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{
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"results": [
{
"id": "mp-1177891",
"created_at": "2022-09-04T14:48:16.169170Z",
"structure_string": "Li8 Mn4 V12 O32\n1.0\n5.999703 -5.989849 0.000000\n5.999703 5.989849 0.000000\n0.019692 0.000000 8.477874\nLi Mn V O\n8 4 12 32\ndirect\n0.873438 0.123070 0.371733 Li\n0.751279 0.247490 0.751595 Li\n0.249098 0.249098 0.249098 Li\n0.123070 0.371733 0.873438 Li\n0.628787 0.628787 0.628787 Li\n0.751595 0.751279 0.247490 Li\n0.247490 0.751595 0.751279 Li\n0.371733 0.873438 0.123070 Li\n0.500696 0.995626 0.498798 Mn\n0.498798 0.500696 0.995626 Mn\n0.995626 0.498798 0.500696 Mn\n0.001538 0.001538 0.001538 Mn\n0.620818 0.122403 0.125348 V\n0.377312 0.123344 0.874850 V\n0.122403 0.125348 0.620818 V\n0.874850 0.377312 0.123344 V\n0.622787 0.371299 0.385374 V\n0.371299 0.385374 0.622787 V\n0.878026 0.623320 0.878326 V\n0.125348 0.620818 0.122403 V\n0.385374 0.622787 0.371299 V\n0.623320 0.878326 0.878026 V\n0.878326 0.878026 0.623320 V\n0.123344 0.874850 0.377312 V\n0.129516 0.105163 0.399411 O\n0.892307 0.099795 0.629370 O\n0.613402 0.114494 0.885724 O\n0.399411 0.129516 0.105163 O\n0.145254 0.120803 0.851147 O\n0.363608 0.145547 0.632901 O\n0.628492 0.138435 0.354788 O\n0.851147 0.145254 0.120803 O\n0.138435 0.354788 0.628492 O\n0.372633 0.352414 0.854690 O\n0.632901 0.363608 0.145547 O\n0.854690 0.372633 0.352414 O\n0.612040 0.371125 0.598586 O\n0.384956 0.384956 0.384956 O\n0.105163 0.399411 0.129516 O\n0.865194 0.393055 0.901909 O\n0.371125 0.598586 0.612040 O\n0.598586 0.612040 0.371125 O\n0.885724 0.613402 0.114494 O\n0.099795 0.629370 0.892307 O\n0.354788 0.628492 0.138435 O\n0.145547 0.632901 0.363608 O\n0.874634 0.647644 0.645458 O\n0.647644 0.645458 0.874634 O\n0.352414 0.854690 0.372633 O\n0.120803 0.851147 0.145254 O\n0.862383 0.862383 0.862383 O\n0.645458 0.874634 0.647644 O\n0.901909 0.865194 0.393055 O\n0.114494 0.885724 0.613402 O\n0.393055 0.901909 0.865194 O\n0.629370 0.892307 0.099795 O\n",
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"elements": [
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"formula_full": "Li8 Mn4 V12 O32",
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"spacegroup": 146
},
{
"id": "mp-1057015",
"created_at": "2022-09-04T14:48:16.190120Z",
"structure_string": "Pb1 S1\n1.0\n3.693328 -2.122348 0.000000\n3.693328 2.122348 0.000000\n2.473734 0.000000 3.467805\nPb S\n1 1\ndirect\n0.984655 0.984655 0.984655 Pb\n0.470945 0.470945 0.470945 S\n",
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"spacegroup": 160
},
{
"id": "mp-756515",
"created_at": "2022-09-04T14:48:16.202820Z",
"structure_string": "Li4 Nb1 Te3 O12\n1.0\n8.934690 0.000000 0.000000\n0.000000 5.051792 0.000000\n0.000000 0.040788 5.355029\nLi Nb Te O\n4 1 3 12\ndirect\n0.310742 0.000000 0.000000 Li\n0.169323 0.500000 0.000000 Li\n0.692887 0.000000 0.500000 Li\n0.801059 0.500000 0.500000 Li\n0.897942 0.000000 0.000000 Nb\n0.592949 0.500000 0.000000 Te\n0.083024 0.000000 0.500000 Te\n0.397449 0.500000 0.500000 Te\n0.741684 0.263381 0.853361 O\n0.431684 0.286100 0.846845 O\n0.062577 0.209643 0.829250 O\n0.584417 0.699499 0.684799 O\n0.900802 0.803432 0.674923 O\n0.235608 0.764919 0.671263 O\n0.235608 0.235081 0.328737 O\n0.900802 0.196568 0.325077 O\n0.584417 0.300501 0.315201 O\n0.062577 0.790357 0.170750 O\n0.431684 0.713900 0.153155 O\n0.741684 0.736619 0.146639 O\n",
