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=220",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=218",
"results": [
{
"id": "jvasp-105153",
"created_at": "2022-09-04T14:38:48.124352Z",
"updated_at": "2022-09-04T14:38:48.124381Z",
"structure_string": "Cs1 Ca3\n1.0\n5.648419 -0.000000 3.261116\n1.882806 5.325380 3.261116\n-0.000000 -0.000000 6.522232\nCs Ca\n1 3\ndirect\n0.000000 0.000000 0.000000 Cs\n0.250000 0.250000 0.250000 Ca\n0.750001 0.750000 0.750000 Ca\n0.500000 0.500000 0.500000 Ca\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cs",
"Ca"
],
"chemical_system": "Ca-Cs",
"density": 2.142570800182131,
"density_atomic": 0.020388545293238157,
"volume": 196.18859229386004,
"volume_molar": 29.53688295749691,
"formula_full": "Cs1 Ca3",
"formula_reduced": "CsCa3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-70793",
"created_at": "2022-09-04T14:36:15.135656Z",
"updated_at": "2022-09-04T14:36:15.135681Z",
"structure_string": "Na1 Be1 Si2\n1.0\n3.240799 -0.000000 -0.000000\n-0.000000 3.240799 0.000000\n-0.000000 0.000000 6.506153\nNa Be Si\n1 1 2\ndirect\n0.500000 0.500000 0.744851 Na\n0.000000 0.000000 0.404648 Be\n0.000000 0.000000 0.067587 Si\n0.500000 0.500000 0.282914 Si\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Be",
"Si"
],
"chemical_system": "Be-Na-Si",
"density": 2.1426735602786433,
"density_atomic": 0.05853714364720083,
"volume": 68.33268162361514,
"volume_molar": 10.287725681141893,
"formula_full": "Na1 Be1 Si2",
"formula_reduced": "NaBeSi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.948040575,
"spacegroup": 99
},
{
"id": "jvasp-49856",
"created_at": "2022-09-04T14:36:54.243676Z",
"updated_at": "2022-09-04T14:36:54.243712Z",
"structure_string": "K4 Be4 O6\n1.0\n0.000000 4.968961 -0.002447\n7.950325 0.000000 0.000000\n0.000000 -2.727981 -5.656789\nK Be O\n4 4 6\ndirect\n0.216673 0.351025 0.929705 K\n0.216673 0.148976 0.429705 K\n0.783328 0.851025 0.570295 K\n0.783327 0.648976 0.070295 K\n0.304316 0.513117 0.505780 Be\n0.695684 0.013117 0.994221 Be\n0.304316 0.986883 0.005780 Be\n0.695684 0.486883 0.494221 Be\n0.000000 0.500000 0.500000 O\n0.000000 0.000000 0.000000 O\n0.392487 0.939896 0.799384 O\n0.607513 0.439896 0.700617 O\n0.392487 0.560105 0.299383 O\n0.607513 0.060104 0.200617 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"K",
"Be",
"O"
],
"chemical_system": "Be-K-O",
"density": 2.142784467155768,
"density_atomic": 0.0626331794490857,
"volume": 223.52369978887234,
"volume_molar": 9.61493702374694,
"formula_full": "K4 Be4 O6",
"formula_reduced": "K2Be2O3",
"formula_anonymous": "A2B2C3",
"energy_above_hull": 1.1470769571428572,
"spacegroup": 14
},
{
"id": "jvasp-34278",
"created_at": "2022-09-04T14:37:10.164077Z",
"updated_at": "2022-09-04T14:37:10.164095Z",
"structure_string": "Na4 C1 O4\n1.0\n5.161098 0.522757 1.042244\n0.951491 5.099389 1.042415\n0.568170 0.522773 5.234415\nNa C O\n4 1 4\ndirect\n0.942224 0.426840 0.426839 Na\n0.426836 0.942200 0.426834 Na\n0.426836 0.426828 0.942229 Na\n0.822088 0.822120 0.822112 Na\n0.040462 0.040462 0.040454 C\n0.157558 0.157566 0.157564 O\n0.871675 0.871667 0.248974 O\n0.871667 0.248988 0.871651 O\n0.248997 0.871671 0.871671 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Na",
"C",
"O"
],
"chemical_system": "C-Na-O",
"density": 2.1429740325885698,
"density_atomic": 0.06914891656647003,
"volume": 130.15388305250838,
"volume_molar": 8.708944491142043,
"formula_full": "Na4 C1 O4",
"formula_reduced": "Na4CO4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 1.5274866666666664,
