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=id&page=4059",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=4057",
"results": [
{
"id": "jvasp-85484",
"created_at": "2022-09-04T14:36:08.159733Z",
"updated_at": "2022-09-04T14:36:08.159758Z",
"structure_string": "As2 C6 N6\n1.0\n5.613429 0.002836 0.970558\n1.468809 5.417858 0.970558\n0.172629 0.132129 8.604132\nAs C N\n2 6 6\ndirect\n0.299562 0.296930 0.732970 As\n0.703070 0.700439 0.267030 As\n0.966091 0.238315 0.749836 C\n0.899883 0.668329 0.052062 C\n0.331672 0.100118 0.947939 C\n0.761686 0.033909 0.250164 C\n0.443433 0.985609 0.638729 C\n0.014392 0.556567 0.361271 C\n0.539517 0.815951 0.572216 N\n0.368173 0.992394 0.073646 N\n0.778001 0.233137 0.247715 N\n0.766863 0.222000 0.752285 N\n0.007607 0.631828 0.926354 N\n0.184050 0.460483 0.427784 N\n",
"nsites": 14,
"nelements": 3,
"elements": [
"As",
"C",
"N"
],
"chemical_system": "As-C-N",
"density": 1.9524841514498223,
"density_atomic": 0.053804599722529906,
"volume": 260.20080201688967,
"volume_molar": 11.192613254361438,
"formula_full": "As2 C6 N6",
"formula_reduced": "As(CN)3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 5.9406387857142855,
"spacegroup": 5
},
{
"id": "jvasp-85485",
"created_at": "2022-09-04T14:36:14.096843Z",
"updated_at": "2022-09-04T14:36:14.096860Z",
"structure_string": "Ge6 Rh10\n1.0\n3.978090 0.000064 -0.000026\n0.000092 5.532133 0.000004\n-0.000069 -0.000004 10.624658\nGe Rh\n6 10\ndirect\n0.499996 0.907016 0.344816 Ge\n-0.000000 0.499981 0.499997 Ge\n0.500000 0.407022 0.155185 Ge\n0.500003 0.092969 0.655204 Ge\n0.499999 0.592964 0.844794 Ge\n0.000000 -0.000019 0.000003 Ge\n-0.000001 0.341638 0.715106 Rh\n0.000005 0.158371 0.215105 Rh\n-0.000006 0.841639 0.784891 Rh\n0.499995 0.835873 0.108867 Rh\n0.500004 0.164132 0.891153 Rh\n0.499997 0.664129 0.608850 Rh\n-0.000000 0.000017 0.500000 Rh\n0.500002 0.335876 0.391128 Rh\n-0.000000 0.500016 0.000000 Rh\n0.000000 0.658373 0.284897 Rh\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Ge",
"Rh"
],
"chemical_system": "Ge-Rh",
"density": 10.403354989682752,
"density_atomic": 0.06842862391722933,
"volume": 233.82027993655788,
"volume_molar": 8.800616489503472,
"formula_full": "Ge6 Rh10",
"formula_reduced": "Ge3Rh5",
"formula_anonymous": "A3B5",
"energy_above_hull": 2.4053066062500004,
"spacegroup": 55
},
{
"id": "jvasp-85486",
"created_at": "2022-09-04T14:35:40.898238Z",
"updated_at": "2022-09-04T14:35:40.898266Z",
"structure_string": "Te2 Pb4 O10\n1.0\n5.335403 -0.000803 2.282050\n1.762926 6.141868 3.255544\n0.012907 -0.048641 7.352156\nTe Pb O\n2 4 10\ndirect\n0.048968 0.216168 0.685748 Te\n0.048995 0.716167 0.185750 Te\n0.381840 0.536009 0.684451 Pb\n0.716064 0.896339 0.687068 Pb\n0.397495 0.035967 0.184814 Pb\n0.700492 0.396378 0.186706 Pb\n0.293103 0.696273 0.315879 O\n0.988795 0.422751 0.814623 O\n0.804900 0.736065 0.055609 O\n0.694557 0.196234 0.815963 O\n0.773440 0.922167 0.315207 O\n0.403375 0.236101 0.555524 O\n0.324546 0.510160 0.056303 O\n0.109140 0.009576 0.556887 O\n0.181631 0.966477 0.935946 O\n0.916327 0.465868 0.435556 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Te",
