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=4567",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=4565",
"results": [
{
"id": "jvasp-98461",
"created_at": "2022-09-04T14:36:14.594477Z",
"updated_at": "2022-09-04T14:36:14.594511Z",
"structure_string": "Ba8 Si4 O16\n1.0\n5.838222 0.000000 0.000000\n0.000000 7.571656 0.000000\n0.000000 0.000000 10.295931\nBa Si O\n8 4 16\ndirect\n0.750000 0.840319 0.914909 Ba\n0.750000 0.340318 0.585091 Ba\n0.250000 0.659682 0.414909 Ba\n0.750000 0.008531 0.306368 Ba\n0.250000 0.991469 0.693632 Ba\n0.750000 0.508531 0.193632 Ba\n0.250000 0.491469 0.806368 Ba\n0.250000 0.159682 0.085091 Ba\n0.750000 0.771518 0.579929 Si\n0.250000 0.228483 0.420071 Si\n0.750000 0.271517 0.920071 Si\n0.250000 0.728483 0.079929 Si\n0.250000 0.511437 0.084330 O\n0.750000 0.488563 0.915670 O\n0.981517 0.192358 0.849153 O\n0.750000 0.692094 0.429170 O\n0.250000 0.307906 0.570830 O\n0.750000 0.192094 0.070830 O\n0.250000 0.807907 0.929169 O\n0.981517 0.692358 0.650847 O\n0.481517 0.307642 0.349153 O\n0.518483 0.192358 0.849153 O\n0.018483 0.807643 0.150847 O\n0.018483 0.307642 0.349153 O\n0.518483 0.692358 0.650847 O\n0.481517 0.807643 0.150847 O\n0.750000 0.988563 0.584329 O\n0.250000 0.011437 0.415670 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Ba",
"Si",
"O"
],
"chemical_system": "Ba-O-Si",
"density": 5.3521321991933055,
"density_atomic": 0.06152065181451842,
"volume": 455.1317187668712,
"volume_molar": 9.78881169555297,
"formula_full": "Ba8 Si4 O16",
"formula_reduced": "Ba2SiO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.5436206485714283,
"spacegroup": 62
},
{
"id": "jvasp-98462",
"created_at": "2022-09-04T14:36:16.657362Z",
"updated_at": "2022-09-04T14:36:16.657383Z",
"structure_string": "Ta10 Ge6\n1.0\n4.880642 0.000000 1.775559\n2.440321 7.183803 0.887780\n-0.015646 0.000000 7.638723\nTa Ge\n10 6\ndirect\n0.276001 0.149628 0.298369 Ta\n0.723997 0.850372 0.701631 Ta\n0.425629 0.298369 0.850372 Ta\n0.574370 0.701631 0.149628 Ta\n0.925629 0.850372 0.298369 Ta\n0.223997 0.701631 0.850372 Ta\n0.776001 0.298369 0.149628 Ta\n0.074370 0.149628 0.701631 Ta\n0.749999 0.500000 0.500000 Ta\n0.249999 0.500000 0.500000 Ta\n0.833029 0.500000 0.833941 Ge\n0.666970 0.166059 0.500000 Ge\n0.333029 0.833940 0.500000 Ge\n0.166970 0.500000 0.166059 Ge\n0.750000 -0.000000 0.000000 Ge\n0.250000 -0.000000 0.000000 Ge\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Ta",
"Ge"
],
"chemical_system": "Ge-Ta",
"density": 13.910780233961582,
"density_atomic": 0.05969588046333015,
"volume": 268.0251949684944,
"volume_molar": 10.088034070791982,
"formula_full": "Ta10 Ge6",
"formula_reduced": "Ta5Ge3",
"formula_anonymous": "A3B5",
"energy_above_hull": 5.19965423125,
"spacegroup": 140
},
{
"id": "jvasp-98464",
"created_at": "2022-09-04T14:36:18.661450Z",
"updated_at": "2022-09-04T14:36:18.661482Z",
