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{
"id": "mp-21974",
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"structure_string": "Dy12 Fe20 O48\n1.0\n-6.268653 6.268653 6.268653\n6.268653 -6.268653 6.268653\n6.268653 6.268653 -6.268653\nDy Fe O\n12 20 48\ndirect\n0.375000 0.125000 0.250000 Dy\n0.750000 0.125000 0.375000 Dy\n0.250000 0.375000 0.125000 Dy\n0.125000 0.250000 0.375000 Dy\n0.375000 0.750000 0.125000 Dy\n0.125000 0.375000 0.750000 Dy\n0.625000 0.875000 0.750000 Dy\n0.250000 0.875000 0.625000 Dy\n0.750000 0.625000 0.875000 Dy\n0.875000 0.750000 0.625000 Dy\n0.625000 0.250000 0.875000 Dy\n0.875000 0.625000 0.250000 Dy\n0.000000 0.000000 0.000000 Fe\n0.500000 0.000000 0.000000 Fe\n0.000000 0.500000 0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.500000 0.500000 0.000000 Fe\n0.000000 0.500000 0.500000 Fe\n0.500000 0.000000 0.500000 Fe\n0.500000 0.500000 0.500000 Fe\n0.625000 0.375000 0.250000 Fe\n0.750000 0.375000 0.625000 Fe\n0.250000 0.125000 0.875000 Fe\n0.875000 0.250000 0.125000 Fe\n0.125000 0.875000 0.250000 Fe\n0.875000 0.125000 0.750000 Fe\n0.250000 0.625000 0.375000 Fe\n0.375000 0.250000 0.625000 Fe\n0.750000 0.875000 0.125000 Fe\n0.125000 0.750000 0.875000 Fe\n0.375000 0.625000 0.750000 Fe\n0.625000 0.750000 0.375000 Fe\n0.416336 0.822933 0.791124 O\n0.874789 0.406598 0.083664 O\n0.093402 0.968191 0.677067 O\n0.531809 0.625211 0.708876 O\n0.677067 0.083664 0.708876 O\n0.625211 0.708876 0.531809 O\n0.625211 0.416336 0.093402 O\n0.708876 0.531809 0.625211 O\n0.822933 0.531809 0.406598 O\n0.968191 0.791124 0.874789 O\n0.791124 0.874789 0.968191 O\n0.708876 0.677067 0.083664 O\n0.416336 0.093402 0.625211 O\n0.406598 0.822933 0.531809 O\n0.083664 0.708876 0.677067 O\n0.093402 0.625211 0.416336 O\n0.531809 0.406598 0.822933 O\n0.083664 0.874789 0.406598 O\n0.968191 0.677067 0.093402 O\n0.177067 0.468191 0.593402 O\n0.677067 0.093402 0.968191 O\n0.791124 0.416336 0.822933 O\n0.406598 0.083664 0.874789 O\n0.874789 0.968191 0.791124 O\n0.583664 0.177067 0.208876 O\n0.125211 0.593402 0.916336 O\n0.906598 0.031809 0.322933 O\n0.468191 0.374789 0.291124 O\n0.322933 0.916336 0.291124 O\n0.374789 0.291124 0.468191 O\n0.374789 0.583664 0.906598 O\n0.291124 0.468191 0.374789 O\n0.125211 0.031809 0.208876 O\n0.593402 0.916336 0.125211 O\n0.208876 0.583664 0.177067 O\n0.177067 0.208876 0.583664 O\n0.322933 0.906598 0.031809 O\n0.031809 0.322933 0.906598 O\n0.916336 0.125211 0.593402 O\n0.468191 0.593402 0.177067 O\n0.906598 0.374789 0.583664 O\n0.916336 0.291124 0.322933 O\n0.593402 0.177067 0.468191 O\n0.583664 0.906598 0.374789 O\n0.291124 0.322933 0.916336 O\n0.208876 0.125211 0.031809 O\n0.031809 0.208876 0.125211 O\n0.822933 0.791124 0.416336 O\n",
"nsites": 80,
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"elements": [
"Dy",
"Fe",
"O"
],
"chemical_system": "Dy-Fe-O",
"density": 6.462747637182964,
"density_atomic": 0.08119089054343832,
"volume": 985.3322147907569,
"volume_molar": 7.417261616040615,
