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{
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"results": [
{
"id": "mp-1096731",
"created_at": "2022-09-04T14:41:44.997121Z",
"structure_string": "Ta2 V1 Tc1\n1.0\n-4.519503 5.464454 7.730340\n4.519503 -5.464454 7.730340\n4.519503 5.464454 -7.730340\nTa V Tc\n2 1 1\ndirect\n0.000000 0.253652 0.253652 Ta\n0.000000 0.746348 0.746348 Ta\n0.000000 0.000000 0.000000 V\n0.000000 0.500000 0.500000 Tc\n",
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{
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"structure_string": "Mg4 Mn4 F20\n1.0\n9.588711 0.000000 0.000000\n0.000000 5.095582 0.000000\n0.000000 2.668686 7.341752\nMg Mn F\n4 4 20\ndirect\n0.010656 0.523102 0.771633 Mg\n0.510656 0.476898 0.728367 Mg\n0.989344 0.476898 0.228367 Mg\n0.489344 0.523102 0.271633 Mg\n0.756216 0.112299 0.613943 Mn\n0.256216 0.887701 0.886057 Mn\n0.243784 0.887701 0.386057 Mn\n0.743784 0.112299 0.113943 Mn\n0.883842 0.405696 0.607805 F\n0.383842 0.594304 0.892195 F\n0.116158 0.594304 0.392195 F\n0.616158 0.405696 0.107805 F\n0.608458 0.366458 0.501016 F\n0.108458 0.633542 0.998984 F\n0.391542 0.633542 0.498984 F\n0.891542 0.366458 0.001016 F\n0.394182 0.138606 0.773909 F\n0.894182 0.861394 0.726091 F\n0.605818 0.861394 0.226091 F\n0.105818 0.138606 0.273909 F\n0.131282 0.187541 0.853908 F\n0.631282 0.812459 0.646092 F\n0.868718 0.812459 0.146092 F\n0.368718 0.187541 0.353908 F\n0.664075 0.200343 0.844145 F\n0.164075 0.799657 0.655855 F\n0.335925 0.799657 0.155855 F\n0.835925 0.200343 0.344145 F\n",
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"formula_full": "Mg4 Mn4 F20",
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"updated_at": "2021-11-28T01:35:22.687000Z",
"spacegroup": 14
},
{
"id": "mp-1245473",
"created_at": "2022-09-04T14:41:31.750648Z",
"structure_string": "Mn36 Ir8 N36\n1.0\n6.553749 0.000000 -0.029144\n0.000000 7.646893 0.000000\n-4.636784 0.000000 16.361520\nMn Ir N\n36 8 36\ndirect\n0.482176 0.864201 0.076871 Mn\n0.517824 0.364201 0.423129 Mn\n0.517824 0.135799 0.923129 Mn\n0.482176 0.635799 0.576871 Mn\n0.615450 0.127202 0.579992 Mn\n0.384550 0.627202 0.920008 Mn\n0.384550 0.872798 0.420008 Mn\n0.615450 0.372798 0.079992 Mn\n0.766259 0.872124 0.723336 Mn\n0.233741 0.372124 0.776664 Mn\n0.233741 0.127876 0.276664 Mn\n0.766259 0.627876 0.223336 Mn\n0.834553 0.308498 0.711533 Mn\n0.165447 0.808498 0.788467 Mn\n0.165447 0.691502 0.288467 Mn\n0.834553 0.191502 0.211533 Mn\n0.692425 0.414236 0.891608 Mn\n0.307575 0.914236 0.608392 Mn\n0.307575 0.585764 0.108392 Mn\n0.692425 0.085764 0.391608 Mn\n0.832461 0.121815 0.852079 Mn\n0.167539 0.621815 0.647921 Mn\n0.167539 0.878185 0.147921 Mn\n0.832461 0.378185 0.352079 Mn\n0.063793 0.134822 0.636616 Mn\n0.936207 0.634822 0.863384 Mn\n0.936207 0.865178 0.363384 Mn\n0.063793 0.365178 0.136616 Mn\n0.307249 0.336723 0.580446 Mn\n0.692751 0.836723 0.919554 Mn\n0.692751 0.663277 0.419554 Mn\n0.307249 0.163277 0.080446 Mn\n0.827418 0.443701 0.569775 Mn\n0.172582 0.943701 0.930225 Mn\n0.172582 0.556299 0.430225 Mn\n0.827418 0.056299 0.069775 Mn\n0.470873 0.147935 0.717442 Ir\n0.529127 0.647935 0.782558 Ir\n0.529127 0.852065 0.282558 Ir\n0.470873 0.352065 0.217443 Ir\n0.842926 0.825203 0.571557 