"structure_string": "Ta4 Pd6 Se16\n1.0\n3.596523 0.000000 0.000000\n0.000000 10.793212 0.000000\n0.000000 -0.000000 15.385684\nTa Pd Se\n4 6 16\ndirect\n0.500000 0.785500 0.882508 Ta\n0.500000 0.285500 0.617491 Ta\n0.500000 0.714500 0.382508 Ta\n0.500000 0.214500 0.117491 Ta\n0.000000 0.000000 0.000000 Pd\n0.000000 0.500000 0.500000 Pd\n0.000000 0.622251 0.783978 Pd\n0.000000 0.377749 0.216022 Pd\n0.000000 0.122251 0.716021 Pd\n0.000000 0.877749 0.283978 Pd\n0.000000 0.043921 0.156800 Se\n0.000000 0.956079 0.843200 Se\n0.000000 0.730884 0.507753 Se\n0.500000 0.954158 0.384082 Se\n0.000000 0.769115 0.007754 Se\n0.000000 0.456079 0.656800 Se\n0.000000 0.543921 0.343200 Se\n0.500000 0.752300 0.716486 Se\n0.500000 0.247700 0.283513 Se\n0.500000 0.252300 0.783513 Se\n0.500000 0.747700 0.216486 Se\n0.500000 0.545841 0.884082 Se\n0.500000 0.454158 0.115918 Se\n0.500000 0.045842 0.615918 Se\n0.000000 0.230884 -0.007754 Se\n0.000000 0.269115 0.492246 Se\n",
"nsites": 26,
"nelements": 3,
"elements": [
"Ta",
"Pd",
"Se"
],
"chemical_system": "Pd-Se-Ta",
"density": 7.300273534445024,
"density_atomic": 0.04353344037030225,
"volume": 597.2420231169403,
"volume_molar": 13.833367426913032,
"formula_full": "Ta4 Pd6 Se16",
"formula_reduced": "Ta2Pd3Se8",
"formula_anonymous": "A2B3C8",
"energy_above_hull": 2.745681725641025,
"spacegroup": 55
},
{
"id": "jvasp-98466",
"created_at": "2022-09-04T14:36:20.009551Z",
"updated_at": "2022-09-04T14:36:20.009570Z",
"structure_string": "K6 Sm2 P4 O16\n1.0\n5.645358 0.000000 0.000000\n0.000000 7.392253 -0.103147\n0.000000 0.013352 9.502261\nK Sm P O\n6 2 4 16\ndirect\n0.250000 0.800324 0.917787 K\n0.750000 0.199676 0.082213 K\n0.750000 0.634596 0.408255 K\n0.250000 0.365403 0.591745 K\n0.750000 0.493047 0.808845 K\n0.250000 0.506953 0.191155 K\n0.750000 0.993148 0.708625 Sm\n0.250000 0.006851 0.291375 Sm\n0.250000 0.806048 0.574258 P\n0.250000 0.234785 0.912597 P\n0.750000 0.765214 0.087403 P\n0.750000 0.193951 0.425741 P\n0.025872 0.154781 0.838394 O\n0.250000 0.441430 0.898974 O\n0.750000 0.558569 0.101025 O\n0.474925 0.749277 0.657392 O\n0.974925 0.250723 0.342608 O\n0.525075 0.250723 0.342608 O\n0.025075 0.749277 0.657392 O\n0.250000 0.013305 0.550471 O\n0.750000 0.986695 0.449528 O\n0.250000 0.715112 0.425163 O\n0.750000 0.284887 0.574837 O\n0.525872 0.845218 0.161605 O\n0.974128 0.845218 0.161605 O\n0.474128 0.154781 0.838394 O\n0.250000 0.176196 0.069487 O\n0.750000 0.823803 0.930513 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"K",
"Sm",
"P",
"O"
],
"chemical_system": "K-O-P-Sm",
"density": 3.8322962469654986,
"density_atomic": 0.07060805546864031,
"volume": 396.55531956174394,
"volume_molar": 8.528971262598583,
"formula_full": "K6 Sm2 P4 O16",
"formula_reduced": "K3Sm(PO4)2",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 1.919725133928572,
"spacegroup": 11
},
{
"id": "jvasp-98467",
"created_at": "2022-09-04T14:36:21.625945Z",