"Pb",
"O"
],
"chemical_system": "O-Pb-Te",
"density": 8.55702859576828,
"density_atomic": 0.06627894437930723,
"volume": 241.403965465016,
"volume_molar": 9.086054125328157,
"formula_full": "Te2 Pb4 O10",
"formula_reduced": "TePb2O5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 1.8021446133333328,
"spacegroup": 15
},
{
"id": "jvasp-85488",
"created_at": "2022-09-04T14:35:46.682761Z",
"updated_at": "2022-09-04T14:35:46.682779Z",
"structure_string": "Li1 Fe6 Ge4\n1.0\n5.033599 -0.000000 -0.000000\n-2.516800 4.358815 0.050698\n-0.000000 2.830611 6.484966\nLi Fe Ge\n1 6 4\ndirect\n-0.000000 -0.000000 0.500000 Li\n0.599762 0.199522 0.185537 Fe\n0.400238 0.800476 0.814464 Fe\n0.114934 0.714702 0.185545 Fe\n0.885066 0.285296 0.814456 Fe\n0.599768 0.714702 0.185545 Fe\n0.400231 0.285296 0.814456 Fe\n0.873340 0.746680 0.879968 Ge\n0.668563 0.337124 0.494296 Ge\n0.126659 0.253318 0.120033 Ge\n0.331437 0.662874 0.505705 Ge\n",
"nsites": 11,
"nelements": 3,
"elements": [
"Li",
"Fe",
"Ge"
],
"chemical_system": "Fe-Ge-Li",
"density": 7.420173960319631,
"density_atomic": 0.07770489838293433,
"volume": 141.56121723229532,
"volume_molar": 7.7500143302710915,
"formula_full": "Li1 Fe6 Ge4",
"formula_reduced": "Li(Fe3Ge2)2",
"formula_anonymous": "AB4C6",
"energy_above_hull": 2.682072436363636,
"spacegroup": 166
},
{
"id": "jvasp-85489",
"created_at": "2022-09-04T14:35:51.704920Z",
"updated_at": "2022-09-04T14:35:51.704949Z",
"structure_string": "Ba2 Sb4\n1.0\n4.468351 0.000000 0.000000\n0.000000 5.083877 -1.046946\n0.000000 -0.008019 9.482655\nBa Sb\n2 4\ndirect\n0.250000 0.416817 0.286891 Ba\n0.750000 0.583183 0.713109 Ba\n0.250000 0.043244 0.605380 Sb\n0.750000 0.956756 0.394620 Sb\n0.250000 0.826130 0.021184 Sb\n0.750000 0.173870 0.978816 Sb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ba",
"Sb"
],
"chemical_system": "Ba-Sb",
"density": 5.87263494119191,
"density_atomic": 0.02785830078234069,
"volume": 215.37566296230764,
"volume_molar": 21.617042643955585,
"formula_full": "Ba2 Sb4",
"formula_reduced": "BaSb2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.61864939,
"spacegroup": 11
},
{
"id": "jvasp-85491",
"created_at": "2022-09-04T14:36:00.218586Z",
"updated_at": "2022-09-04T14:36:00.218602Z",
"structure_string": "K1 Eu1 Cu2 Te4\n1.0\n4.504288 0.000000 -0.000000\n0.000000 4.504288 -0.000000\n0.000000 0.000000 10.701047\nK Eu Cu Te\n1 1 2 4\ndirect\n0.500000 0.500000 0.513069 K\n0.000000 0.000000 0.985413 Eu\n0.000000 0.500000 0.235966 Cu\n0.500000 0.000000 0.235966 Cu\n0.000000 0.000000 0.369246 Te\n0.000000 0.500000 0.776449 Te\n0.500000 0.500000 0.084643 Te\n0.500000 0.000000 0.776449 Te\n",
"nsites": 8,
"nelements": 4,