Ir\n0.157074 0.325203 0.928443 Ir\n0.157074 0.174797 0.428443 Ir\n0.842926 0.674797 0.071557 Ir\n0.603331 0.396310 0.614317 N\n0.396669 0.896310 0.885683 N\n0.396669 0.603690 0.385683 N\n0.603331 0.103690 0.114317 N\n0.484838 0.244628 0.825009 N\n0.515162 0.744628 0.674991 N\n0.515162 0.755372 0.174991 N\n0.484838 0.255372 0.325009 N\n0.795664 0.062500 0.956736 N\n0.204336 0.562500 0.543264 N\n0.204336 0.937500 0.043264 N\n0.795664 0.437500 0.456736 N\n0.511846 0.864292 0.539529 N\n0.488154 0.364292 0.960471 N\n0.488154 0.135708 0.460471 N\n0.511846 0.635708 0.039529 N\n0.831944 0.078075 0.677025 N\n0.168056 0.578075 0.822975 N\n0.168056 0.921925 0.322975 N\n0.831944 0.421925 0.177025 N\n0.065157 0.383376 0.661449 N\n0.934843 0.883376 0.838551 N\n0.934843 0.616624 0.338551 N\n0.065157 0.116624 0.161449 N\n0.035994 0.240680 0.812940 N\n0.964006 0.740680 0.687060 N\n0.964006 0.759320 0.187060 N\n0.035994 0.259320 0.312940 N\n0.184174 0.119946 0.546852 N\n0.815826 0.619946 0.953148 N\n0.815826 0.880054 0.453148 N\n0.184174 0.380054 0.046852 N\n0.240812 0.973153 0.708209 N\n0.759188 0.473153 0.791791 N\n0.759188 0.026847 0.291791 N\n0.240812 0.526847 0.208209 N\n",
"nsites": 80,
"nelements": 3,
"elements": [
"Mn",
"Ir",
"N"
],
"chemical_system": "Ir-Mn-N",
"density": 8.150739102826924,
"density_atomic": 0.09768754180836205,
"volume": 818.937589369784,
"volume_molar": 6.164696796049899,
"formula_full": "Mn36 Ir8 N36",
"formula_reduced": "Mn9Ir2N9",
"formula_anonymous": "A2B9C9",
"energy": -710.2462204,
"energy_per_atom": -8.878077755,
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"updated_at": "2021-11-28T01:35:22.869000Z",
"spacegroup": 14
},
{
"id": "mp-985578",
"created_at": "2022-09-04T14:41:34.796304Z",
"structure_string": "Al1 Fe1\n1.0\n1.325086 -2.295116 0.000000\n1.325086 2.295116 0.000000\n0.000000 0.000000 4.900414\nAl Fe\n1 1\ndirect\n0.000000 0.000000 0.500000 Al\n0.000000 0.000000 0.000000 Fe\n",
"nsites": 2,
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"elements": [
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"Fe"
],
"chemical_system": "Al-Fe",
"density": 4.614313908264683,
"density_atomic": 0.06709938226489791,
"volume": 29.806533718959017,
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"formula_full": "Al1 Fe1",
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"formula_anonymous": "AB",
"energy": -11.29355488,
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"updated_at": "2021-11-28T01:35:27.055000Z",
"spacegroup": 191
},
{
"id": "mp-1191230",
"created_at": "2022-09-04T14:41:31.825830Z",
"structure_string": "Pr8 Fe2 S14\n1.0\n6.997597 0.000000 0.000000\n0.000000 9.929100 0.000000\n0.000000 4.963974 8.622841\nPr Fe S\n8 2 14\ndirect\n0.724562 0.780746 0.844576 Pr\n0.723768 0.375088 0.780776 Pr\n0.724519 0.844293 0.375645 Pr\n0.224562 0.219254 0.155424 Pr\n0.223768 0.624912 0.219224 Pr\n0.224519 0.155707 0.624355 Pr\n0.179307 0.663194 0.666563 Pr\n0.679307 0.336806 0.333437 Pr\n0.517325 0.001931 0.001455 Fe\n0.017325 0.998069 0.998545 Fe\n0.334502 0.871856 0.900052 S\n0.335536 0.233488 0.869324 S\n0.335283 0.898436 0.232621 S\n0.834502 0.128144 0.099948 S\n0.835536 0.766512 0.130676 S\n0.835283 0.101564 0.767379 S\n0.966988 0.925062 0.562514 S\n0.964734 0.510399 0.927109 S\n0.961880 0.559968 0.510457 S\n0.466988 0.074938 0.437486 S\n0.464734 0.489601 0.072891 S\n0.461880 0.440032 0.489543 S\n0.563597 0.667442 0.666914 S\n0.063597 0.332558 0.333086 S\n",