"updated_at": "2022-09-04T14:36:21.625972Z",
"structure_string": "Dy8 B12 O30\n1.0\n4.387204 0.000000 -0.000000\n-2.193602 5.811774 -0.675845\n-0.000000 0.010379 18.839852\nDy B O\n8 12 30\ndirect\n0.648434 0.725488 0.695934 Dy\n0.351566 0.274511 0.304066 Dy\n0.077054 0.725488 0.195934 Dy\n0.927618 0.267909 0.599128 Dy\n0.659709 0.732090 0.900872 Dy\n0.072382 0.732090 0.400872 Dy\n0.340291 0.267909 0.099128 Dy\n0.922945 0.274511 0.804066 Dy\n0.801432 0.191247 0.412847 B\n0.610185 0.808752 0.087154 B\n0.022657 0.663449 0.025273 B\n0.389814 0.191247 0.912846 B\n0.201297 0.863742 0.805295 B\n0.337554 0.136257 0.694705 B\n0.798702 0.136257 0.194705 B\n0.198567 0.808752 0.587154 B\n0.640792 0.663449 0.525273 B\n0.977342 0.336550 0.974727 B\n0.359207 0.336550 0.474727 B\n0.662445 0.863742 0.305295 B\n0.083525 0.642339 0.638828 O\n0.810069 0.969903 0.378977 O\n0.751652 0.745044 0.020799 O\n0.870314 0.000000 0.250000 O\n0.052461 0.363055 0.204145 O\n0.689406 0.636944 0.295855 O\n0.947538 0.636944 0.795855 O\n0.310594 0.363055 0.704145 O\n0.248348 0.254955 0.979201 O\n0.993392 0.745044 0.520799 O\n0.129685 0.000000 0.750000 O\n0.006608 0.254955 0.479201 O\n0.456229 0.166278 0.430636 O\n0.441185 0.357661 0.861172 O\n0.558814 0.642338 0.138829 O\n0.505655 0.420004 0.549997 O\n0.085651 0.579996 0.950003 O\n0.494344 0.579996 0.450003 O\n0.914348 0.420004 0.049997 O\n0.189930 0.030096 0.621023 O\n0.159834 0.969903 0.878977 O\n0.916475 0.357661 0.361172 O\n0.840166 0.030096 0.121023 O\n0.530458 0.869572 0.802851 O\n0.660885 0.130427 0.697149 O\n0.339114 0.869572 0.302851 O\n0.543770 0.833721 0.569364 O\n0.710049 0.166278 0.930636 O\n0.289951 0.833721 0.069364 O\n0.469541 0.130427 0.197149 O\n",
"nsites": 50,
"nelements": 3,
"elements": [
"Dy",
"B",
"O"
],
"chemical_system": "B-Dy-O",
"density": 6.601088781852195,
"density_atomic": 0.10408020736955516,
"volume": 480.398735395157,
"volume_molar": 5.78605761095126,
"formula_full": "Dy8 B12 O30",
"formula_reduced": "Dy4(B2O5)3",
"formula_anonymous": "A4B6C15",
"energy_above_hull": 3.38180656,
"spacegroup": 15
},
{
"id": "jvasp-9847",
"created_at": "2022-09-04T14:38:10.037599Z",
"updated_at": "2022-09-04T14:38:10.037633Z",
"structure_string": "Ca4 V4 O8\n1.0\n3.068166 0.006099 0.001879\n1.526574 8.624438 -0.435374\n1.529160 0.068035 8.325349\nCa V O\n4 4 8\ndirect\n0.383302 0.311355 0.923205 Ca\n0.592639 0.716842 0.096879 Ca\n0.837042 0.089758 0.238723 Ca\n0.138903 0.938441 0.781363 Ca\n0.831872 0.600767 0.735109 V\n0.587858 0.248565 0.577608 V\n0.388147 0.779641 0.442478 V\n0.144044 0.427440 0.284970 V\n0.547204 0.570395 0.334877 O\n0.790489 0.801853 0.615398 O\n0.185468 0.226351 0.404687 O\n0.428719 0.457807 0.685211 O\n0.210693 0.688878 0.888892 O\n0.036517 0.194770 0.734446 O\n0.765237 0.339323 0.131190 O\n0.939469 0.833429 0.285637 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ca",
"V",