"formula_full": "Dy12 Fe20 O48",
"formula_reduced": "Dy3Fe5O12",
"formula_anonymous": "A3B5C12",
"energy": -666.1002358400001,
"energy_per_atom": -8.326252948,
"energy_above_hull": null,
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"energy_uncorrected": -588.00423584,
"band_gap": 1.6504000000000003,
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"is_magnetic": true,
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"is_theoretical": false,
"updated_at": "2021-11-28T01:35:35.262000Z",
"spacegroup": 230
},
{
"id": "mp-1201980",
"created_at": "2022-09-04T14:48:12.779472Z",
"structure_string": "Mn12 Fe8 Ge12 O48\n1.0\n-6.122952 6.122952 6.122952\n6.122952 -6.122952 6.122952\n6.122952 6.122952 -6.122952\nMn Fe Ge O\n12 8 12 48\ndirect\n0.125000 0.375000 0.750000 Mn\n0.375000 0.125000 0.250000 Mn\n0.375000 0.750000 0.125000 Mn\n0.125000 0.250000 0.375000 Mn\n0.750000 0.125000 0.375000 Mn\n0.250000 0.375000 0.125000 Mn\n0.875000 0.625000 0.250000 Mn\n0.625000 0.875000 0.750000 Mn\n0.625000 0.250000 0.875000 Mn\n0.875000 0.750000 0.625000 Mn\n0.250000 0.875000 0.625000 Mn\n0.750000 0.625000 0.875000 Mn\n0.000000 0.500000 0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.500000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.500000 0.500000 0.000000 Fe\n0.500000 0.000000 0.500000 Fe\n0.000000 0.500000 0.500000 Fe\n0.000000 0.000000 0.000000 Fe\n0.375000 0.625000 0.750000 Ge\n0.125000 0.875000 0.250000 Ge\n0.625000 0.750000 0.375000 Ge\n0.875000 0.250000 0.125000 Ge\n0.750000 0.375000 0.625000 Ge\n0.250000 0.125000 0.875000 Ge\n0.625000 0.375000 0.250000 Ge\n0.875000 0.125000 0.750000 Ge\n0.375000 0.250000 0.625000 Ge\n0.125000 0.750000 0.875000 Ge\n0.250000 0.625000 0.375000 Ge\n0.750000 0.875000 0.125000 Ge\n0.085102 0.876652 0.400847 O\n0.975805 0.684255 0.099153 O\n0.524195 0.623348 0.708450 O\n0.414898 0.815745 0.791550 O\n0.876652 0.400847 0.085102 O\n0.684255 0.099153 0.975805 O\n0.623348 0.708450 0.524195 O\n0.815745 0.791550 0.414898 O\n0.400847 0.085102 0.876652 O\n0.099153 0.975805 0.684255 O\n0.708450 0.524195 0.623348 O\n0.791550 0.414898 0.815745 O\n0.914898 0.123348 0.599153 O\n0.024195 0.315745 0.900847 O\n0.475805 0.376652 0.291550 O\n0.585102 0.184255 0.208450 O\n0.123348 0.599153 0.914898 O\n0.315745 0.900847 0.024195 O\n0.376652 0.291550 0.475805 O\n0.184255 0.208450 0.585102 O\n0.599153 0.914898 0.123348 O\n0.900847 0.024195 0.315745 O\n0.291550 0.475805 0.376652 O\n0.208450 0.585102 0.184255 O\n0.585102 0.900847 0.376652 O\n0.475805 0.599153 0.184255 O\n0.024195 0.208450 0.123348 O\n0.914898 0.291550 0.315745 O\n0.376652 0.585102 0.900847 O\n0.184255 0.475805 0.599153 O\n0.123348 0.024195 0.208450 O\n0.315745 0.914898 0.291550 O\n0.900847 0.376652 0.585102 O\n0.599153 0.184255 0.475805 O\n0.208450 0.123348 0.024195 O\n0.291550 0.315745 0.914898 O\n0.414898 0.099153 0.623348 O\n0.524195 0.400847 0.815745 O\n0.975805 0.791550 0.876652 O\n0.085102 0.708450 0.684255 O\n0.623348 0.414898 0.099153 O\n0.815745 0.524195 0.400847 O\n0.876652 0.975805 0.791550 O\n0.684255 0.085102 0.708450 O\n0.099153 0.623348 0.414898 O\n0.400847 0.815745 0.524195 O\n0.791550 0.876652 0.975805 O\n0.708450 0.684255 0.085102 O\n",