"nsites": 24,
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"elements": [
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"S"
],
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"density": 4.678176869342697,
"density_atomic": 0.04005917967722993,
"volume": 599.1136162391728,
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"formula_full": "Pr8 Fe2 S14",
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"formula_anonymous": "AB4C7",
"energy": -159.22277538,
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"updated_at": "2021-11-28T01:35:12.217000Z",
"spacegroup": 4
},
{
"id": "mp-1176463",
"created_at": "2022-09-04T14:41:34.796612Z",
"structure_string": "Mn6 Nb2 O16\n1.0\n5.081228 2.993883 0.000000\n-5.081228 2.993883 0.000000\n0.000000 0.277491 9.388721\nMn Nb O\n6 2 16\ndirect\n0.331053 0.164226 0.212018 Mn\n0.830185 0.662300 0.213203 Mn\n0.825296 0.164670 0.214986 Mn\n0.164670 0.825296 0.714986 Mn\n0.164226 0.331053 0.712018 Mn\n0.662300 0.830185 0.713203 Mn\n0.664252 0.338599 0.497698 Nb\n0.338599 0.664252 0.997698 Nb\n0.332250 0.158614 0.595295 O\n0.544782 0.503736 0.342482 O\n0.666776 0.337470 0.112126 O\n0.995068 0.992379 0.307860 O\n0.992379 0.995068 0.807860 O\n0.839082 0.665632 0.604556 O\n0.531277 0.044471 0.337842 O\n0.960447 0.475351 0.327341 O\n0.154811 0.817075 0.092450 O\n0.817075 0.154811 0.592450 O\n0.044471 0.531277 0.837842 O\n0.475351 0.960447 0.827341 O\n0.337470 0.666776 0.612126 O\n0.158614 0.332250 0.095295 O\n0.503736 0.544782 0.842482 O\n0.665632 0.839082 0.104556 O\n",
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"elements": [
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],
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"density_atomic": 0.08401780005582724,
"volume": 285.6537541336805,
"volume_molar": 7.167696316731066,
"formula_full": "Mn6 Nb2 O16",
"formula_reduced": "Mn3NbO8",
"formula_anonymous": "AB3C8",
"energy": -205.69861727,
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"updated_at": "2021-11-28T01:35:28.543000Z",
"spacegroup": 9
},
{
"id": "mp-757863",
"created_at": "2022-09-04T14:41:31.426352Z",
"structure_string": "Li8 V2 Cr2 W4 O24\n1.0\n5.419680 2.906804 -4.234655\n-5.428198 2.919850 -4.236904\n-4.826676 6.133036 4.214143\nLi V Cr W O\n8 2 2 4 24\ndirect\n0.318344 0.679414 0.213367 Li\n0.818405 0.179379 0.213435 Li\n0.171758 0.321396 0.786691 Li\n0.671773 0.821383 0.786712 Li\n0.692004 0.304575 0.796648 Li\n0.191969 0.804696 0.796609 Li\n0.831958 0.677456 0.216264 Li\n0.331910 0.177490 0.216226 Li\n0.231067 0.270520 0.487835 V\n0.730999 0.770577 0.487865 V\n0.509662 0.490224 0.006609 Cr\n0.009458 0.990284 0.006385 Cr\n0.746587 0.263635 0.503540 W\n0.246590 0.763542 0.503559 W\n0.495372 0.996289 0.989290 W\n0.995359 0.496178 0.989293 W\n0.783914 0.525832 0.442490 O\n0.283894 0.025858 0.442472 O\n0.930906 0.181173 0.749354 O\n0.430950 0.681205 0.749351 O\n0.294246 0.026101 0.065406 O\n0.794272 0.526108 0.065454 O\n0.985622 0.218114 0.446172 O\n0.485609 0.718218 0.445892 O\n0.545913 0.262328 0.952011 O\n0.045908 0.762235 0.951993 O\n0.316508 0.064519 0.749897 O\n0.816435 0.564459 0.749887 O\n0.698831 0.917266 0.262978 O\n0.198757 0.417270 0.262959 O\n0.471454 0.719627 0.061001 O\n0.971376 0.219533 0.061022 O\n0.035803 0.767652 0.564242 O\n0.535803 0.267651 0.564224 O\n0.725880 0.957188 0.951920 O\n0.225923 0.456910 0.952256 O\n0.089307 0.793437 0.262759 O\n0.589312 0.293453 0.262774 O\n0.231888 0.456615 0.562776 O\n0.731880 0.956610 0.562780 O\n",
