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{
"id": "mp-1212343",
"created_at": "2022-09-04T14:45:30.809591Z",
"structure_string": "Li66 Cu63 Si42\n1.0\n0.000000 0.000000 -13.572671\n-7.014121 -12.148813 -0.000000\n-7.014121 12.148813 0.000000\nLi Cu Si\n66 63 42\ndirect\n0.187105 0.850764 0.960287 Li\n0.853772 0.109524 0.149236 Li\n0.520438 0.039713 0.890476 Li\n0.256628 0.516324 0.626438 Li\n0.923295 0.110114 0.483676 Li\n0.589961 0.373562 0.889886 Li\n0.108057 0.702591 0.738335 Li\n0.774724 0.035745 0.297409 Li\n0.441390 0.261665 0.964255 Li\n0.374306 0.915131 0.961704 Li\n0.040973 0.046573 0.084869 Li\n0.707639 0.038296 0.953427 Li\n0.824748 0.595989 0.075124 Li\n0.491415 0.479134 0.404011 Li\n0.158081 0.924876 0.520866 Li\n0.830024 0.252480 0.402658 Li\n0.496691 0.150179 0.747520 Li\n0.163357 0.597342 0.849821 Li\n0.104509 0.924582 0.187328 Li\n0.771176 0.262746 0.075418 Li\n0.437842 0.812672 0.737254 Li\n0.504043 0.842021 0.077595 Li\n0.170710 0.235574 0.157979 Li\n0.837376 0.922405 0.764426 Li\n0.891743 0.382944 0.629173 Li\n0.558410 0.246229 0.617056 Li\n0.225076 0.370827 0.753771 Li\n0.762738 0.567452 0.739164 Li\n0.429405 0.171712 0.432548 Li\n0.096071 0.260836 0.828288 Li\n0.491558 0.919555 0.629978 Li\n0.158225 0.710424 0.080445 Li\n0.824891 0.370022 0.289576 Li\n0.440620 0.919918 0.300732 Li\n0.107287 0.380813 0.080082 Li\n0.773953 0.699268 0.619187 Li\n0.761823 0.902837 0.415185 Li\n0.428490 0.512348 0.097163 Li\n0.095156 0.584815 0.487652 Li\n0.437120 0.570941 0.623755 Li\n0.103787 0.052815 0.429059 Li\n0.770453 0.376245 0.947185 Li\n0.826018 0.718123 0.960520 Li\n0.492685 0.242398 0.281877 Li\n0.159351 0.039480 0.757602 Li\n0.703545 0.906339 0.072493 Li\n0.370212 0.166155 0.093661 Li\n0.036878 0.927507 0.833845 Li\n0.562414 0.836218 0.408457 Li\n0.229081 0.572239 0.163782 Li\n0.895747 0.591543 0.427761 Li\n0.490124 0.605063 0.969104 Li\n0.156791 0.364042 0.394937 Li\n0.823457 0.030896 0.635958 Li\n0.561781 0.499891 0.736994 Li\n0.228448 0.237103 0.500109 Li\n0.895114 0.263006 0.762897 Li\n0.742857 0.181960 0.560327 Li\n0.409524 0.378368 0.818040 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Cu\n0.616893 0.039238 0.416131 Cu\n0.283559 0.376892 0.960762 Cu\n0.350044 0.869249 0.458420 Cu\n0.016711 0.589171 0.130751 Cu\n0.683377 0.541580 0.410829 Cu\n0.691899 0.706554 0.247375 Cu\n0.358566 0.540821 0.293446 Cu\n0.025232 0.752625 0.459179 Cu\n0.922514 0.757623 0.799232 Cu\n0.589181 0.041610 0.242377 Cu\n0.255847 0.200768 0.958390 Cu\n0.466196 0.706537 0.848055 Cu\n0.132863 0.141518 0.293463 Cu\n0.799529 0.151945 0.858482 Cu\n0.986310 0.248124 0.281976 Cu\n0.652977 0.033851 0.751876 Cu\n0.319643 0.718024 0.966149 Cu\n0.520986 0.713521 0.194349 Cu\n0.187653 0.480828 0.286479 Cu\n0.854319 0.805651 0.519172 Cu\n0.679807 0.538735 0.905688 Cu\n0.346474 0.366953 0.461265 Cu\n0.013140 0.094312 0.633047 Cu\n0.798126 0.818938 0.191210 Cu\n0.464793 0.372272 0.181062 Cu\n0.131459 0.808790 0.627728 Cu\n0.352103 0.538319 0.794238 Cu\n0.018770 0.255918 0.461681 Cu\n0.685436 0.205762 0.744082 Cu\n0.678210 0.865333 0.575455 Cu\n0.344877 0.710122 0.134667 Cu\n0.011543 0.424545 0.289878 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Si\n0.640205 0.868709 0.747423 Si\n0.965849 0.921362 0.469185 Si\n0.632516 0.547823 0.078638 Si\n0.299182 0.530815 0.452177 Si\n0.713548 0.370680 0.744685 Si\n0.380215 0.374006 0.629320 Si\n0.046881 0.255315 0.625994 Si\n0.963952 0.583816 0.788650 Si\n0.630619 0.204835 0.416184 Si\n0.297285 0.211350 0.795165 Si\n0.717515 0.704495 0.409253 Si\n0.384182 0.704758 0.295505 Si\n0.050848 0.590747 0.295242 Si\n0.969615 0.418859 0.456165 Si\n0.636282 0.037306 0.581141 Si\n0.302948 0.543835 0.962694 Si\n",
"nsites": 171,
"nelements": 3,
"elements": [
"Li",
"Cu",
"Si"
],
"chemical_system": "Cu-Li-Si",
"density": 4.049581022556662,
"density_atomic": 0.07392540149819063,
"volume": 2313.1426618519663,
"volume_molar": 8.146240179902705,
"formula_full": "Li66 Cu63 Si42",
"formula_reduced": "Li22(Cu3Si2)7",
"formula_anonymous": "A14B21C22",
"energy": -657.58465945,
"energy_per_atom": -3.845524324269006,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -660.56665945,
"band_gap": 0.0514000000000001,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 2.23e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:03.137000Z",
"spacegroup": 144
},
{
"id": "mp-1250551",
"created_at": "2022-09-04T14:45:23.568281Z",
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