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"nelements": 4,
"elements": [
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"O"
],
"chemical_system": "Fe-Ge-Mn-O",
"density": 4.965403232121391,
"density_atomic": 0.08712593084355527,
"volume": 918.211136746984,
"volume_molar": 6.911995891112434,
"formula_full": "Mn12 Fe8 Ge12 O48",
"formula_reduced": "Mn3Fe2(GeO4)3",
"formula_anonymous": "A2B3C3D12",
"energy": -630.97547012,
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"updated_at": "2021-11-28T01:38:35.203000Z",
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},
{
"id": "mp-1247577",
"created_at": "2022-09-04T14:47:13.948618Z",
"structure_string": "Sr4 Ca28 Ti4 Mn28 O88\n1.0\n10.916344 -0.006803 -0.082971\n-0.008357 15.626199 -0.025841\n-0.080999 -0.018744 10.880479\nSr Ca Ti Mn O\n4 28 4 28 88\ndirect\n0.998883 0.111354 0.503830 Sr\n0.501428 0.387500 0.998631 Sr\n0.242840 0.388077 0.256113 Sr\n0.230982 0.119524 0.250694 Sr\n0.988926 0.114819 0.008861 Ca\n0.017161 0.627431 0.499363 Ca\n0.016453 0.626220 0.994723 Ca\n0.539447 0.127284 0.480984 Ca\n0.549090 0.123963 0.984036 Ca\n0.522176 0.625306 0.499449 Ca\n0.522078 0.624022 0.998733 Ca\n0.495076 0.394566 0.500338 Ca\n0.494835 0.856103 0.003683 Ca\n0.495954 0.855660 0.497115 Ca\n0.966272 0.389005 0.998372 Ca\n0.964461 0.391781 0.502727 Ca\n0.967704 0.865305 0.004414 Ca\n0.969080 0.869848 0.515596 Ca\n0.234637 0.400798 0.746910 Ca\n0.229036 0.860140 0.260097 Ca\n0.226163 0.867923 0.747953 Ca\n0.739856 0.393925 0.250936 Ca\n0.734506 0.389079 0.750649 Ca\n0.733548 0.860151 0.250861 Ca\n0.738913 0.860696 0.749898 Ca\n0.222669 0.108644 0.727703 Ca\n0.271264 0.627335 0.260047 Ca\n0.271169 0.629108 0.756916 Ca\n0.773394 0.114790 0.245780 Ca\n0.782477 0.121776 0.756181 Ca\n0.766942 0.626253 0.253694 Ca\n0.768937 0.624929 0.755720 Ca\n0.987683 0.983380 0.260706 Ti\n0.230809 0.988741 0.013052 Ti\n0.263259 0.232949 0.934834 Ti\n0.980867 0.255987 0.273884 Ti\n0.993052 0.992197 0.756726 Mn\n0.001963 0.504100 0.249555 Mn\n0.000319 0.504121 0.749519 Mn\n0.506831 0.989757 0.232388 Mn\n0.508245 0.983547 0.735858 Mn\n0.499521 0.506924 0.250276 Mn\n0.497663 0.505656 0.750683 Mn\n0.244628 0.992820 0.510577 Mn\n0.249205 0.510675 0.004590 Mn\n0.250176 0.505781 0.504598 Mn\n0.746770 0.994382 0.991458 Mn\n0.739427 0.997493 0.498840 Mn\n0.750943 0.504762 0.001675 Mn\n0.748413 0.505470 0.501603 Mn\n0.269909 0.245291 0.471822 Mn\n0.250024 0.749958 0.005235 Mn\n0.251622 0.749558 0.505906 Mn\n0.757607 0.250569 0.003059 Mn\n0.745858 0.252566 0.506238 Mn\n0.750139 0.746105 0.001091 Mn\n0.750560 0.746982 0.502476 Mn\n0.992019 0.258058 0.757296 Mn\n0.000480 0.744772 0.251864 Mn\n0.002517 0.748057 0.753294 Mn\n0.527592 0.257848 0.257508 Mn\n0.516372 0.253647 0.749187 Mn\n0.499480 