"O"
],
"chemical_system": "Ca-O-V",
"density": 3.7093415573450796,
"density_atomic": 0.07263367155283165,
"volume": 220.28350843261526,
"volume_molar": 8.2911143430491,
"formula_full": "Ca4 V4 O8",
"formula_reduced": "CaVO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.611625405,
"spacegroup": 12
},
{
"id": "jvasp-98470",
"created_at": "2022-09-04T14:35:42.244529Z",
"updated_at": "2022-09-04T14:35:42.244555Z",
"structure_string": "Li12 W6 O24\n1.0\n8.478574 -0.002879 -2.720794\n-3.729773 7.614133 -2.720794\n-0.001796 -0.002879 8.904434\nLi W O\n12 6 24\ndirect\n0.066700 0.297407 0.894373 Li\n0.630411 0.224891 0.390723 Li\n0.390722 0.630410 0.224891 Li\n0.775108 0.609276 0.369590 Li\n0.609277 0.369589 0.775108 Li\n0.224891 0.390723 0.630411 Li\n0.369589 0.775108 0.609277 Li\n0.702592 0.105626 0.933298 Li\n0.933298 0.702593 0.105627 Li\n0.894373 0.066701 0.297406 Li\n0.297406 0.894373 0.066701 Li\n0.105626 0.933298 0.702594 Li\n0.730148 0.966176 0.555595 W\n0.269851 0.033823 0.444404 W\n0.555595 0.730149 0.966178 W\n0.966176 0.555594 0.730149 W\n0.033823 0.444405 0.269851 W\n0.444405 0.269851 0.033823 W\n0.218346 0.182067 0.878758 O\n0.576623 0.248487 0.918680 O\n0.918680 0.576624 0.248488 O\n0.248488 0.918680 0.576624 O\n0.423376 0.751512 0.081321 O\n0.781653 0.817932 0.121243 O\n0.751512 0.081319 0.423376 O\n0.457762 0.140160 0.153383 O\n0.153383 0.457763 0.140160 O\n0.140160 0.153382 0.457763 O\n0.542236 0.859839 0.846617 O\n0.503451 0.811952 0.470940 O\n0.811952 0.470940 0.503451 O\n0.470939 0.503450 0.811952 O\n0.496549 0.188047 0.529060 O\n0.188047 0.529059 0.496548 O\n0.529061 0.496549 0.188048 O\n0.817932 0.121242 0.781653 O\n0.121242 0.781653 0.817933 O\n0.846616 0.542236 0.859840 O\n0.081319 0.423376 0.751513 O\n0.878756 0.218346 0.182067 O\n0.859839 0.846617 0.542237 O\n0.182066 0.878758 0.218347 O\n",
"nsites": 42,
"nelements": 3,
"elements": [
"Li",
"W",
"O"
],
"chemical_system": "Li-O-W",
"density": 4.537949347568518,
"density_atomic": 0.07309241959553764,
"volume": 574.6149906161287,
"volume_molar": 8.239077038800966,
"formula_full": "Li12 W6 O24",
"formula_reduced": "Li2WO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.745902,
"spacegroup": 148
},
{
"id": "jvasp-98471",
"created_at": "2022-09-04T14:35:43.185293Z",
"updated_at": "2022-09-04T14:35:43.185320Z",
"structure_string": "Ba2 Mo2 O8\n1.0\n5.626140 -0.000000 -0.000000\n0.000000 5.626140 0.000000\n-2.813070 -2.813070 6.423437\nBa Mo O\n2 2 8\ndirect\n0.125000 0.375000 0.250000 Ba\n0.875000 0.625000 0.750000 Ba\n0.625000 0.875000 0.250000 Mo\n0.375000 0.125000 0.750000 Mo\n0.781076 0.918053 0.095108 O\n0.314032 0.677055 0.095108 O\n0.418053 0.814032 0.595108 O\n0.177055 0.281076 0.595108 O\n0.218924 0.081947 0.904892 O\n0.685968 0.322945 0.904892 O\n0.581947 0.185968 0.404892 O\n0.822945 0.718924 0.404892 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ba",
