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=-energy_above_hull&page=1510",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=1508",
"results": [
{
"id": "jvasp-15083",
"created_at": "2022-09-04T14:36:21.077439Z",
"updated_at": "2022-09-04T14:36:21.077471Z",
"structure_string": "U3 S6\n1.0\n3.639031 -6.302986 0.000000\n3.639031 6.302986 0.000000\n-0.000000 0.000000 3.939006\nU S\n3 6\ndirect\n0.333333 0.666667 0.500001 U\n0.666667 0.333333 0.500001 U\n0.000000 0.000000 0.000000 U\n0.405777 0.405777 0.000000 S\n-0.000000 0.594223 0.000000 S\n0.594223 -0.000000 0.000000 S\n0.258777 -0.000000 0.500001 S\n-0.000000 0.258777 0.500001 S\n0.741223 0.741223 0.500001 S\n",
"nsites": 9,
"nelements": 2,
"elements": [
"U",
"S"
],
"chemical_system": "S-U",
"density": 8.330230557067052,
"density_atomic": 0.049807388762999484,
"volume": 180.6960819171843,
"volume_molar": 12.090858223175273,
"formula_full": "U3 S6",
"formula_reduced": "US2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.3715053333333325,
"spacegroup": 189
},
{
"id": "jvasp-24796",
"created_at": "2022-09-04T14:37:36.982797Z",
"updated_at": "2022-09-04T14:37:36.982819Z",
"structure_string": "U2 Cu4 As5\n1.0\n3.954991 -0.000000 -0.640844\n-0.103839 3.953628 -0.640844\n0.006723 0.006902 12.566089\nU Cu As\n2 4 5\ndirect\n0.841749 0.841751 0.683501 U\n0.158249 0.158250 0.316499 U\n0.941971 0.441972 0.883945 Cu\n0.058028 0.558029 0.116056 Cu\n0.558028 0.058028 0.116056 Cu\n0.441971 0.941972 0.883945 Cu\n0.375624 0.375624 0.751249 As\n0.624375 0.624376 0.248751 As\n0.000000 0.000000 0.000000 As\n0.749999 0.250000 0.500000 As\n0.249999 0.750000 0.500000 As\n",
"nsites": 11,
"nelements": 3,
"elements": [
"U",
"Cu",
"As"
],
"chemical_system": "As-Cu-U",
"density": 9.335414160955418,
"density_atomic": 0.05597239990911967,
"volume": 196.52543070978368,
"volume_molar": 10.759125515035857,
"formula_full": "U2 Cu4 As5",
"formula_reduced": "U2Cu4As5",
"formula_anonymous": "A2B4C5",
"energy_above_hull": 2.3713465954545456,
"spacegroup": 139
},
{
"id": "jvasp-116743",
"created_at": "2022-09-04T14:38:44.812157Z",
"updated_at": "2022-09-04T14:38:44.812184Z",
"structure_string": "Sr6 Al2 N6\n1.0\n7.590205 0.000029 0.000000\n-3.795124 6.573255 0.000000\n-0.000000 -0.000000 5.381290\nSr Al N\n6 2 6\ndirect\n0.924647 0.641604 0.250000 Sr\n0.716956 0.075356 0.250000 Sr\n0.358396 0.283042 0.250000 Sr\n0.075354 0.358397 0.750000 Sr\n0.283044 0.924645 0.750000 Sr\n0.641604 0.716959 0.750000 Sr\n0.666667 0.333334 0.750000 Al\n0.333334 0.666667 0.250000 Al\n0.895863 0.591045 0.750000 N\n0.695181 0.104138 0.750000 N\n0.408958 0.304819 0.750000 N\n0.104138 0.408956 0.250000 N\n0.304820 0.895863 0.250000 N\n0.591042 0.695182 0.250000 N\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Sr",
"Al",
"N"
],
"chemical_system": "Al-N-Sr",
"density": 4.105015537055593,
"density_atomic": 0.05214428232584268,
"volume": 268.4858123564893,
"volume_molar": 11.548995386240902,
