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{
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"results": [
{
"id": "mp-1110599",
"created_at": "2022-09-04T14:48:07.027786Z",
"structure_string": "Rb2 Ti1 Ag1 F6\n1.0\n0.000000 4.450885 4.450885\n4.450885 0.000000 4.450885\n4.450885 4.450885 0.000000\nRb Ti Ag F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750000 Rb\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500000 0.500000 Ag\n0.223982 0.223982 0.776018 F\n0.223982 0.776018 0.776018 F\n0.776018 0.776018 0.223982 F\n0.223982 0.776018 0.223982 F\n0.776018 0.223982 0.776018 F\n0.776018 0.223982 0.223982 F\n",
"nsites": 10,
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"elements": [
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"Ag",
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"formula_full": "Rb2 Ti1 Ag1 F6",
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},
{
"id": "mp-1174830",
"created_at": "2022-09-04T14:48:07.032330Z",
"structure_string": "Li6 Mn3 Co1 O10\n1.0\n2.997531 0.000000 0.000000\n1.485105 6.287465 0.000000\n0.669298 1.745274 9.738119\nLi Mn Co O\n6 3 1 10\ndirect\n0.886476 0.205364 0.692528 Li\n0.106164 0.802215 0.300942 Li\n0.485451 0.012677 0.498351 Li\n0.707968 0.582960 0.102596 Li\n0.315578 0.393580 0.911721 Li\n0.381705 0.211839 0.193152 Li\n0.002883 0.006603 0.007466 Mn\n0.197568 0.599046 0.595902 Mn\n0.615466 0.794346 0.803654 Mn\n0.790744 0.391972 0.389048 Co\n0.490609 0.076639 0.868003 O\n0.635656 0.677043 0.449704 O\n0.030209 0.885152 0.654144 O\n0.225638 0.494952 0.263257 O\n0.853700 0.281398 0.044701 O\n0.360347 0.315937 0.545530 O\n0.521712 0.913842 0.130600 O\n0.941517 0.126554 0.358983 O\n0.180129 0.715603 0.946713 O\n0.770479 0.512279 0.743006 O\n",
"nsites": 20,
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"elements": [
"Li",
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"Co",
"O"
],
"chemical_system": "Co-Li-Mn-O",
"density": 3.8487464992517344,
"density_atomic": 0.10897218389678363,
"volume": 183.5330749996129,
"volume_molar": 5.526310058816529,
"formula_full": "Li6 Mn3 Co1 O10",
"formula_reduced": "Li6Mn3CoO10",
"formula_anonymous": "AB3C6D10",
"energy": -135.39924974000002,
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"updated_at": "2021-11-28T01:38:29.136000Z",
"spacegroup": 1
},
{
"id": "mp-1065",
"created_at": "2022-09-04T14:48:07.689864Z",
"structure_string": "La1 Sb1\n1.0\n0.000000 3.279540 3.279540\n3.279540 0.000000 3.279540\n3.279540 3.279540 0.000000\nLa Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.500000 Sb\n",
"nsites": 2,
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"elements": [
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"Sb"
],
"chemical_system": "La-Sb",
"density": 6.1356956560648435,
"density_atomic": 0.02835053136429015,
"volume": 70.54541498009333,
"volume_molar": 21.24172094913673,
"formula_full": "La1 Sb1",
"formula_reduced": "LaSb",
"formula_anonymous": "AB",
"energy": -11.79145021,
"energy_per_atom": -5.895725105,
"energy_above_hull": null,
"is_stable": null,
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"energy_uncorrected": -11.59945021,
"band_gap": 0.0,
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"is_magnetic": false,
"total_magnetization": 0.00036,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:27.695000Z",
"spacegroup": 225
},
{
"id": "mp-1209986",
"created_at": "2022-09-04T14:48:07.036622Z",
