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=3482",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume_molar&page=3480",
"results": [
{
"id": "jvasp-16174",
"created_at": "2022-09-04T14:35:52.814874Z",
"updated_at": "2022-09-04T14:35:52.814895Z",
"structure_string": "Sr2 As2 Pd2\n1.0\n2.163331 -3.747000 0.000000\n2.163331 3.747000 0.000000\n-0.000000 -0.000000 8.850474\nSr As Pd\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Sr\n0.000000 0.000000 0.000000 Sr\n0.333333 0.666667 0.750000 As\n0.666667 0.333333 0.250000 As\n0.333333 0.666667 0.250000 Pd\n0.666667 0.333333 0.750000 Pd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sr",
"As",
"Pd"
],
"chemical_system": "As-Pd-Sr",
"density": 6.225384495983688,
"density_atomic": 0.04181653633777968,
"volume": 143.48390673809163,
"volume_molar": 14.401338052858337,
"formula_full": "Sr2 As2 Pd2",
"formula_reduced": "SrAsPd",
"formula_anonymous": "ABC",
"energy_above_hull": 0.6765412533333331,
"spacegroup": 194
},
{
"id": "jvasp-56993",
"created_at": "2022-09-04T14:37:09.740912Z",
"updated_at": "2022-09-04T14:37:09.740935Z",
"structure_string": "Pr4 C2 Br2\n1.0\n1.919501 -3.324674 0.000000\n1.919501 3.324674 -0.000000\n0.000000 -0.000000 14.989844\nPr C Br\n4 2 2\ndirect\n0.333333 0.666667 0.907036 Pr\n0.666667 0.333333 0.407037 Pr\n0.666667 0.333333 0.092963 Pr\n0.333333 0.666667 0.592963 Pr\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n0.666667 0.333333 0.750000 Br\n0.333333 0.666667 0.250000 Br\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Pr",
"C",
"Br"
],
"chemical_system": "Br-C-Pr",
"density": 6.487427767960611,
"density_atomic": 0.04181436138655453,
"volume": 191.3218266337654,
"volume_molar": 14.402087130610653,
"formula_full": "Pr4 C2 Br2",
"formula_reduced": "Pr2CBr",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.0831409512500003,
"spacegroup": 194
},
{
"id": "jvasp-34210",
"created_at": "2022-09-04T14:37:13.949431Z",
"updated_at": "2022-09-04T14:37:13.949457Z",
"structure_string": "Rb4 C1 O4\n1.0\n5.105946 0.000000 2.181281\n2.552973 6.226174 1.090640\n0.106810 0.000000 6.816150\nRb C O\n4 1 4\ndirect\n0.975836 0.350679 0.000008 Rb\n0.024161 -0.000000 0.649322 Rb\n0.326515 0.649320 0.000008 Rb\n0.673478 -0.000000 0.350678 Rb\n0.500005 -0.000000 -0.000008 C\n0.258254 -0.000000 0.191283 O\n0.741762 0.808719 -0.000007 O\n0.449511 -0.000000 0.808724 O\n0.550481 0.191280 -0.000007 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Rb",
"C",
"O"
],
"chemical_system": "C-O-Rb",
"density": 3.2238932005678285,
"density_atomic": 0.041814122947314056,
"volume": 215.23828232245913,
"volume_molar": 14.40216925651632,
"formula_full": "Rb4 C1 O4",
"formula_reduced": "Rb4CO4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 1.4129315555555553,
"spacegroup": 121
},
{
"id": "jvasp-40271",
"created_at": "2022-09-04T14:37:54.848877Z",
"updated_at": "2022-09-04T14:37:54.848904Z",
"structure_string": "Li1 In3\n1.0\n4.573527 0.000000 -0.000000\n0.000000 4.573527 0.000000\n0.000000 0.000000 4.573527\nLi In\n1 3\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.000000 In\n0.000000 0.500000 0.500000 In\n0.500000 0.000000 0.500000 In\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"In"
],
"chemical_system": "In-Li",
"density": 6.09945361834912,
"density_atomic": 0.04181251100497553,
"volume": 95.66514671945953,
"volume_molar": 14.402724484265937,
"formula_full": "Li1 In3",
"formula_reduced": "LiIn3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.005105,