"formula_full": "Sr6 Al2 N6",
"formula_reduced": "Sr3AlN3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 2.371310211428572,
"spacegroup": 176
},
{
"id": "jvasp-109070",
"created_at": "2022-09-04T14:37:49.608292Z",
"updated_at": "2022-09-04T14:37:49.608314Z",
"structure_string": "Pd1 Pt3\n1.0\n3.621311 -0.005836 -3.228468\n-0.731217 3.546724 -3.228468\n0.004763 0.005836 4.851482\nPd Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Pd\n0.749999 0.249999 0.499998 Pt\n0.249999 0.749999 0.499998 Pt\n0.499999 0.499999 -0.000002 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pd",
"Pt"
],
"chemical_system": "Pd-Pt",
"density": 18.39815952507666,
"density_atomic": 0.06407447832107428,
"volume": 62.4273518070047,
"volume_molar": 9.398657496395566,
"formula_full": "Pd1 Pt3",
"formula_reduced": "PdPt3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.371289975,
"spacegroup": 139
},
{
"id": "jvasp-52841",
"created_at": "2022-09-04T14:36:37.125411Z",
"updated_at": "2022-09-04T14:36:37.125438Z",
"structure_string": "Na2 H6 S2 O10\n1.0\n3.369743 3.873931 -1.947130\n-3.369743 3.873931 1.947130\n-0.038891 0.000000 8.163178\nNa H S O\n2 6 2 10\ndirect\n0.948420 0.496464 0.491771 Na\n0.503535 0.051580 0.991771 Na\n0.303088 0.597284 0.780343 H\n0.402716 0.696912 0.280343 H\n0.495723 0.528869 0.695130 H\n0.471131 0.504277 0.195130 H\n0.822907 0.591537 0.002184 H\n0.408463 0.177093 0.502184 H\n0.126038 0.137416 0.244790 S\n0.862583 0.873962 0.744790 S\n0.355005 0.462141 0.740768 O\n0.775365 0.687047 0.653099 O\n0.312953 0.224635 0.153099 O\n0.717991 0.141306 0.629014 O\n0.858693 0.282009 0.129013 O\n0.777750 0.789495 0.922039 O\n0.210505 0.222250 0.422039 O\n0.146967 0.870891 0.813862 O\n0.129109 0.853033 0.313862 O\n0.537858 0.644995 0.240768 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Na",
"H",
"S",
"O"
],
"chemical_system": "H-Na-O-S",
"density": 2.1575222675452213,
"density_atomic": 0.09409992642605199,
"volume": 212.54001740072468,
"volume_molar": 6.399729509600067,
"formula_full": "Na2 H6 S2 O10",
"formula_reduced": "NaH3SO5",
"formula_anonymous": "ABC3D5",
"energy_above_hull": 2.37123365,
"spacegroup": 9
},
{
"id": "jvasp-58420",
"created_at": "2022-09-04T14:37:29.262479Z",
"updated_at": "2022-09-04T14:37:29.262501Z",
"structure_string": "Er3 P4 Pd7\n1.0\n3.873984 0.000000 0.972822\n1.424112 7.359931 2.528805\n0.002786 0.008944 8.188823\nEr P Pd\n3 4 7\ndirect\n0.500000 0.500000 0.500000 Er\n0.180266 0.815608 0.823860 Er\n0.819734 0.184391 0.176139 Er\n0.605959 0.107911 0.680171 P\n0.394041 0.892089 0.319828 P\n0.157810 0.433511 0.250866 P\n0.842189 0.566488 0.749133 P\n0.331597 0.412984 0.923824 Pd\n0.989340 0.234910 0.786411 Pd\n0.010660 0.765089 0.213588 Pd\n0.500000 -0.000000 -0.000000 Pd\n0.804818 0.860103 0.530259 Pd\n0.195181 0.139896 0.469740 Pd\n0.668403 0.587016 0.076175 Pd\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Er",
"P",
"Pd"
],
"chemical_system": "Er-P-Pd",