"structure_string": "Na2 Li2 Er4 F16\n1.0\n4.172953 -5.264057 0.000000\n4.172953 5.264057 0.000000\n0.000000 0.000000 7.083412\nNa Li Er F\n2 2 4 16\ndirect\n0.655393 0.655393 0.250000 Na\n0.344607 0.344607 0.750000 Na\n0.000000 0.000000 0.000000 Li\n0.000000 0.000000 0.500000 Li\n0.075598 0.450137 0.250000 Er\n0.924402 0.549863 0.750000 Er\n0.450137 0.075598 0.250000 Er\n0.549863 0.924402 0.750000 Er\n0.088831 0.088831 0.250000 F\n0.911169 0.911169 0.750000 F\n0.934867 0.657093 0.050238 F\n0.065133 0.342907 0.949762 F\n0.657093 0.934867 0.449762 F\n0.342907 0.065133 0.550238 F\n0.388200 0.388200 0.250000 F\n0.611800 0.611800 0.750000 F\n0.745563 0.306075 0.250000 F\n0.254437 0.693925 0.750000 F\n0.306075 0.745563 0.250000 F\n0.693925 0.254437 0.750000 F\n0.065133 0.342907 0.550238 F\n0.934867 0.657093 0.449762 F\n0.342907 0.065133 0.949762 F\n0.657093 0.934867 0.050238 F\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Na",
"Li",
"Er",
"F"
],
"chemical_system": "Er-F-Li-Na",
"density": 5.5113630781568625,
"density_atomic": 0.07712135771320774,
"volume": 311.19784080110634,
"volume_molar": 7.80865500630139,
"formula_full": "Na2 Li2 Er4 F16",
"formula_reduced": "NaLiEr2F8",
"formula_anonymous": "ABC2D8",
"energy": -152.09221731,
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"updated_at": "2021-11-28T01:38:30.951000Z",
"spacegroup": 63
},
{
"id": "mp-1020160",
"created_at": "2022-09-04T14:48:07.041782Z",
"structure_string": "Na24 Zn8 B40 O80\n1.0\n7.984618 0.000000 0.000000\n0.000000 12.382849 0.000000\n0.000000 0.000000 18.242433\nNa Zn B O\n24 8 40 80\ndirect\n0.707319 0.572768 0.429652 Na\n0.207319 0.927232 0.570348 Na\n0.292681 0.072768 0.070348 Na\n0.792681 0.427232 0.929652 Na\n0.292681 0.427232 0.570348 Na\n0.792681 0.072768 0.429652 Na\n0.707319 0.927232 0.929652 Na\n0.207319 0.572768 0.070348 Na\n0.331044 0.081622 0.421393 Na\n0.831044 0.418378 0.578607 Na\n0.668956 0.581622 0.078607 Na\n0.168956 0.918378 0.921393 Na\n0.668956 0.918378 0.578607 Na\n0.168956 0.581622 0.421393 Na\n0.331044 0.418378 0.921393 Na\n0.831044 0.081622 0.078607 Na\n0.310182 0.347194 0.245398 Na\n0.810182 0.152806 0.754602 Na\n0.689818 0.847194 0.254602 Na\n0.189818 0.652806 0.745398 Na\n0.689818 0.652806 0.754602 Na\n0.189818 0.847194 0.245398 Na\n0.310182 0.152806 0.745398 Na\n0.810182 0.347194 0.254602 Na\n0.576232 0.323469 0.403318 Zn\n0.076232 0.176531 0.596682 Zn\n0.423768 0.823469 0.096682 Zn\n0.923768 0.676531 0.903318 Zn\n0.423768 0.676531 0.596682 Zn\n0.923768 0.823469 0.403318 Zn\n0.576232 0.176531 0.903318 Zn\n0.076232 0.323469 0.096682 Zn\n0.920228 0.342960 0.424636 B\n0.420228 0.157040 0.575364 B\n0.079772 0.842960 0.075364 B\n0.579772 0.657040 0.924636 B\n0.079772 0.657040 0.575364 B\n0.579772 0.842960 0.424636 B\n0.920228 0.157040 0.924636 B\n0.420228 0.342960 0.075364 B\n0.227394 0.327808 0.427028 B\n0.727394 0.172192 0.572972 B\n0.772606 0.827808 0.072972 B\n0.272606 0.672192 0.927028 B\n0.772606 0.672192 0.572972 B\n0.272606 0.827808 0.427028 B\n0.227394 0.172192 0.927028 B\n0.727394 0.327808 0.072972 B\n0.063259 0.212909 0.336392 B\n0.563259 0.287091 0.663608 B\n0.936741 0.712909 0.163608 B\n0.436741 0.787091 0.836392 B\n0.936741 0.787091 0.663608 B\n0.436741 0.712909 0.336392 B\n0.063259 0.287091 0.836392 B\n0.563259 0.212909 0.163608 B\n0.555128 0.150574 0.297096 B\n0.055128 0.349426 0.702904 B\n0.444872 0.650574 0.202904 B\n0.944872 0.849426 0.797096 B\n0.444872 0.849426 0.702904 B\n0.944872 0.650574 0.297096 B\n0.555128 0.349426 0.797096 B\n0.055128 0.150574 0.202904 B\n0.509696 0.521541 0.301415 B\n0.009696 0.978459 0.698585 B\n0.490304 0.021541 0.198585 B\n0.990304 0.478459 0.801415 B\n0.490304 0.478459 0.698585 B\n0.990304 0.021541 0.301415 B\n0.509696 0.978459 0.801415 B\n0.009696 0.521541 0.198585 B\n0.574183 0.169747 0.369495 O\n0.074183 0.330253 0.630505 O\n0.425817 0.669747 0.130505 O\n0.925817 0.830253 0.869495 O\n0.425817 0.830253 0.630505 O\n0.925817 0.669747 0.369495 O\n0.574183 0.330253 0.869495 O\n0.074183 0.169747 0.130505 O\n0.219683 0.253665 0.369902 O\n0.719683 0.246335 0.630098 O\n0.780317 0.753665 0.130098 O\n0.280317 0.746335 0.869902 