0.747003 0.253272 Mn\n0.499665 0.746558 0.754244 Mn\n0.109680 0.776800 0.106637 O\n0.108659 0.773954 0.606580 O\n0.591212 0.250943 0.097766 O\n0.582888 0.258368 0.581721 O\n0.611399 0.763925 0.113295 O\n0.609218 0.765905 0.616443 O\n0.405790 0.208409 0.353644 O\n0.397621 0.182791 0.854347 O\n0.395060 0.728726 0.399499 O\n0.396794 0.728690 0.901989 O\n0.902526 0.243079 0.417695 O\n0.914023 0.241403 0.921970 O\n0.893714 0.729110 0.392667 O\n0.894587 0.729922 0.894161 O\n0.146226 0.249124 0.330195 O\n0.173936 0.251372 0.790964 O\n0.148741 0.733524 0.354450 O\n0.149052 0.733008 0.855496 O\n0.662174 0.218318 0.350100 O\n0.659803 0.226286 0.856756 O\n0.642038 0.728486 0.359122 O\n0.643636 0.725637 0.859367 O\n0.357435 0.774037 0.146000 O\n0.357106 0.771146 0.649921 O\n0.853894 0.273429 0.154624 O\n0.847618 0.277912 0.651527 O\n0.859377 0.768430 0.142956 O\n0.861696 0.769191 0.643463 O\n0.360683 0.490036 0.139500 O\n0.354248 0.495439 0.645976 O\n0.358313 0.015034 0.130212 O\n0.348678 0.991490 0.666688 O\n0.861786 0.483423 0.141368 O\n0.858001 0.482208 0.643079 O\n0.854909 0.977292 0.142589 O\n0.847077 0.977418 0.644228 O\n0.138956 0.003938 0.364497 O\n0.147845 0.020020 0.869992 O\n0.145133 0.520753 0.355682 O\n0.146798 0.519515 0.854871 O\n0.630173 0.028922 0.347909 O\n0.633647 0.027560 0.842076 O\n0.642505 0.522653 0.359563 O\n0.641067 0.517975 0.859593 O\n0.391916 0.518512 0.396103 O\n0.389818 0.517644 0.893692 O\n0.880039 0.009689 0.388241 O\n0.890766 0.013604 0.893859 O\n0.894647 0.519688 0.393109 O\n0.894835 0.518042 0.892572 O\n0.107595 0.478978 0.104541 O\n0.105651 0.480433 0.606075 O\n0.104237 0.974794 0.115750 O\n0.099938 0.982239 0.622267 O\n0.616732 0.490005 0.116589 O\n0.609000 0.488077 0.612049 O\n0.599950 0.988928 0.080692 O\n0.583859 0.990978 0.579343 O\n0.002888 0.380423 0.283210 O\n0.014453 0.379660 0.785835 O\n0.999939 0.868524 0.292241 O\n0.007759 0.869549 0.793744 O\n0.500264 0.379084 0.277425 O\n0.488757 0.378400 0.766920 O\n0.505556 0.870870 0.284129 O\n0.513601 0.870180 0.794424 O\n0.487797 0.626483 0.212967 O\n0.489555 0.627718 0.713991 O\n0.992240 0.130778 0.227793 O\n0.998510 0.135098 0.726310 O\n0.991501 0.625521 0.208892 O\n0.991027 0.625096 0.713201 O\n0.202533 0.150418 0.032459 O\n0.248746 0.122866 0.520219 O\n0.233631 0.633773 0.044362 O\n0.234334 0.629596 0.540660 O\n0.758891 0.123646 0.032700 O\n0.749081 0.123534 0.541034 O\n0.746652 0.624964 0.037198 O\n0.744469 0.626236 0.540337 O\n0.276866 0.367258 0.497966 O\n0.283087 0.334216 0.009691 O\n0.280493 0.878265 0.467654 O\n0.275566 0.882210 0.964704 O\n0.745244 0.379092 0.465829 O\n0.748478 0.376610 0.968532 O\n0.744914 0.872549 0.465610 O\n0.748939 0.870856 0.963332 O\n",
"nsites": 152,
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"elements": [
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],
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"density": 4.125056069368553,
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"volume": 1855.8916430643274,