"nsites": 40,
"nelements": 5,
"elements": [
"Li",
"V",
"Cr",
"W",
"O"
],
"chemical_system": "Cr-Li-O-V-W",
"density": 5.52806375062574,
"density_atomic": 0.09644267819903614,
"volume": 414.75413942206103,
"volume_molar": 6.244269520980791,
"formula_full": "Li8 V2 Cr2 W4 O24",
"formula_reduced": "Li4VCr(WO6)2",
"formula_anonymous": "ABC2D4E12",
"energy": -316.04924404,
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"spacegroup": 1
},
{
"id": "mp-1203090",
"created_at": "2022-09-04T14:41:46.427024Z",
"structure_string": "Hf12 Mn12 Si24\n1.0\n7.843528 0.000000 0.000000\n0.000000 8.975481 0.000000\n0.000000 0.000000 9.777365\nHf Mn Si\n12 12 24\ndirect\n0.745180 0.825605 0.048559 Hf\n0.745180 0.174395 0.951441 Hf\n0.254820 0.674395 0.548559 Hf\n0.254820 0.325605 0.451441 Hf\n0.254820 0.174395 0.951441 Hf\n0.254820 0.825605 0.048559 Hf\n0.745180 0.325605 0.451441 Hf\n0.745180 0.674395 0.548559 Hf\n0.500000 0.831758 0.321339 Hf\n0.500000 0.168242 0.678661 Hf\n0.500000 0.668242 0.821339 Hf\n0.500000 0.331758 0.178661 Hf\n0.749367 0.583634 0.253236 Mn\n0.749367 0.416366 0.746764 Mn\n0.250633 0.916366 0.753236 Mn\n0.250633 0.083634 0.246764 Mn\n0.250633 0.416366 0.746764 Mn\n0.250633 0.583634 0.253236 Mn\n0.749367 0.083634 0.246764 Mn\n0.749367 0.916366 0.753236 Mn\n0.745129 0.000000 0.500000 Mn\n0.254871 0.500000 0.000000 Mn\n0.254871 0.000000 0.500000 Mn\n0.745129 0.500000 0.000000 Mn\n0.849985 0.834281 0.319220 Si\n0.849985 0.165719 0.680780 Si\n0.150015 0.665719 0.819220 Si\n0.150015 0.334281 0.180780 Si\n0.150015 0.165719 0.680780 Si\n0.150015 0.834281 0.319220 Si\n0.849985 0.334281 0.180780 Si\n0.849985 0.665719 0.819220 Si\n0.500000 0.538310 0.380419 Si\n0.500000 0.461690 0.619581 Si\n0.500000 0.961690 0.880419 Si\n0.500000 0.038310 0.119581 Si\n0.000000 0.539410 0.375925 Si\n0.000000 0.460590 0.624075 Si\n0.000000 0.960590 0.875925 Si\n0.000000 0.039410 0.124075 Si\n0.500000 0.623956 0.106012 Si\n0.500000 0.376044 0.893988 Si\n0.500000 0.876044 0.606012 Si\n0.500000 0.123956 0.393988 Si\n0.000000 0.611465 0.101802 Si\n0.000000 0.388535 0.898198 Si\n0.000000 0.888535 0.601802 Si\n0.000000 0.111465 0.398198 Si\n",
"nsites": 48,
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"elements": [
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"Mn",
"Si"
],
"chemical_system": "Hf-Mn-Si",
"density": 8.383714059282257,
"density_atomic": 0.0697349069974126,
"volume": 688.3209868162721,
"volume_molar": 8.635762230561864,
"formula_full": "Hf12 Mn12 Si24",
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"energy": -390.12533133,
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},
{
"id": "mp-1173934",
"created_at": "2022-09-04T14:41:34.848835Z",