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{
"id": "mp-1086",
"created_at": "2022-09-04T14:48:16.215884Z",
"structure_string": "Ta1 C1\n1.0\n0.000000 2.241038 2.241038\n2.241038 0.000000 2.241038\n2.241038 2.241038 0.000000\nTa C\n1 1\ndirect\n0.000000 0.000000 0.000000 Ta\n0.500000 0.500000 0.500000 C\n",
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"density": 14.234280973849424,
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"spacegroup": 225
},
{
"id": "mp-640915",
"created_at": "2022-09-04T14:48:16.224705Z",
"structure_string": "Na8 La4 P4 S8 O28\n1.0\n5.427196 0.000000 0.000000\n0.000000 9.825279 0.000000\n0.000000 0.534114 14.913217\nNa La P S O\n8 4 4 8 28\ndirect\n0.000000 0.500000 0.000000 Na\n0.001179 0.819844 0.597566 Na\n0.500000 0.000000 0.500000 Na\n0.998821 0.180156 0.402434 Na\n0.501179 0.680156 0.402434 Na\n0.500000 0.000000 0.000000 Na\n0.498821 0.319844 0.597566 Na\n0.000000 0.500000 0.500000 Na\n0.467870 0.971406 0.778813 La\n0.967870 0.528594 0.221187 La\n0.032130 0.471406 0.778813 La\n0.532130 0.028594 0.221187 La\n0.524371 0.315392 0.849556 P\n0.475629 0.684608 0.150444 P\n0.975629 0.815392 0.849556 P\n0.024371 0.184608 0.150444 P\n0.984908 0.840445 0.239406 S\n0.485969 0.350835 0.370598 S\n0.484908 0.659555 0.760594 S\n0.514031 0.649165 0.629402 S\n0.515092 0.340445 0.239406 S\n0.014031 0.850835 0.370598 S\n0.985969 0.149165 0.629402 S\n0.015092 0.159555 0.760594 S\n0.231409 0.624758 0.113541 O\n0.988337 0.659006 0.870326 O\n0.488337 0.840994 0.129674 O\n0.017729 0.154117 0.254451 O\n0.731909 0.100928 0.606207 O\n0.768591 0.375242 0.886459 O\n0.982271 0.845883 0.745549 O\n0.297386 0.388103 0.889989 O\n0.473715 0.787247 0.584504 O\n0.231909 0.399072 0.393793 O\n0.011663 0.340994 0.129674 O\n0.731409 0.875242 0.886459 O\n0.511663 0.159006 0.870326 O\n0.172425 0.052158 0.593544 O\n0.202614 0.888103 0.889989 O\n0.973715 0.712753 0.415496 O\n0.268591 0.124758 0.113541 O\n0.827575 0.947842 0.406456 O\n0.702614 0.611897 0.110011 O\n0.482271 0.654117 0.254451 O\n0.517729 0.345883 0.745549 O\n0.797386 0.111897 0.110011 O\n0.268091 0.899072 0.393793 O\n0.327575 0.552158 0.593544 O\n0.026285 0.287247 0.584504 O\n0.672425 0.447842 0.406456 O\n0.768091 0.600928 0.606207 O\n0.526285 0.212753 0.415496 O\n",
"nsites": 52,
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"formula_full": "Na8 La4 P4 S8 O28",
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"spacegroup": 14
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{
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"structure_string": "La4 Cu5 As8\n1.0\n2.905734 -10.223333 0.000000\n2.905734 10.223333 0.000000\n0.000000 0.000000 5.812955\nLa Cu As\n4 5 8\ndirect\n0.622800 0.377200 0.000000 La\n0.122036 0.877964 0.500000 La\n0.878571 0.121429 0.500000 La\n0.378121 0.621879 0.000000 La\n0.994150 0.495112 0.244453 Cu\n0.504888 0.005850 0.755547 Cu\n0.504888 0.005850 0.244453 Cu\n0.994150 0.495112 0.755547 Cu\n0.436980 0.563020 0.500000 Cu\n0.824983 0.175017 0.000000 As\n0.317339 0.682661 0.500000 As\n0.677450 0.322550 0.500000 As\n0.177334 0.822666 0.000000 As\n0.763785 0.760531 0.765019 As\n0.239469 0.236215 0.234981 As\n0.763785 0.760531 0.234981 As\n0.239469 0.236215 0.765019 As\n",