"volume_molar": 7.352921519632274,
"formula_full": "Sr4 Ca28 Ti4 Mn28 O88",
"formula_reduced": "SrCa7TiMn7O22",
"formula_anonymous": "ABC7D7E22",
"energy": -1188.08221539,
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"updated_at": "2021-11-28T01:37:58.398000Z",
"spacegroup": 1
},
{
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"id": "mp-1268193",
"created_at": "2022-09-04T14:39:58.480001Z",
"structure_string": "Ca32 Mn28 Cr4 O92\n1.0\n10.875728 -0.007852 -0.035187\n-0.010819 15.253001 -0.005013\n-0.034436 -0.003570 10.736434\nCa Mn Cr O\n32 28 4 92\ndirect\n0.018754 0.116298 0.505432 Ca\n0.015745 0.118392 0.992453 Ca\n0.021321 0.626683 0.496124 Ca\n0.020934 0.627022 0.995549 Ca\n0.525819 0.129088 0.505624 Ca\n0.534079 0.121224 0.974608 Ca\n0.525938 0.625128 0.497975 Ca\n0.522676 0.625239 0.994539 Ca\n0.491165 0.382949 0.996986 Ca\n0.478466 0.383837 0.508048 Ca\n0.483064 0.870970 0.995432 Ca\n0.481346 0.866014 0.515211 Ca\n0.967860 0.383686 0.000102 Ca\n0.976830 0.379624 0.506046 Ca\n0.975436 0.873350 0.005083 Ca\n0.972378 0.874074 0.506846 Ca\n0.227914 0.388741 0.254043 Ca\n0.226461 0.377891 0.732928 Ca\n0.224659 0.873235 0.244182 Ca\n0.228694 0.873848 0.749051 Ca\n0.730854 0.383575 0.244641 Ca\n0.726861 0.378667 0.748289 Ca\n0.732173 0.866838 0.246634 Ca\n0.727813 0.873447 0.745423 Ca\n0.240266 0.119459 0.260941 Ca\n0.269666 0.116296 0.734472 Ca\n0.273286 0.627666 0.257038 Ca\n0.271510 0.625294 0.755028 Ca\n0.777378 0.117091 0.254380 Ca\n0.774270 0.123276 0.754796 Ca\n0.773106 0.625286 0.256022 Ca\n0.772554 0.626302 0.753797 Ca\n0.997599 0.997936 0.753364 Mn\n0.999346 0.502109 0.250511 Mn\n0.000750 0.500627 0.750191 Mn\n0.507814 0.987550 0.242815 Mn\n0.500101 0.998948 0.749195 Mn\n0.499112 0.503658 0.251137 Mn\n0.499873 0.501510 0.749925 Mn\n0.240836 0.993161 0.504062 Mn\n0.249210 0.503972 0.004307 Mn\n0.250392 0.503014 0.500735 Mn\n0.750595 0.998623 0.998070 Mn\n0.746375 0.000267 0.501645 Mn\n0.748800 0.502896 0.000553 Mn\n0.751280 0.500397 0.500123 Mn\n0.249577 0.250857 0.492869 Mn\n0.251044 0.751414 0.000426 Mn\n0.250539 0.749923 0.500108 Mn\n0.751727 0.248806 0.998833 Mn\n0.749613 0.250784 0.504442 Mn\n0.749749 0.749675 0.999995 Mn\n0.750633 0.749276 0.500084 Mn\n0.995745 0.251122 0.745104 Mn\n0.000643 0.749228 0.250369 Mn\n0.000871 0.750317 0.750020 Mn\n0.518248 0.255429 0.260106 Mn\n0.502676 0.250897 0.743371 Mn\n0.499312 0.748549 0.251718 Mn\n0.499972 0.748231 0.751068 Mn\n0.996897 0.996148 0.249267 Cr\n0.250015 0.000112 0.002935 Cr\n0.258650 0.244679 0.964684 Cr\n0.985998 0.250560 0.268354 Cr\n0.100122 0.266730 0.597100 O\n0.105731 0.771502 0.103580 O\n0.105677 0.773109 0.603503 O\n0.591239 0.260006 0.101923 O\n0.599007 0.269498 0.594984 O\n0.606367 0.772909 0.106962 O\n0.607362 0.765987 0.606841 O\n0.397367 0.209655 0.361147 O\n0.405753 0.232065 0.896889 O\n0.396233 0.726319 0.397885 O\n0.395854 0.729318 0.897878 O\n0.899494 0.224913 0.403853 O\n0.901198 0.233961 0.903952 O\n0.895724 0.730238 