"Mo",
"O"
],
"chemical_system": "Ba-Mo-O",
"density": 4.855497650884848,
"density_atomic": 0.05901911695556642,
"volume": 203.32395025554874,
"volume_molar": 10.20371206931794,
"formula_full": "Ba2 Mo2 O8",
"formula_reduced": "BaMoO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.3814993116666665,
"spacegroup": 88
},
{
"id": "jvasp-98473",
"created_at": "2022-09-04T14:35:44.702762Z",
"updated_at": "2022-09-04T14:35:44.702787Z",
"structure_string": "Ba2 Co2 P4 O14\n1.0\n5.337110 0.079890 -0.132058\n-0.614607 7.115121 -1.501083\n-0.099164 -0.128155 7.620346\nBa Co P O\n2 2 4 14\ndirect\n0.795589 0.227201 0.071631 Ba\n0.204412 0.772798 0.928371 Ba\n0.202170 0.613344 0.395396 Co\n0.797829 0.386655 0.604606 Co\n0.707828 0.814319 0.598215 P\n0.292171 0.185680 0.401785 P\n0.294858 0.269354 0.788439 P\n0.705141 0.730646 0.211561 P\n0.461894 0.603526 0.201916 O\n0.295888 0.152479 0.930423 O\n0.704113 0.847520 0.069578 O\n0.564903 0.267842 0.396735 O\n0.060222 0.384706 0.800692 O\n0.270949 0.123341 0.592805 O\n0.729052 0.876659 0.407196 O\n0.892836 0.654077 0.589067 O\n0.107163 0.345922 0.410933 O\n0.211381 0.017070 0.255097 O\n0.788620 0.982928 0.744903 O\n0.435098 0.732158 0.603265 O\n0.939779 0.615293 0.199309 O\n0.538105 0.396473 0.798085 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Ba",
"Co",
"P",
"O"
],
"chemical_system": "Ba-Co-O-P",
"density": 4.259659346569766,
"density_atomic": 0.07622157422526658,
"volume": 288.6321913921748,
"volume_molar": 7.9008349292315305,
"formula_full": "Ba2 Co2 P4 O14",
"formula_reduced": "BaCoP2O7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 2.630716579090909,
"spacegroup": 2
},
{
"id": "jvasp-98474",
"created_at": "2022-09-04T14:35:46.224622Z",
"updated_at": "2022-09-04T14:35:46.224647Z",
"structure_string": "Li1 La4 Ni1 O8\n1.0\n4.914294 0.000000 -2.024847\n0.000000 5.315423 0.000000\n0.001006 0.000000 6.978349\nLi La Ni O\n1 4 1 8\ndirect\n0.500000 0.000000 -0.000000 Li\n0.364106 0.500000 0.728212 La\n0.635894 0.500000 0.271788 La\n0.137176 0.000000 0.274353 La\n0.862824 0.000000 0.725647 La\n0.000000 0.500000 0.000000 Ni\n0.176523 0.500000 0.353046 O\n0.320248 0.000000 0.640496 O\n0.679752 0.000000 0.359504 O\n0.823477 0.500000 0.646954 O\n0.753029 0.744633 -0.000000 O\n0.246970 0.255367 -0.000000 O\n0.246970 0.744633 -0.000000 O\n0.753029 0.255367 -0.000000 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"La",
"Ni",
"O"
],
"chemical_system": "La-Li-Ni-O",
"density": 6.824946630236045,
"density_atomic": 0.07679811993345916,
"volume": 182.29612928194257,
"volume_molar": 7.841521075278685,
"formula_full": "Li1 La4 Ni1 O8",
"formula_reduced": "LiLa4NiO8",
"formula_anonymous": "ABC4D8",
"energy_above_hull": 2.2984507428571432,
"spacegroup": 65
},
{
"id": "jvasp-98475",
"created_at": "2022-09-04T14:35:47.204228Z",
"updated_at": "2022-09-04T14:35:47.204246Z",