"elements": [
"K",
"Eu",
"Cu",
"Te"
],
"chemical_system": "Cu-Eu-K-Te",
"density": 6.3371136996045,
"density_atomic": 0.03684778725964584,
"volume": 217.1093733153759,
"volume_molar": 16.34329008025727,
"formula_full": "K1 Eu1 Cu2 Te4",
"formula_reduced": "KEu(CuTe2)2",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.4108124958333333,
"spacegroup": 99
},
{
"id": "jvasp-85497",
"created_at": "2022-09-04T14:36:10.408636Z",
"updated_at": "2022-09-04T14:36:10.408657Z",
"structure_string": "U1 H2 O4\n1.0\n2.950206 2.957443 -0.002935\n0.633480 2.323612 5.596049\n3.540671 -0.575356 6.277473\nU H O\n1 2 4\ndirect\n0.989044 0.046634 0.953037 U\n0.419978 0.578295 0.948450 H\n0.947073 0.514969 0.957629 H\n0.170394 0.699350 0.933560 O\n0.803648 0.393913 0.972512 O\n0.484790 0.046638 0.953031 O\n0.989620 0.546634 0.453037 O\n",
"nsites": 7,
"nelements": 3,
"elements": [
"U",
"H",
"O"
],
"chemical_system": "H-O-U",
"density": 5.079507305312824,
"density_atomic": 0.0704265467595793,
"volume": 99.39433810231328,
"volume_molar": 8.550952782845169,
"formula_full": "U1 H2 O4",
"formula_reduced": "U(HO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 3.06813,
"spacegroup": 5
},
{
"id": "jvasp-85498",
"created_at": "2022-09-04T14:36:21.441261Z",
"updated_at": "2022-09-04T14:36:21.441282Z",
"structure_string": "La2 H6 O6\n1.0\n6.540951 0.000117 0.000000\n-3.270374 5.664503 0.000000\n0.000000 0.000000 3.841752\nLa H O\n2 6 6\ndirect\n0.333334 0.666669 0.250000 La\n0.666667 0.333331 0.750000 La\n0.865720 0.727262 0.250000 H\n0.861544 0.134269 0.250000 H\n0.272747 0.138470 0.250000 H\n0.134281 0.272738 0.750000 H\n0.138456 0.865731 0.750000 H\n0.727253 0.861530 0.750000 H\n0.918221 0.611261 0.250000 O\n0.693049 0.081772 0.250000 O\n0.388743 0.306969 0.250000 O\n0.081779 0.388739 0.750000 O\n0.306952 0.918228 0.750000 O\n0.611257 0.693031 0.750000 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"La",
"H",
"O"
],
"chemical_system": "H-La-O",
"density": 4.431292359566182,
"density_atomic": 0.09835388464865988,
"volume": 142.34313214989783,
"volume_molar": 6.122931271614044,
"formula_full": "La2 H6 O6",
"formula_reduced": "La(HO)3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 2.4519750714285715,
"spacegroup": 176
},
{
"id": "jvasp-855",
"created_at": "2022-09-04T14:37:43.032061Z",
"updated_at": "2022-09-04T14:37:43.032088Z",
"structure_string": "Cl4\n1.0\n3.747247 -0.162724 0.000000\n-1.364812 3.493655 0.000000\n0.000000 0.000000 8.083979\nCl\n4\ndirect\n0.127891 0.127891 0.107887 Cl\n0.372110 0.372109 0.607887 Cl\n0.627891 0.627890 0.392113 Cl\n0.872110 0.872109 0.892113 Cl\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Cl"
],
"chemical_system": "Cl",
"density": 2.2634724354192737,
"density_atomic": 0.03844794408706017,
"volume": 104.0367721858558,
"volume_molar": 15.663102157981914,
"formula_full": "Cl4",
"formula_reduced": "Cl",
"formula_anonymous": "A",