0.395173 O\n0.894960 0.729425 0.895515 O\n0.148731 0.243924 0.325856 O\n0.149009 0.226060 0.843191 O\n0.146339 0.730540 0.352925 O\n0.146804 0.729964 0.854072 O\n0.656989 0.223969 0.351333 O\n0.649933 0.229341 0.852343 O\n0.646187 0.728128 0.354190 O\n0.644586 0.728674 0.855842 O\n0.353577 0.266209 0.640730 O\n0.355722 0.772739 0.147342 O\n0.354400 0.770146 0.647132 O\n0.866811 0.273954 0.146601 O\n0.849900 0.273509 0.649732 O\n0.856832 0.769870 0.144663 O\n0.856381 0.771306 0.645641 O\n0.356129 0.482701 0.146063 O\n0.355503 0.481380 0.645489 O\n0.353358 0.997962 0.166489 O\n0.355216 0.980430 0.641561 O\n0.855851 0.481207 0.145222 O\n0.856896 0.478415 0.646263 O\n0.848947 0.979522 0.149887 O\n0.850928 0.978396 0.646834 O\n0.140747 0.011188 0.357068 O\n0.143022 0.024692 0.857189 O\n0.147516 0.520928 0.352356 O\n0.150178 0.515092 0.854044 O\n0.626285 0.029880 0.356370 O\n0.648390 0.019633 0.849981 O\n0.646223 0.519077 0.353688 O\n0.644927 0.521304 0.855351 O\n0.396065 0.021782 0.895017 O\n0.395673 0.522816 0.397079 O\n0.395265 0.514213 0.900424 O\n0.889593 0.020964 0.393179 O\n0.894556 0.017555 0.899282 O\n0.897206 0.520056 0.396025 O\n0.896593 0.518455 0.897557 O\n0.104112 0.479561 0.104628 O\n0.106583 0.479220 0.604616 O\n0.101534 0.980965 0.108965 O\n0.097234 0.980795 0.611692 O\n0.607049 0.481112 0.107430 O\n0.607270 0.481747 0.605841 O\n0.601733 0.986283 0.094316 O\n0.598513 0.981584 0.598776 O\n0.011808 0.377200 0.285951 O\n0.014739 0.374632 0.788900 O\n0.006751 0.873511 0.290023 O\n0.011403 0.874492 0.792905 O\n0.497653 0.377192 0.284788 O\n0.508263 0.375288 0.783207 O\n0.509146 0.871877 0.299921 O\n0.510074 0.874239 0.784312 O\n0.490212 0.124949 0.715000 O\n0.490041 0.627061 0.208510 O\n0.488044 0.624703 0.713269 O\n0.996775 0.126111 0.213421 O\n0.985765 0.125477 0.713738 O\n0.990191 0.625529 0.209739 O\n0.991384 0.624987 0.711733 O\n0.236526 0.146247 0.054556 O\n0.246203 0.121130 0.515292 O\n0.237783 0.625523 0.041260 O\n0.236941 0.626215 0.540920 O\n0.744082 0.124789 0.040015 O\n0.740677 0.125384 0.542428 O\n0.739852 0.625924 0.040698 O\n0.744432 0.624747 0.538233 O\n0.265321 0.375910 0.463085 O\n0.255769 0.357677 0.007277 O\n0.269545 0.874749 0.456310 O\n0.265939 0.875384 0.964600 O\n0.759750 0.374349 0.459005 O\n0.750636 0.375518 0.965750 O\n0.755056 0.875678 0.460585 O\n0.757806 0.874318 0.960883 O\n",
"nsites": 156,
"nelements": 4,
"elements": [
"Ca",
"Mn",
"Cr",
"O"
],
"chemical_system": "Ca-Cr-Mn-O",
"density": 4.196230390489083,
"density_atomic": 0.08759023282701099,
"volume": 1781.0204969782073,
"volume_molar": 6.875356493107641,
"formula_full": "Ca32 Mn28 Cr4 O92",
"formula_reduced": "Ca8Mn7CrO23",
"formula_anonymous": "AB7C8D23",
"energy": -1207.02044449,
"energy_per_atom": -7.7373105416025645,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -1089.11644449,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 100.0000011,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:41.301000Z",
"spacegroup": 1
}
]
}