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{
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"structure_string": "Li2 Cr8 P14 O48\n1.0\n10.105656 0.000000 0.000000\n-2.638484 9.899858 0.000000\n-3.889380 -4.590475 8.840954\nLi Cr P O\n2 8 14 48\ndirect\n0.552013 0.245802 0.671182 Li\n0.447987 0.754198 0.328818 Li\n0.511664 0.663546 0.884432 Cr\n0.003129 0.387754 0.074722 Cr\n0.986257 0.830895 0.412328 Cr\n0.500164 0.104881 0.255601 Cr\n0.013743 0.169105 0.587672 Cr\n0.996871 0.612246 0.925278 Cr\n0.499836 0.895119 0.744399 Cr\n0.488336 0.336454 0.115568 Cr\n0.747775 0.540647 0.050993 P\n0.734001 0.179546 0.116712 P\n0.252225 0.459353 0.949007 P\n0.806666 0.374361 0.566712 P\n0.249072 0.391343 0.522745 P\n0.198126 0.939896 0.261158 P\n0.265999 0.820454 0.883288 P\n0.193334 0.625639 0.433288 P\n0.262003 0.036101 0.758488 P\n0.737997 0.963899 0.241512 P\n0.750928 0.608657 0.477255 P\n0.226367 0.219743 0.225266 P\n0.801874 0.060104 0.738842 P\n0.773633 0.780257 0.774734 P\n0.347389 0.435864 0.083311 O\n0.112186 0.257150 0.126531 O\n0.867527 0.210638 0.873730 O\n0.652611 0.564136 0.916689 O\n0.863777 0.944379 0.797116 O\n0.336303 0.175096 0.906381 O\n0.621356 0.980988 0.657861 O\n0.663697 0.824904 0.093619 O\n0.126761 0.500534 0.990837 O\n0.911924 0.302307 0.536895 O\n0.136223 0.055621 0.202884 O\n0.881871 0.974948 0.372303 O\n0.634659 0.780742 0.802765 O\n0.370483 0.724786 0.534346 O\n0.814868 0.107495 0.219449 O\n0.309865 0.339080 0.401374 O\n0.132473 0.789362 0.126270 O\n0.088076 0.697693 0.463105 O\n0.185132 0.892505 0.780551 O\n0.870061 0.320922 0.160199 O\n0.690135 0.660920 0.598626 O\n0.129939 0.679078 0.839801 O\n0.633019 0.403517 0.044018 O\n0.835203 0.678678 0.205063 O\n0.366981 0.596483 0.955982 O\n0.166891 0.564305 0.271704 O\n0.604804 0.507296 0.327811 O\n0.356787 0.936666 0.046978 O\n0.851331 0.064784 0.623222 O\n0.622829 0.987866 0.298939 O\n0.148669 0.935216 0.376778 O\n0.873239 0.499466 0.009163 O\n0.887814 0.742850 0.873469 O\n0.849192 0.519883 0.530456 O\n0.377171 0.012134 0.701061 O\n0.621516 0.220040 0.177622 O\n0.395196 0.492704 0.672189 O\n0.365341 0.219258 0.197235 O\n0.118129 0.025052 0.627697 O\n0.150808 0.480117 0.469544 O\n0.378484 0.779960 0.822378 O\n0.164797 0.321322 0.794937 O\n0.853249 0.754638 0.493833 O\n0.378644 0.019012 0.342139 O\n0.629517 0.275214 0.465654 O\n0.146751 0.245362 0.506167 O\n0.833109 0.435695 0.728296 O\n0.643213 0.063334 0.953022 O\n",
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"elements": [
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"formula_full": "Li2 Cr8 P14 O48",
"formula_reduced": "LiCr4P7O24",
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"energy_per_atom": -8.063315192638889,
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"formation_energy": null,
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"energy_uncorrected": -531.59069387,
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"total_magnetization": 23.9992202,
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"updated_at": "2021-11-28T01:34:59.344000Z",
"spacegroup": 2
},
{
"id": "mp-759361",
"created_at": "2022-09-04T14:40:56.179043Z",
"structure_string": "Fe4 P16 O44\n1.0\n22.641990 0.000000 0.000000\n0.000000 5.476418 0.000000\n0.000000 2.515516 7.132975\nFe P O\n4 16 44\ndirect\n0.886905 0.997493 0.872031 Fe\n0.613095 0.997493 0.372031 Fe\n0.386905 0.002507 0.627969 Fe\n0.113095 0.002507 0.127969 Fe\n0.572316 0.689979 0.818230 P\n0.195842 0.596929 0.965010 P\n0.178709 0.668044 0.552617 P\n0.966433 0.594738 0.708971 P\n0.927684 0.689979 0.318230 P\n0.304158 0.596929 0.465010 P\n0.466433 0.405262 0.791029 P\n0.678709 0.331956 0.947383 P\n0.321291 0.668044 0.052617 P\n0.533567 0.594738 0.208971 P\n0.695842 0.403071 0.534990 P\n0.072316 0.310021 0.681770 P\n0.033567 0.405262 0.291029 P\n0.821291 0.331956 0.447383 P\n0.804158 0.403071 0.034990 P\n0.427684 0.310021 0.181770 P\n0.344580 0.900638 0.907012 O\n0.575114 0.919177 0.647757 O\n0.545621 0.763359 0.986225 O\n0.956826 0.775332 0.815030 O\n0.835916 0.652992 0.981780 O\n0.155420 0.900638 0.407012 O\n0.195016 0.730234 0.735228 O\n0.317698 0.805445 0.543934 O\n0.437578 0.661820 0.747339 O\n0.266507 0.530689 0.995920 O\n0.636309 0.577875 0.887295 O\n0.924886 0.919177 0.147757 O\n0.954379 0.763359 0.486225 O\n0.543174 0.775332 0.315030 O\n0.038524 0.556769 0.696505 O\n0.664084 0.652992 0.481780 O\n0.304984 0.730234 0.235228 O\n0.182302 0.805445 0.043934 O\n0.538524 0.443231 0.803495 O\n0.062422 0.661820 0.247339 O\n0.233493 0.530689 0.495920 O\n0.863691 0.577875 0.387295 O\n0.136309 0.422125 0.612705 O\n0.766507 0.469311 0.504080 O\n0.937578 0.338180 0.752661 O\n0.461476 0.556769 0.196505 O\n0.817698 0.194555 0.956066 O\n0.695016 0.269766 0.764772 O\n0.335916 0.347008 0.518220 O\n0.961476 0.443231 0.303495 O\n0.456826 0.224668 0.684970 O\n0.045621 0.236641 0.513775 O\n0.075114 0.080823 0.852243 O\n0.363691 0.422125 0.112705 O\n0.733493 0.469311 0.004080 O\n0.562422 0.338180 0.252661 O\n0.682302 0.194555 0.456066 O\n0.804984 0.269766 0.264772 O\n0.844580 0.099362 0.592988 O\n0.164084 0.347008 0.018220 O\n0.043174 0.224668 0.184970 O\n0.454379 0.236641 0.013775 O\n0.424886 0.080823 0.352243 O\n0.655420 0.099362 0.092988 O\n",
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}
]
}