"spacegroup": 221
},
{
"id": "jvasp-106243",
"created_at": "2022-09-04T14:38:39.929510Z",
"updated_at": "2022-09-04T14:38:39.929526Z",
"structure_string": "Er2 Al1 Cd1\n1.0\n4.445900 0.000000 2.566841\n1.481966 4.191634 2.566841\n0.000000 0.000000 5.133682\nEr Al Cd\n2 1 1\ndirect\n0.750001 0.749999 0.749999 Er\n0.250000 0.250000 0.250000 Er\n0.500001 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Er",
"Al",
"Cd"
],
"chemical_system": "Al-Cd-Er",
"density": 8.22571117194844,
"density_atomic": 0.04181075246145352,
"volume": 95.6691703572594,
"volume_molar": 14.40333025709589,
"formula_full": "Er2 Al1 Cd1",
"formula_reduced": "Er2AlCd",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5347281375,
"spacegroup": 225
},
{
"id": "jvasp-98701",
"created_at": "2022-09-04T14:35:46.260126Z",
"updated_at": "2022-09-04T14:35:46.260153Z",
"structure_string": "La1 In5 Co1\n1.0\n4.662789 0.000000 -0.000000\n0.000000 4.662789 -0.000000\n0.000000 0.000000 7.701137\nLa In Co\n1 5 1\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.000000 In\n0.500000 0.000000 0.687807 In\n0.000000 0.500000 0.312193 In\n0.500000 0.000000 0.312193 In\n0.000000 0.500000 0.687807 In\n0.000000 0.000000 0.500000 Co\n",
"nsites": 7,
"nelements": 3,
"elements": [
"La",
"In",
"Co"
],
"chemical_system": "Co-In-La",
"density": 7.655611568148294,
"density_atomic": 0.04180725603478391,
"volume": 167.43504989124264,
"volume_molar": 14.404534837181227,
"formula_full": "La1 In5 Co1",
"formula_reduced": "LaIn5Co",
"formula_anonymous": "ABC5",
"energy_above_hull": 0.3988851071428571,
"spacegroup": 123
},
{
"id": "jvasp-101676",
"created_at": "2022-09-04T14:36:40.433135Z",
"updated_at": "2022-09-04T14:36:40.433145Z",
"structure_string": "Y2 U1 Se3\n1.0\n4.025338 -0.000000 0.000000\n-2.012669 3.486044 0.000000\n0.000000 0.000000 10.227448\nY U Se\n2 1 3\ndirect\n0.333333 0.666666 0.671984 Y\n0.666667 0.333333 0.328016 Y\n0.000000 0.000000 0.000000 U\n0.333333 0.666666 0.169768 Se\n0.666667 0.333333 0.830233 Se\n0.000000 0.000000 0.500000 Se\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Y",
"U",
"Se"
],
"chemical_system": "Se-U-Y",
"density": 7.552207709167702,
"density_atomic": 0.041806975780110986,
"volume": 143.51671911304348,
"volume_molar": 14.404631398535503,
"formula_full": "Y2 U1 Se3",
"formula_reduced": "Y2USe3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.6820445,
"spacegroup": 164
},
{
"id": "jvasp-115777",
"created_at": "2022-09-04T14:38:39.449925Z",
"updated_at": "2022-09-04T14:38:39.449954Z",
"structure_string": "Sn1 C1\n1.0\n3.597539 0.000000 -0.000000\n-1.798769 3.115560 0.000000\n-0.000000 0.000000 4.268379\nSn C\n1 1\ndirect\n0.333333 0.666667 0.000000 Sn\n0.000000 0.000000 0.000000 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sn",
"C"
],
"chemical_system": "C-Sn",
"density": 4.537209759993806,
"density_atomic": 0.04180472693578142,
"volume": 47.84147981811511,
"volume_molar": 14.40540628156942,
"formula_full": "Sn1 C1",
"formula_reduced": "SnC",
"formula_anonymous": "AB",
"energy_above_hull": 2.8158058500000003,
"spacegroup": 187
},
{
"id": "jvasp-8587",
"created_at": "2022-09-04T14:36:34.121668Z",
"updated_at": "2022-09-04T14:36:34.121696Z",
"structure_string": "Tb2 Cl6\n1.0\n3.825907 0.000000 0.000000\n-1.912954 5.884729 -0.000000\n-0.000000 -0.000000 8.499868\nTb Cl\n2 6\ndirect\n0.757236 0.514471 0.250000 Tb\n0.242766 0.485530 0.750000 Tb\n0.147038 0.294075 0.066071 Cl\n0.852964 0.705925 0.933930 Cl\n0.583722 0.167442 0.750000 Cl\n0.416280 0.832558 0.250000 Cl\n0.147038 0.294075 0.433930 Cl\n0.852964 0.705925 0.566071 Cl\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Tb",