"structure_string": "Ca2 Mn2 Si4 O12\n1.0\n5.196130 -0.021263 0.999014\n1.186152 6.622948 0.601187\n-0.023994 0.025241 6.755043\nCa Mn Si O\n2 2 4 12\ndirect\n0.750001 0.302589 0.697411 Ca\n0.250000 0.697411 0.302588 Ca\n0.250000 0.095700 0.904300 Mn\n0.749999 0.904301 0.095699 Mn\n0.734105 0.805628 0.619746 Si\n0.765895 0.380255 0.194371 Si\n0.234106 0.619746 0.805628 Si\n0.265895 0.194371 0.380255 Si\n0.152404 0.786536 0.973542 O\n0.347598 0.026459 0.213464 O\n0.509603 0.326487 0.372450 O\n0.668563 0.608621 0.117800 O\n0.831435 0.882202 0.391380 O\n0.331436 0.391380 0.882201 O\n0.168564 0.117800 0.608620 O\n0.009602 0.372451 0.326487 O\n0.490398 0.673515 0.627549 O\n-0.009603 0.627550 0.673515 O\n0.847597 0.213465 0.026459 O\n0.652403 0.973542 0.786535 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Ca",
"Mn",
"Si",
"O"
],
"chemical_system": "Ca-Mn-O-Si",
"density": 3.527079927876568,
"density_atomic": 0.08593039798754981,
"volume": 232.7465072708931,
"volume_molar": 7.008161140918409,
"formula_full": "Ca2 Mn2 Si4 O12",
"formula_reduced": "CaMn(SiO3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.659616586137931,
"spacegroup": 15
},
{
"id": "jvasp-98477",
"created_at": "2022-09-04T14:35:49.683364Z",
"updated_at": "2022-09-04T14:35:49.683391Z",
"structure_string": "Yb20 Si16\n1.0\n7.434637 -0.000000 0.000000\n-0.000000 7.797421 0.000000\n0.000000 0.000000 15.335237\nYb Si\n20 16\ndirect\n0.817213 0.318878 0.622675 Yb\n0.317212 0.181122 0.622675 Yb\n0.817213 0.318878 0.877325 Yb\n0.182788 0.681122 0.377325 Yb\n0.682788 0.818878 0.122675 Yb\n0.970100 0.820796 0.597413 Yb\n0.470100 0.679204 0.902588 Yb\n0.682788 0.818878 0.377325 Yb\n0.529900 0.320796 0.402588 Yb\n0.029900 0.179204 0.402588 Yb\n0.529900 0.320796 0.097413 Yb\n0.470100 0.679204 0.597413 Yb\n0.970100 0.820796 0.902588 Yb\n0.359423 0.008693 0.250000 Yb\n0.859424 0.491307 0.250000 Yb\n0.029900 0.179204 0.097413 Yb\n0.182788 0.681122 0.122675 Yb\n0.640577 0.991307 0.750000 Yb\n0.317212 0.181122 0.877325 Yb\n0.140577 0.508693 0.750000 Yb\n0.360297 0.974486 0.037055 Si\n0.639703 0.025514 0.537055 Si\n0.139703 0.474486 0.962945 Si\n0.139703 0.474486 0.537055 Si\n0.639703 0.025514 0.962945 Si\n0.360297 0.974486 0.462945 Si\n0.860297 0.525514 0.037055 Si\n0.973556 0.904476 0.250000 Si\n0.526445 0.404476 0.750000 Si\n0.026445 0.095524 0.750000 Si\n0.251148 0.378097 0.250000 Si\n0.751148 0.121903 0.250000 Si\n0.248852 0.878097 0.750000 Si\n0.748853 0.621903 0.750000 Si\n0.473556 0.595524 0.250000 Si\n0.860297 0.525514 0.462945 Si\n",
"nsites": 36,
"nelements": 2,
"elements": [
"Yb",
"Si"
],
"chemical_system": "Si-Yb",
"density": 7.3037057877483385,
"density_atomic": 0.04049498630727107,
"volume": 888.9989424082364,
"volume_molar": 14.871324351870925,
"formula_full": "Yb20 Si16",
"formula_reduced": "Yb5Si4",
"formula_anonymous": "A4B5",
"energy_above_hull": 1.0747186555555552,
"spacegroup": 62
}
]
}