"density": 9.751864658903902,
"density_atomic": 0.05998629769534678,
"volume": 233.38663224561697,
"volume_molar": 10.039193934896145,
"formula_full": "Er3 P4 Pd7",
"formula_reduced": "Er3P4Pd7",
"formula_anonymous": "A3B4C7",
"energy_above_hull": 2.371227278571429,
"spacegroup": 12
},
{
"id": "jvasp-101665",
"created_at": "2022-09-04T14:36:41.279719Z",
"updated_at": "2022-09-04T14:36:41.279744Z",
"structure_string": "Ba2 Lu1 Re1 O6\n1.0\n5.113237 0.000219 2.950777\n1.705019 4.820591 2.950777\n0.001181 0.000835 5.903619\nBa Lu Re O\n2 1 1 6\ndirect\n0.750003 0.750002 0.749986 Ba\n0.249998 0.249997 0.250016 Ba\n0.000000 0.000000 0.000000 Lu\n0.500001 0.499999 0.500001 Re\n0.261486 0.261485 0.738512 O\n0.738515 0.738514 0.261489 O\n0.738523 0.261486 0.738515 O\n0.261479 0.738513 0.261486 O\n0.738514 0.261478 0.261486 O\n0.261487 0.738521 0.738515 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Lu",
"Re",
"O"
],
"chemical_system": "Ba-Lu-O-Re",
"density": 8.35262985204242,
"density_atomic": 0.06873330911426331,
"volume": 145.4898669781175,
"volume_molar": 8.761604580958995,
"formula_full": "Ba2 Lu1 Re1 O6",
"formula_reduced": "Ba2LuReO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.371067669,
"spacegroup": 225
},
{
"id": "jvasp-57117",
"created_at": "2022-09-04T14:38:33.389140Z",
"updated_at": "2022-09-04T14:38:33.389168Z",
"structure_string": "Y6 Cu2 Si2 S14\n1.0\n4.944222 -8.563643 -0.000000\n4.944222 8.563643 0.000000\n0.000000 -0.000000 5.685983\nY Cu Si S\n6 2 2 14\ndirect\n0.770874 0.128387 0.743308 Y\n0.229126 0.871612 0.243308 Y\n0.357513 0.229126 0.743308 Y\n0.128387 0.357513 0.243308 Y\n0.642487 0.770874 0.243308 Y\n0.871612 0.642487 0.743308 Y\n0.000000 0.000000 0.703917 Cu\n0.000000 0.000000 0.203917 Cu\n0.333333 0.666667 0.830201 Si\n0.666667 0.333333 0.330201 Si\n0.835167 0.094222 0.219348 S\n0.477443 0.894322 0.980720 S\n0.333333 0.666667 0.458854 S\n0.164833 0.905777 0.719347 S\n0.740945 0.835167 0.719347 S\n0.416879 0.522557 0.980720 S\n0.894322 0.416879 0.480720 S\n0.583121 0.477443 0.480720 S\n0.259054 0.164833 0.219348 S\n0.666667 0.333333 0.958854 S\n0.522557 0.105678 0.480720 S\n0.094222 0.259054 0.719347 S\n0.105678 0.583121 0.980720 S\n0.905777 0.740945 0.219348 S\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Y",
"Cu",
"Si",
"S"
],
"chemical_system": "Cu-S-Si-Y",
"density": 4.019847565411633,
"density_atomic": 0.04984472132137988,
"volume": 481.4953191383515,
"volume_molar": 12.081802446384478,
"formula_full": "Y6 Cu2 Si2 S14",
"formula_reduced": "Y3CuSiS7",
"formula_anonymous": "ABC3D7",
"energy_above_hull": 2.3710571166666665,
"spacegroup": 173
},
{
"id": "jvasp-92601",
"created_at": "2022-09-04T14:35:46.504844Z",
"updated_at": "2022-09-04T14:35:46.504870Z",
"structure_string": "La1 Cr1 O3\n1.0\n3.889903 0.000000 -0.000000\n0.000000 3.889903 -0.000000\n0.000000 0.000000 3.889903\nLa Cr O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 La\n0.000000 0.000000 0.000000 Cr\n0.500000 0.000000 0.000000 O\n0.000000 0.500000 0.000000 O\n0.000000 0.000000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"La",