"Cl"
],
"chemical_system": "Cl-Tb",
"density": 4.603812897973914,
"density_atomic": 0.041803912388926875,
"volume": 191.36964802651008,
"volume_molar": 14.40568697009125,
"formula_full": "Tb2 Cl6",
"formula_reduced": "TbCl3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 63
},
{
"id": "jvasp-34002",
"created_at": "2022-09-04T14:38:36.597924Z",
"updated_at": "2022-09-04T14:38:36.597948Z",
"structure_string": "Te8 Mo6 S4\n1.0\n-0.343285 -5.924332 0.038155\n-0.059375 -0.090716 14.106100\n-4.963522 3.268475 0.000116\nTe Mo S\n8 6 4\ndirect\n0.670675 0.111226 0.695903 Te\n0.995989 0.888772 0.637436 Te\n0.995989 0.388774 0.358555 Te\n0.326122 0.877081 0.306252 Te\n0.326125 0.377084 0.019880 Te\n0.340539 0.122917 0.027080 Te\n0.340539 0.622919 0.313450 Te\n0.670681 0.611226 0.974771 Te\n0.333335 0.250000 0.374993 Mo\n0.684403 0.750888 0.659783 Mo\n0.684407 0.250887 0.024624 Mo\n0.982259 0.749112 0.308711 Mo\n0.982260 0.249112 0.673547 Mo\n0.333334 0.750000 0.958342 Mo\n0.662874 0.853254 0.974478 S\n0.003790 0.646746 0.644928 S\n0.003795 0.146743 0.358858 S\n0.662878 0.353256 0.688406 S\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Te",
"Mo",
"S"
],
"chemical_system": "Mo-S-Te",
"density": 6.65102055159601,
"density_atomic": 0.041802103294352695,
"volume": 430.6003426012234,
"volume_molar": 14.4063104136044,
"formula_full": "Te8 Mo6 S4",
"formula_reduced": "Te4Mo3S2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 3.2878254185185183,
"spacegroup": 15
},
{
"id": "jvasp-37882",
"created_at": "2022-09-04T14:38:02.089721Z",
"updated_at": "2022-09-04T14:38:02.089752Z",
"structure_string": "Dy2 Zn1 Hg1\n1.0\n0.000000 3.630353 3.630353\n3.630353 0.000000 3.630353\n3.630353 3.630353 0.000000\nDy Zn Hg\n2 1 1\ndirect\n0.500000 0.500000 0.500000 Dy\n0.000000 0.000000 0.000000 Dy\n0.750000 0.750000 0.750000 Zn\n0.250000 0.250000 0.250000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Dy",
"Zn",
"Hg"
],
"chemical_system": "Dy-Hg-Zn",
"density": 10.2555576375274,
"density_atomic": 0.04180068777566536,
"volume": 95.69220538827199,
"volume_molar": 14.40679826207511,
"formula_full": "Dy2 Zn1 Hg1",
"formula_reduced": "Dy2ZnHg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-9170",
"created_at": "2022-09-04T14:38:31.733562Z",
"updated_at": "2022-09-04T14:38:31.733592Z",
"structure_string": "P8 S10\n1.0\n0.000000 6.352534 -0.134281\n10.906021 0.000000 0.000000\n0.000000 -2.543955 -6.161922\nP S\n8 10\ndirect\n0.679690 0.000128 0.403205 P\n0.320308 0.500128 0.596794 P\n0.449946 0.867151 0.497899 P\n0.550052 0.367151 0.502101 P\n0.754275 0.741127 0.580240 P\n0.245724 0.241127 0.419759 P\n0.478191 0.759200 0.046955 P\n0.521808 0.259200 0.953045 P\n0.035987 0.397183 0.367022 S\n0.964011 0.897183 0.632978 S\n0.273798 0.151980 0.710855 S\n0.726200 0.651980 0.289145 S\n0.634460 0.936218 0.085392 S\n0.240949 0.789715 0.208159 S\n0.365538 0.436218 0.914608 S\n0.850252 0.618299 0.809711 S\n0.759049 0.289715 0.791840 S\n0.149747 0.118299 0.190288 S\n",
"nsites": 18,
"nelements": 2,
"elements": [
"P",
"S"
],
"chemical_system": "P-S",
"density": 2.1919501241429837,
"density_atomic": 0.04179933490105249,
"volume": 430.6288615024534,
"volume_molar": 14.407264551590663,
"formula_full": "P8 S10",
"formula_reduced": "P4S5",
"formula_anonymous": "A4B5",
"energy_above_hull": 2.791010222222222,
"spacegroup": 4
}
]
}