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{
"id": "mp-1193021",
"created_at": "2022-09-04T14:48:16.176158Z",
"structure_string": "Cs12 Sn4 Te12\n1.0\n7.395355 8.962940 0.000000\n-7.395355 8.962940 0.000000\n0.000000 1.146431 10.489482\nCs Sn Te\n12 4 12\ndirect\n0.603950 0.396050 0.250000 Cs\n0.396050 0.603950 0.750000 Cs\n0.914245 0.085755 0.250000 Cs\n0.085755 0.914245 0.750000 Cs\n0.786189 0.403134 0.863805 Cs\n0.596866 0.213811 0.636195 Cs\n0.213811 0.596866 0.136195 Cs\n0.403134 0.786189 0.363805 Cs\n0.754883 0.807770 0.685575 Cs\n0.192230 0.245117 0.814425 Cs\n0.245117 0.192230 0.314425 Cs\n0.807770 0.754883 0.185575 Cs\n0.917233 0.434393 0.454790 Sn\n0.565607 0.082767 0.045210 Sn\n0.082767 0.565607 0.545210 Sn\n0.434393 0.917233 0.954790 Sn\n0.047332 0.581116 0.809148 Te\n0.418884 0.952668 0.690852 Te\n0.952668 0.418884 0.190852 Te\n0.581116 0.047332 0.309148 Te\n0.050231 0.789231 0.423191 Te\n0.210769 0.949769 0.076809 Te\n0.949769 0.210769 0.576809 Te\n0.789231 0.050231 0.923191 Te\n0.687955 0.549092 0.522751 Te\n0.450908 0.312045 0.977249 Te\n0.312045 0.450908 0.477249 Te\n0.549092 0.687955 0.022751 Te\n",
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{
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"created_at": "2022-09-04T14:48:16.181312Z",
"structure_string": "Li4 Fe8 O4 F12\n1.0\n0.006324 4.366123 4.368255\n4.456597 -8.828263 4.471116\n4.373181 4.372438 -0.000009\nLi Fe O F\n4 8 4 12\ndirect\n0.510057 0.530005 0.509994 Li\n0.010068 0.030042 0.010005 Li\n0.364944 0.094987 0.365005 Li\n0.864928 0.594950 0.864990 Li\n0.937507 0.312495 0.437489 Fe\n0.937487 0.312497 0.937510 Fe\n0.937496 0.812495 0.437507 Fe\n0.687139 0.062413 0.687642 Fe\n0.187859 0.562570 0.187352 Fe\n0.437511 0.812499 0.937500 Fe\n0.437495 0.812498 0.437494 Fe\n0.437503 0.312497 0.937496 Fe\n0.576090 0.726537 0.575247 O\n0.076410 0.226630 0.075131 O\n0.298912 0.898469 0.299755 O\n0.798598 0.398371 0.799865 O\n0.554123 0.675167 0.060535 F\n0.053953 0.175119 0.560599 F\n0.814660 0.950540 0.321143 F\n0.314557 0.450533 0.821162 F\n0.560435 0.174432 0.560260 F\n0.060338 0.674418 0.060325 F\n0.320864 0.949841 0.814456 F\n0.821032 0.449885 0.314389 F\n0.814696 0.950589 0.814709 F\n0.314591 0.450589 0.314765 F\n0.560421 0.174467 0.053826 F\n0.060327 0.674464 0.553849 F\n",
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{
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"structure_string": "Sr2 La2 Mg2 Ta2 O12\n1.0\n5.713747 0.000000 0.000000\n0.000000 5.680749 0.000000\n0.000000 5.685418 8.032956\nSr La Mg Ta O\n2 2 2 2 12\ndirect\n0.272723 0.256207 0.749357 Sr\n0.727277 0.256207 0.249357 Sr\n0.215627 0.740309 0.247006 La\n0.784373 0.740309 0.747006 La\n0.252539 0.999286 0.499769 Mg\n0.747461 0.999286 0.999769 Mg\n0.747915 0.500651 0.498981 Ta\n0.252085 0.500651 0.998981 Ta\n0.735568 0.165486 0.742409 O\n0.264432 0.165486 0.242409 O\n0.771247 0.812248 0.257500 O\n0.228753 0.812248 0.757500 O\n0.973409 0.274937 0.461464 O\n0.026591 0.274937 0.961464 O\n0.539916 0.732326 0.545118 O\n0.460084 0.732326 0.045118 O\n0.470234 0.339256 0.454446 O\n0.529766 0.339256 0.954446 O\n0.014024 0.679294 0.543950 O\n0.985976 0.679294 0.043950 O\n",
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{
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}