"Cr",
"O"
],
"chemical_system": "Cr-La-O",
"density": 6.739823350073272,
"density_atomic": 0.08494810381295555,
"volume": 58.859465668702114,
"volume_molar": 7.089199746306233,
"formula_full": "La1 Cr1 O3",
"formula_reduced": "LaCrO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.37100858,
"spacegroup": 221
},
{
"id": "jvasp-7861",
"created_at": "2022-09-04T14:37:04.022312Z",
"updated_at": "2022-09-04T14:37:04.022338Z",
"structure_string": "La1 Cr1 O3\n1.0\n3.890118 0.000000 0.000000\n-0.000000 3.890118 -0.000000\n0.000000 -0.000000 3.890118\nLa Cr O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 La\n0.000000 0.000000 0.000000 Cr\n0.000000 0.500000 0.000000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"La",
"Cr",
"O"
],
"chemical_system": "Cr-La-O",
"density": 6.738705917182065,
"density_atomic": 0.0849340197931948,
"volume": 58.86922592589473,
"volume_molar": 7.090375299159588,
"formula_full": "La1 Cr1 O3",
"formula_reduced": "LaCrO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.3709265799999995,
"spacegroup": 221
},
{
"id": "jvasp-81572",
"created_at": "2022-09-04T14:37:14.517958Z",
"updated_at": "2022-09-04T14:37:14.518000Z",
"structure_string": "Mg1 Be2 Os1\n1.0\n-9.197489 -0.000000 -5.310173\n-5.781461 -1.127234 -0.606560\n-4.461601 2.605898 -2.892627\nMg Be Os\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.710206 0.000001 0.000001 Be\n0.289794 0.000000 0.000000 Be\n0.499999 0.000001 0.000000 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Be",
"Os"
],
"chemical_system": "Be-Mg-Os",
"density": 6.210481313963558,
"density_atomic": 0.06432833669593811,
"volume": 62.1809952728433,
"volume_molar": 9.361567653248924,
"formula_full": "Mg1 Be2 Os1",
"formula_reduced": "MgBe2Os",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.3707540625,
"spacegroup": 71
},
{
"id": "jvasp-104902",
"created_at": "2022-09-04T14:36:41.392271Z",
"updated_at": "2022-09-04T14:36:41.392288Z",
"structure_string": "Y4 Ge4 Ru2\n1.0\n5.193908 0.003771 2.556545\n3.430411 3.899868 2.556545\n-0.018488 -0.008368 10.209986\nY Ge Ru\n4 4 2\ndirect\n0.816221 0.816222 0.111114 Y\n0.183779 0.183778 0.888885 Y\n0.001210 0.001210 0.326936 Y\n-0.001210 -0.001210 0.673065 Y\n0.645943 0.645944 0.434096 Ge\n0.354056 0.354056 0.565904 Ge\n0.514439 0.514439 0.123908 Ge\n0.485561 0.485560 0.876091 Ge\n0.727448 0.727448 0.629765 Ru\n0.272552 0.272552 0.370234 Ru\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Y",
"Ge",
"Ru"
],
"chemical_system": "Ge-Ru-Y",
"density": 6.808519720085569,
"density_atomic": 0.04833282228895309,
"volume": 206.89873933320033,
"volume_molar": 12.45973331331081,
"formula_full": "Y4 Ge4 Ru2",
"formula_reduced": "Y2Ge2Ru",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.37069066,
"spacegroup": 12
}
]
}