volume": 239.83711657454404,
"volume_molar": 14.44332875484433,
"formula_full": "Ag6 S2 I2",
"formula_reduced": "Ag3SI",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.1408296109999998,
"spacegroup": 4
},
{
"id": "jvasp-57449",
"created_at": "2022-09-04T14:38:33.629899Z",
"updated_at": "2022-09-04T14:38:33.629927Z",
"structure_string": "K1 Sn1 S2\n1.0\n3.523856 -0.240468 6.893146\n1.470436 3.211418 6.893146\n-0.404236 -0.240468 7.731081\nK Sn S\n1 1 2\ndirect\n0.500001 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Sn\n0.264444 0.264443 0.264444 S\n0.735557 0.735556 0.735556 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Sn",
"S"
],
"chemical_system": "K-S-Sn",
"density": 3.5695318021215683,
"density_atomic": 0.038742700952654294,
"volume": 103.24525398702119,
"volume_molar": 15.543936307794821,
"formula_full": "K1 Sn1 S2",
"formula_reduced": "KSnS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6093424249999999,
"spacegroup": 166
},
{
"id": "jvasp-10797",
"created_at": "2022-09-04T14:38:33.952394Z",
"updated_at": "2022-09-04T14:38:33.952420Z",
"structure_string": "B3 As3 O12\n1.0\n2.288196 -3.963271 0.000000\n2.288196 3.963271 -0.000000\n0.000000 -0.000000 10.472896\nB As O\n3 3 12\ndirect\n0.000001 0.541793 0.166667 B\n0.458209 0.458209 0.500000 B\n0.541793 0.000001 0.833333 B\n0.000001 0.545101 0.666667 As\n0.545101 0.000001 0.333333 As\n0.454900 0.454900 0.000000 As\n0.315718 0.922911 0.721928 O\n0.607194 0.684284 0.388595 O\n0.878158 0.279528 0.796475 O\n0.401370 0.121843 0.463142 O\n0.598632 0.720474 0.870192 O\n0.922911 0.315718 0.278073 O\n0.279528 0.878158 0.203526 O\n0.077090 0.392807 0.055261 O\n0.392807 0.077090 0.944739 O\n0.121843 0.401370 0.536859 O\n0.720474 0.598632 0.129809 O\n0.684284 0.607194 0.611406 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"B",
"As",
"O"
],
"chemical_system": "As-B-O",
"density": 3.926774651364194,
"density_atomic": 0.09476080186156383,
"volume": 189.95195952748713,
"volume_molar": 6.355096877290837,
"formula_full": "B3 As3 O12",
"formula_reduced": "BAsO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.752678055555556,
"spacegroup": 152
},
{
"id": "jvasp-54981",
"created_at": "2022-09-04T14:38:33.963024Z",
"updated_at": "2022-09-04T14:38:33.963053Z",
"structure_string": "Li1 Ag1 C2\n1.0\n1.876856 -3.250809 -0.000000\n1.876856 3.250809 -0.000000\n-0.000000 -0.000000 5.324929\nLi Ag C\n1 1 2\ndirect\n0.333334 0.666668 0.500000 Li\n0.000000 0.000000 0.000000 Ag\n0.000000 0.000000 0.383308 C\n0.000000 0.000000 0.616692 C\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Ag",
"C"
],
"chemical_system": "Ag-C-Li",
"density": 3.5478730737081423,
"density_atomic": 0.061559313453569596,
"volume": 64.97798262511414,
"volume_molar": 9.782663941731792,
"formula_full": "Li1 Ag1 C2",
"formula_reduced": "LiAgC2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.194271815,
"spacegroup": 187
}
]
}