"energy_above_hull": 4.067500000010105e-06,
"spacegroup": 64
},
{
"id": "jvasp-8550",
"created_at": "2022-09-04T14:37:04.764310Z",
"updated_at": "2022-09-04T14:37:04.764334Z",
"structure_string": "In1 Ni3\n1.0\n3.743186 -0.000000 0.000000\n-0.000000 3.743186 0.000000\n-0.000000 -0.000000 3.743186\nIn Ni\n1 3\ndirect\n0.000000 0.000000 0.000000 In\n0.500001 0.000000 0.500001 Ni\n0.000000 0.500001 0.500001 Ni\n0.500001 0.500001 0.000000 Ni\n",
"nsites": 4,
"nelements": 2,
"elements": [
"In",
"Ni"
],
"chemical_system": "In-Ni",
"density": 9.210133129180923,
"density_atomic": 0.07626684268439501,
"volume": 52.44743140282692,
"volume_molar": 7.8961453602067,
"formula_full": "In1 Ni3",
"formula_reduced": "InNi3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.6430092925,
"spacegroup": 221
},
{
"id": "jvasp-85500",
"created_at": "2022-09-04T14:35:48.004969Z",
"updated_at": "2022-09-04T14:35:48.004991Z",
"structure_string": "Eu2 H6 O6\n1.0\n6.340896 -0.003766 0.000000\n-3.168423 5.494574 0.000000\n0.000000 0.000000 3.626999\nEu H O\n2 6 6\ndirect\n0.333364 0.666727 0.250000 Eu\n0.666636 0.333272 0.750000 Eu\n0.862486 0.726681 0.250000 H\n0.864315 0.137430 0.250000 H\n0.272965 0.135799 0.250000 H\n0.137514 0.273317 0.750000 H\n0.135686 0.862569 0.750000 H\n0.727035 0.864199 0.750000 H\n0.917377 0.607723 0.250000 O\n0.690427 0.082570 0.250000 O\n0.392113 0.309604 0.250000 O\n0.082623 0.392275 0.750000 O\n0.309573 0.917428 0.750000 O\n0.607887 0.690395 0.750000 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Eu",
"H",
"O"
],
"chemical_system": "Eu-H-O",
"density": 5.336566093647104,
"density_atomic": 0.11082677783161902,
"volume": 126.32326116410633,
"volume_molar": 5.433831857089213,
"formula_full": "Eu2 H6 O6",
"formula_reduced": "Eu(HO)3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 2.3910629285714284,
"spacegroup": 176
},
{
"id": "jvasp-85501",
"created_at": "2022-09-04T14:35:55.249260Z",
"updated_at": "2022-09-04T14:35:55.249287Z",
"structure_string": "Mo2 H4 O8\n1.0\n7.940088 -0.036492 0.862087\n-3.010875 5.135868 -1.716958\n0.327279 0.093862 3.730382\nMo H O\n2 4 8\ndirect\n0.800882 0.918067 0.766214 Mo\n0.236160 0.126152 0.152516 Mo\n0.069673 0.657178 0.227772 H\n0.832061 0.447956 0.702855 H\n0.726432 0.422239 0.359005 H\n0.221424 0.529596 0.634686 H\n0.554152 0.741189 0.784286 O\n0.483428 0.258532 0.108302 O\n0.152308 0.080791 0.697134 O\n0.870922 0.905661 0.222030 O\n0.845036 0.233941 0.875819 O\n0.173760 0.774071 0.075968 O\n0.825286 0.548924 0.546396 O\n0.210381 0.422112 0.375488 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mo",
"H",
"O"
],
"chemical_system": "H-Mo-O",
"density": 3.5544618637919387,
"density_atomic": 0.09251933810896187,
"volume": 151.3197163549951,
"volume_molar": 6.509061654664676,
"formula_full": "Mo2 H4 O8",
"formula_reduced": "Mo(HO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 3.1604857,
"spacegroup": 1
}
]
}