"spacegroup": 160
},
{
"id": "jvasp-121233",
"created_at": "2022-09-04T14:38:49.991594Z",
"updated_at": "2022-09-04T14:38:49.991621Z",
"structure_string": "Al2 P2\n1.0\n3.852581 0.410753 0.343290\n-1.395552 -4.977835 -0.415493\n-1.557497 0.318318 -4.936999\nAl P\n2 2\ndirect\n0.835685 0.024893 0.024616 Al\n0.835689 0.395483 0.654112 Al\n0.203487 0.740350 0.044738 P\n0.203416 0.415479 0.369569 P\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Al",
"P"
],
"chemical_system": "Al-P",
"density": 2.1431092351198338,
"density_atomic": 0.0445381366287233,
"volume": 89.81067244336263,
"volume_molar": 13.521312780104573,
"formula_full": "Al2 P2",
"formula_reduced": "AlP",
"formula_anonymous": "AB",
"energy_above_hull": 1.36971415,
"spacegroup": 44
},
{
"id": "jvasp-37735",
"created_at": "2022-09-04T14:38:35.998198Z",
"updated_at": "2022-09-04T14:38:35.998217Z",
"structure_string": "K3 Ho1\n1.0\n0.000000 4.781627 4.781627\n4.781627 0.000000 4.781627\n4.781627 4.781627 0.000000\nK Ho\n3 1\ndirect\n0.000000 0.000000 0.000000 K\n0.499999 0.499999 0.499999 K\n0.250000 0.250000 0.250000 K\n0.750002 0.750002 0.750002 Ho\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Ho"
],
"chemical_system": "Ho-K",
"density": 2.1433240476218884,
"density_atomic": 0.018293757182341785,
"volume": 218.65382600907353,
"volume_molar": 32.91910294847975,
"formula_full": "K3 Ho1",
"formula_reduced": "K3Ho",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-51009",
"created_at": "2022-09-04T14:36:51.521304Z",
"updated_at": "2022-09-04T14:36:51.521329Z",
"structure_string": "Ca1 H2 O2\n1.0\n1.922907 -3.330572 -0.000000\n1.922907 3.330572 0.000000\n0.000000 -0.000000 4.481477\nCa H O\n1 2 2\ndirect\n0.000000 0.000000 0.031146 Ca\n0.333334 0.666668 0.990920 H\n0.666668 0.333334 0.572003 H\n0.333334 0.666668 0.211161 O\n0.666668 0.333334 0.789913 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"H",
"O"
],
"chemical_system": "Ca-H-O",
"density": 2.1433649612710264,
"density_atomic": 0.0871047281680638,
"volume": 57.40216524587246,
"volume_molar": 6.913678380788479,
"formula_full": "Ca1 H2 O2",
"formula_reduced": "Ca(HO)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.6712754839999997,
"spacegroup": 156
},
{
"id": "jvasp-91895",
"created_at": "2022-09-04T14:36:06.990515Z",
"updated_at": "2022-09-04T14:36:06.990554Z",
"structure_string": "Mg7 Cr1\n1.0\n6.287831 0.000000 0.000000\n-3.143916 5.445421 -0.000000\n-0.000000 0.000000 5.025923\nMg Cr\n7 1\ndirect\n0.167995 0.833998 0.250000 Mg\n0.666002 0.332005 0.250000 Mg\n0.666002 0.833998 0.250000 Mg\n0.328199 0.171801 0.750000 Mg\n0.328198 0.656400 0.750000 Mg\n0.843600 0.171801 0.750000 Mg\n0.833332 0.666667 0.750000 Mg\n0.166667 0.333333 0.250000 Cr\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mg",
"Cr"
],
"chemical_system": "Cr-Mg",
"density": 2.143434968787416,
"density_atomic": 0.04648810399409998,
"volume": 172.08703544922625,
"volume_molar": 12.954154380579379,
"formula_full": "Mg7 Cr1",
"formula_reduced": "Mg7Cr",
"formula_anonymous": "AB7",
"energy_above_hull": 0.0,
"spacegroup": 187
},
{
"id": "jvasp-5356",
"created_at": "2022-09-04T14:36:04.068120Z",
"updated_at": "2022-09-04T14:36:04.068137Z",