"structure_string": "Li6 Mn2 Co4 O12\n1.0\n-2.678485 4.273592 0.657285\n-2.382729 -4.364766 6.047972\n4.681081 0.428927 3.568729\nLi Mn Co O\n6 2 4 12\ndirect\n0.999740 0.666584 0.833320 Li\n0.499475 0.166375 0.333409 Li\n0.501140 0.837106 0.664061 Li\n0.001036 0.332421 0.164705 Li\n0.499065 0.496278 0.002601 Li\n0.999114 0.000919 0.501723 Li\n0.499869 0.166859 0.833319 Mn\n0.000172 0.666810 0.333224 Mn\n0.499846 0.496174 0.503616 Co\n0.500659 0.837230 0.162793 Co\n0.999735 0.003315 0.996844 Co\n0.000030 0.329881 0.669955 Co\n0.261071 0.243759 0.987237 O\n0.761229 0.743199 0.487260 O\n0.238899 0.589928 0.179252 O\n0.738816 0.089649 0.679694 O\n0.245542 0.585143 0.635124 O\n0.725892 0.084522 0.147326 O\n0.274202 0.248840 0.519665 O\n0.754242 0.748047 0.031050 O\n0.243142 0.893932 0.321967 O\n0.723768 0.402053 0.826551 O\n0.275991 0.931280 0.840410 O\n0.757324 0.439697 0.344894 O\n",
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"elements": [
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],
"chemical_system": "Co-Li-Mn-O",
"density": 4.396937747682711,
"density_atomic": 0.1097104927375327,
"volume": 218.757562755795,
"volume_molar": 5.489120146791379,
"formula_full": "Li6 Mn2 Co4 O12",
"formula_reduced": "Li3Mn(CoO3)2",
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"updated_at": "2021-11-28T01:35:31.484000Z",
"spacegroup": 2
},
{
"id": "mp-766587",
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"structure_string": "Li12 V4 P4 C4 O28\n1.0\n6.512588 0.000000 0.000000\n0.000000 9.669120 0.000000\n0.000000 4.545211 8.658724\nLi V P C O\n12 4 4 4 28\ndirect\n0.266190 0.688043 0.889026 Li\n0.233810 0.188043 0.889026 Li\n0.021976 0.519089 0.711281 Li\n0.478024 0.019089 0.711281 Li\n0.751385 0.321395 0.625888 Li\n0.748615 0.821395 0.625888 Li\n0.248615 0.678605 0.374112 Li\n0.251385 0.178605 0.374112 Li\n0.978024 0.480911 0.288719 Li\n0.521976 0.980911 0.288719 Li\n0.733810 0.311957 0.110974 Li\n0.766190 0.811957 0.110974 Li\n0.521937 0.486219 0.751532 V\n0.978063 0.986219 0.751532 V\n0.478063 0.513781 0.248468 V\n0.021937 0.013781 0.248468 V\n0.237961 0.313058 0.591989 P\n0.262039 0.813058 0.591989 P\n0.762039 0.686942 0.408011 P\n0.737961 0.186942 0.408011 P\n0.756304 0.643072 0.946236 C\n0.743696 0.143072 0.946236 C\n0.243696 0.356928 0.053764 C\n0.256304 0.856928 0.053764 C\n0.698655 0.282355 0.926427 O\n0.801345 0.782355 0.926427 O\n0.275480 0.467724 0.912048 O\n0.744703 0.611087 0.833060 O\n0.224520 0.967724 0.912048 O\n0.755297 0.111087 0.833060 O\n0.056708 0.328857 0.685356 O\n0.434544 0.313124 0.682484 O\n0.065456 0.813124 0.682484 O\n0.443292 0.828857 0.685356 O\n0.758141 0.556736 0.578109 O\n0.277064 0.650992 0.592897 O\n0.741859 0.056736 0.578109 O\n0.222936 0.150992 0.592897 O\n0.722936 0.349008 0.407103 O\n0.241859 0.443264 0.421891 O\n0.777064 0.849008 0.407103 O\n0.258141 0.943264 0.421891 O\n0.943292 0.671143 0.314644 O\n0.565456 0.686876 0.317516 O\n0.934544 0.186876 0.317516 O\n0.556708 0.171143 0.314644 O\n0.255297 0.388913 0.166940 O\n0.724520 0.532276 0.087952 O\n0.244703 0.888913 0.166940 O\n0.775480 0.032276 0.087952 O\n0.301345 0.717645 0.073573 O\n0.198655 0.217645 0.073573 O\n",
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"elements": [
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],
"chemical_system": "C-Li-O-P-V",