O\n0.780317 0.746335 0.630098 O\n0.280317 0.753665 0.369902 O\n0.219683 0.246335 0.869902 O\n0.719683 0.253665 0.130098 O\n0.778118 0.381706 0.455149 O\n0.278118 0.118294 0.544851 O\n0.221882 0.881706 0.044851 O\n0.721882 0.618294 0.955149 O\n0.221882 0.618294 0.544851 O\n0.721882 0.881706 0.455149 O\n0.778118 0.118294 0.955149 O\n0.278118 0.381706 0.044851 O\n0.371687 0.358331 0.458517 O\n0.871687 0.141669 0.541483 O\n0.628313 0.858331 0.041483 O\n0.128313 0.641669 0.958517 O\n0.628313 0.641669 0.541483 O\n0.128313 0.858331 0.458517 O\n0.371687 0.141669 0.958517 O\n0.871687 0.358331 0.041483 O\n0.575644 0.425837 0.318663 O\n0.075644 0.074163 0.681337 O\n0.424356 0.925837 0.181337 O\n0.924356 0.574163 0.818663 O\n0.424356 0.574163 0.681337 O\n0.924356 0.925837 0.318663 O\n0.575644 0.074163 0.818663 O\n0.075644 0.425837 0.181337 O\n0.573697 0.229075 0.243557 O\n0.073697 0.270925 0.756443 O\n0.426303 0.729075 0.256443 O\n0.926303 0.770925 0.743557 O\n0.426303 0.770925 0.756443 O\n0.926303 0.729075 0.243557 O\n0.573697 0.270925 0.743557 O\n0.073697 0.229075 0.256443 O\n0.456913 0.596396 0.353877 O\n0.956913 0.903604 0.646123 O\n0.543087 0.096396 0.146123 O\n0.043087 0.403604 0.853877 O\n0.543087 0.403604 0.646123 O\n0.043087 0.096396 0.353877 O\n0.456913 0.903604 0.853877 O\n0.956913 0.596396 0.146123 O\n0.490215 0.545805 0.225900 O\n0.990215 0.954195 0.774100 O\n0.509785 0.045805 0.274100 O\n0.009785 0.454195 0.725900 O\n0.509785 0.454195 0.774100 O\n0.009785 0.045805 0.225900 O\n0.490215 0.954195 0.725900 O\n0.990215 0.545805 0.274100 O\n0.917154 0.273075 0.365332 O\n0.417154 0.226925 0.634668 O\n0.082846 0.773075 0.134668 O\n0.582846 0.726925 0.865332 O\n0.082846 0.726925 0.634668 O\n0.582846 0.773075 0.365332 O\n0.917154 0.226925 0.865332 O\n0.417154 0.273075 0.134668 O\n0.077271 0.376652 0.452387 O\n0.577271 0.123348 0.547613 O\n0.922729 0.876652 0.047613 O\n0.422729 0.623348 0.952387 O\n0.922729 0.623348 0.547613 O\n0.422729 0.876652 0.452387 O\n0.077271 0.123348 0.952387 O\n0.577271 0.376652 0.047613 O\n",
"nsites": 152,
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],
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"formula_full": "Na24 Zn8 B40 O80",
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"spacegroup": 61
},
{
"id": "mp-1188141",
"created_at": "2022-09-04T14:48:07.053934Z",
"structure_string": "Rb1 Au1 I4 O12\n1.0\n0.000000 -5.738443 0.000000\n-6.581741 2.869221 2.264842\n0.013964 0.000000 -8.585842\nRb Au I O\n1 1 4 12\ndirect\n0.957496 0.000000 0.000000 Rb\n0.769860 0.000000 0.500000 Au\n0.709019 0.359721 0.833711 I\n0.349297 0.640279 0.166289 I\n0.318571 0.698295 0.655003 I\n0.620276 0.301705 0.344997 I\n0.889774 0.197254 0.730373 O\n0.692519 0.802746 0.269627 O\n0.917155 0.593299 0.801302 O\n0.323856 0.406701 0.198698 O\n0.854270 0.397657 0.036545 O\n0.456614 0.602343 0.963455 O\n0.373197 0.944284 0.802956 O\n0.428913 0.055716 0.197044 O\n0.160638 0.702488 0.473079 O\n0.458150 0.297512 0.526922 O\n0.654552 0.764039 0.589790 O\n0.890513 0.235961 0.410210 O\n",
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"elements": [
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"Au",
"I",
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],
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"formula_full": "Rb1 Au1 I4 O12",
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{
"id": "mp-1180",
"created_at": "2022-09-04T14:48:07.061873Z",
"structure_string": "Mn1 Pt3\n1.0\n3.936087 0.000000 0.000000\n0.000000 3.936087 0.000000\n0.000000 0.000000 3.936087\nMn Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Mn\n0.000000 0.500000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n",
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{
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