"structure_string": "S32 O4\n1.0\n8.010772 0.000000 0.000000\n0.000000 7.980139 0.000000\n0.000000 0.000000 13.210248\nS O\n32 4\ndirect\n0.010588 0.499954 0.854855 S\n0.186653 0.335498 0.763990 S\n0.813347 0.835498 0.236011 S\n0.813347 0.335498 0.263989 S\n0.186653 0.835498 0.736011 S\n0.437635 0.958279 0.703577 S\n0.562365 0.458279 0.296423 S\n0.562365 0.958279 0.203577 S\n0.437635 0.458279 0.796423 S\n0.549822 0.780151 0.620909 S\n0.450178 0.280150 0.379091 S\n0.450178 0.780151 0.120909 S\n0.549822 0.280150 0.879091 S\n0.535978 0.851832 0.467448 S\n0.464022 0.351832 0.532552 S\n0.535978 0.351832 0.032552 S\n0.464022 0.851832 0.967448 S\n0.029806 0.360751 0.478440 S\n0.676872 0.249603 0.594013 S\n0.676872 0.749603 0.905987 S\n0.323128 0.249603 0.094013 S\n0.139891 0.931679 0.407567 S\n0.860109 0.431679 0.592433 S\n0.860109 0.931679 0.907568 S\n0.139891 0.431679 0.092433 S\n0.970194 0.860751 0.521560 S\n0.323128 0.749603 0.405987 S\n0.029806 0.860751 0.021560 S\n0.970194 0.360751 0.978440 S\n0.010588 -0.000046 0.645145 S\n0.989412 0.499954 0.354855 S\n0.989412 -0.000046 0.145145 S\n0.808580 0.173454 0.319421 O\n0.808580 0.673454 0.180579 O\n0.191419 0.673454 0.680579 O\n0.191419 0.173454 0.819421 O\n",
"nsites": 36,
"nelements": 2,
"elements": [
"S",
"O"
],
"chemical_system": "O-S",
"density": 2.143436958511249,
"density_atomic": 0.04262915290038655,
"volume": 844.4925022114048,
"volume_molar": 14.126813108560253,
"formula_full": "S32 O4",
"formula_reduced": "S8O",
"formula_anonymous": "AB8",
"energy_above_hull": 2.2929459444444444,
"spacegroup": 29
},
{
"id": "jvasp-35231",
"created_at": "2022-09-04T14:37:57.425467Z",
"updated_at": "2022-09-04T14:37:57.425499Z",
"structure_string": "K2 Sn1\n1.0\n2.998396 1.731124 4.898045\n-2.998396 1.731124 4.898045\n0.000000 -3.462250 4.898045\nK Sn\n2 1\ndirect\n0.249951 0.249951 0.249952 K\n0.750047 0.750047 0.750049 K\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 3,
"nelements": 2,
"elements": [
"K",
"Sn"
],
"chemical_system": "K-Sn",
"density": 2.143472988565795,
"density_atomic": 0.019666627817750016,
"volume": 152.5426742093713,
"volume_molar": 30.621115199855193,
"formula_full": "K2 Sn1",
"formula_reduced": "K2Sn",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1289868555555555,
"spacegroup": 225
},
{
"id": "jvasp-78460",
"created_at": "2022-09-04T14:37:10.550776Z",
"updated_at": "2022-09-04T14:37:10.550794Z",
"structure_string": "Rb1 B1\n1.0\n-3.340906 -3.340906 0.000000\n-3.340906 -0.000000 -3.340906\n0.000000 -3.340906 -3.340906\nRb B\n1 1\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500001 0.500001 0.500001 B\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Rb",
"B"
],
"chemical_system": "B-Rb",
"density": 2.1436654140000906,
"density_atomic": 0.02681681713921124,
"volume": 74.5800662926408,
"volume_molar": 22.45658285522071,
"formula_full": "Rb1 B1",
"formula_reduced": "RbB",
"formula_anonymous": "AB",
"energy_above_hull": 2.1631162916666664,
"spacegroup": 225
},
{
"id": "jvasp-121276",
"created_at": "2022-09-04T14:38:55.334252Z",
"updated_at": "2022-09-04T14:38:55.334280Z",
"structure_string": "As1 Br5\n1.0\n6.004367 0.000000 0.000000\n0.000000 7.901222 0.000000\n0.000000 0.000000 7.743883\nAs Br\n1 5\ndirect\n0.815214 0.000000 0.500000 As\n0.718829 0.000000 0.183595 Br\n0.743364 0.684691 0.500000 Br\n0.743364 0.315309 0.500000 Br\n0.204628 0.000000 0.500000 Br\n0.718829 0.000000 0.816405 Br\n",
"nsites": 6,
"nelements": 2,
"elements": [
"As",
"Br"
],
"chemical_system": "As-Br",
"density": 2.1444285612086516,
"density_atomic": 0.016331684215497456,
"volume": 367.3840322179682,
"volume_molar": 36.87397258321632,
"formula_full": "As1 Br5",
"formula_reduced": "AsBr5",
"formula_anonymous": "AB5",
"energy_above_hull": null,
"spacegroup": 25
}
]
}