"density": 2.762179518723241,
"density_atomic": 0.09536936528419346,
"volume": 545.2484646934994,
"volume_molar": 6.314544237611815,
"formula_full": "Li12 V4 P4 C4 O28",
"formula_reduced": "Li3VPCO7",
"formula_anonymous": "ABCD3E7",
"energy": -381.82459825,
"energy_per_atom": -7.342780735576923,
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"updated_at": "2021-11-28T01:35:28.890000Z",
"spacegroup": 14
},
{
"id": "mp-757232",
"created_at": "2022-09-04T14:41:31.763120Z",
"structure_string": "Li6 Mn4 Cu2 O12\n1.0\n-0.000002 -1.471493 2.406076\n6.696362 -3.341613 -0.390795\n6.557598 8.006667 4.896547\nLi Mn Cu O\n6 4 2 12\ndirect\n0.333462 0.333120 0.083377 Li\n0.333244 0.333535 0.583300 Li\n0.010349 0.979068 0.255063 Li\n0.010337 0.979092 0.755062 Li\n0.656375 0.687554 0.411648 Li\n0.656379 0.687553 0.911651 Li\n0.000089 0.999708 0.499709 Mn\n0.666564 0.666999 0.167023 Mn\n0.000111 0.999667 0.999616 Mn\n0.666559 0.667015 0.667077 Mn\n0.333247 0.333361 0.333170 Cu\n0.333327 0.333350 0.833334 Cu\n0.512244 0.975545 0.888278 O\n0.512243 0.975547 0.388301 O\n0.154471 0.691080 0.278409 O\n0.154464 0.691105 0.778436 O\n0.172412 0.655424 0.051630 O\n0.172468 0.655322 0.551671 O\n0.494256 0.011230 0.615070 O\n0.494212 0.011316 0.115037 O\n0.822558 0.354745 0.221166 O\n0.822593 0.354809 0.721409 O\n0.843968 0.311963 0.445295 O\n0.844067 0.311892 0.945266 O\n",
"nsites": 24,
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],
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"density": 4.123749446463848,
"density_atomic": 0.1026750502176353,
"volume": 233.74714645016846,
"volume_molar": 5.865242575713538,
"formula_full": "Li6 Mn4 Cu2 O12",
"formula_reduced": "Li3Mn2CuO6",
"formula_anonymous": "AB2C3D6",
"energy": -161.24911219,
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"spacegroup": 12
},
{
"id": "mp-1193813",
"created_at": "2022-09-04T14:41:34.858796Z",
"structure_string": "Ti3 P4 N1 O18\n1.0\n5.224037 0.000000 0.000000\n-0.278006 8.340339 0.000000\n-0.346444 -2.927970 8.400238\nTi P N O\n3 4 1 18\ndirect\n0.000000 0.000000 0.000000 Ti\n0.736453 0.269911 0.571762 Ti\n0.263547 0.730089 0.428238 Ti\n0.251832 0.125180 0.704534 P\n0.748168 0.874820 0.295466 P\n0.792537 0.681015 0.657835 P\n0.207463 0.318985 0.342165 P\n0.000000 0.500000 0.000000 N\n0.196746 0.074282 0.854434 O\n0.803254 0.925718 0.145566 O\n0.517511 0.217970 0.727615 O\n0.482489 0.782030 0.272385 O\n0.245391 0.966777 0.556026 O\n0.754609 0.033223 0.443974 O\n0.040496 0.245872 0.691386 O\n0.959504 0.754128 0.308614 O\n0.424039 0.278024 0.441910 O\n0.575961 0.721976 0.558090 O\n0.729577 0.512810 0.687653 O\n0.270423 0.487190 0.312347 O\n0.812423 0.827108 0.823028 O\n0.187577 0.172892 0.176972 O\n0.051483 0.675147 0.582157 O\n0.948517 0.324853 0.417843 O\n0.215394 0.801297 0.972276 O\n0.784606 0.198703 0.027724 O\n",
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],
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"density": 2.5837777087254254,
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"volume": 366.000381756769,
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"formula_full": "Ti3 P4 N1 O18",
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"updated_at": "2021-11-28T01:35:24.959000Z",
"spacegroup": 2
}
]
}