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{
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"results": [
{
"id": "mp-603907",
"created_at": "2022-09-04T14:42:13.133928Z",
"structure_string": "Mg4 Si4 O12\n1.0\n4.115451 4.871174 0.000000\n-4.115451 4.871174 0.000000\n0.000000 0.664672 4.849589\nMg Si O\n4 4 12\ndirect\n0.112304 0.887696 0.250000 Mg\n0.692824 0.307176 0.250000 Mg\n0.887696 0.112304 0.750000 Mg\n0.307176 0.692824 0.750000 Mg\n0.326735 0.167247 0.527731 Si\n0.673265 0.832753 0.472269 Si\n0.832753 0.673265 0.972269 Si\n0.167247 0.326735 0.027731 Si\n0.935838 0.800796 0.630784 O\n0.711940 0.603713 0.303174 O\n0.895123 0.385039 0.925354 O\n0.800796 0.935838 0.130784 O\n0.199204 0.064162 0.869216 O\n0.603713 0.711940 0.803174 O\n0.104877 0.614961 0.074646 O\n0.385039 0.895123 0.425354 O\n0.614961 0.104877 0.574646 O\n0.396287 0.288060 0.196826 O\n0.288060 0.396287 0.696826 O\n0.064162 0.199204 0.369216 O\n",
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{
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"structure_string": "Mg8 Si8 O24\n1.0\n0.000000 0.000000 -5.385009\n0.000000 -8.832554 0.000000\n-9.393232 0.000000 0.000000\nMg Si O\n8 8 24\ndirect\n0.761740 0.486968 0.997077 Mg\n0.238260 0.513032 0.497077 Mg\n0.738260 0.986968 0.497077 Mg\n0.261740 0.013032 0.997077 Mg\n0.264238 0.651054 0.001035 Mg\n0.735762 0.348946 0.501035 Mg\n0.235762 0.151054 0.501035 Mg\n0.764238 0.848946 0.001035 Mg\n0.570662 0.657831 0.708373 Si\n0.429338 0.342169 0.208373 Si\n0.929338 0.157831 0.208373 Si\n0.070662 0.842169 0.708373 Si\n0.568077 0.159609 0.789783 Si\n0.431923 0.840391 0.289783 Si\n0.931923 0.659609 0.289783 Si\n0.068077 0.340391 0.789783 Si\n0.586691 0.654865 0.881920 O\n0.413309 0.345135 0.381920 O\n0.913309 0.154865 0.381920 O\n0.086691 0.845135 0.881920 O\n0.313873 0.744789 0.650563 O\n0.686127 0.255211 0.150563 O\n0.186127 0.244789 0.150563 O\n0.813873 0.755211 0.650563 O\n0.546617 0.499457 0.624441 O\n0.453383 0.500543 0.124441 O\n0.953383 0.999457 0.124441 O\n0.046617 0.000543 0.624441 O\n0.568001 0.155031 0.616175 O\n0.431999 0.844969 0.116175 O\n0.931999 0.655031 0.116175 O\n0.068001 0.344969 0.616175 O\n0.286744 0.219812 0.845299 O\n0.713256 0.780188 0.345299 O\n0.213256 0.719812 0.345299 O\n0.786744 0.280188 0.845299 O\n0.582767 0.003904 0.877935 O\n0.417233 0.996096 0.377935 O\n0.917233 0.503904 0.377935 O\n0.082767 0.496096 0.877935 O\n",
"nsites": 40,
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"elements": [
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"density": 2.9849436098270083,
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"volume": 446.77388918539316,
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"formula_full": "Mg8 Si8 O24",
"formula_reduced": "MgSiO3",
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"energy": -303.96379817,
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"updated_at": "2021-11-28T01:35:38.882000Z",
"spacegroup": 33
},
{
"id": "mp-3470",
"created_at": "2022-09-04T14:42:29.423780Z",
"structure_string": "Mg8 Si8 O24\n1.0\n8.943340 0.000000 0.000000\n0.000000 5.237836 0.000000\n0.000000 2.127729 9.230773\nMg Si O\n8 8 24\ndirect\n0.652261 0.968448 0.251012 Mg\n0.152261 0.531552 0.748988 Mg\n0.347739 0.031552 0.748988 Mg\n0.847739 0.468448 0.251012 Mg\n0.011273 0.961890 0.254295 Mg\n0.511273 0.538110 0.745705 Mg\n0.988727 0.038110 0.745705 Mg\n0.488727 0.461890 0.254295 Mg\n0.340384 0.251912 0.043667 Si\n0.840384 0.248088 0.956333 Si\n0.659616 0.748088 0.956333 Si\n0.159616 0.751912 0.043667 Si\n0.837192 0.680570 0.552055 Si\n0.337192 0.819430 0.447945 Si\n0.162808 0.319430 0.447945 Si\n0.662808 0.180570 0.552055 Si\n0.804094 0.354887 0.603514 O\n0.304094 0.145113 0.396486 O\n0.195906 0.645113 0.396486 O\n0.695906 0.854887 0.603514 O\n0.517630 0.254148 0.634744 O\n0.017630 0.245852 0.365256 O\n0.482370 0.745852 0.365256 O\n0.982370 0.754148 0.634744 O\n0.659610 0.251909 0.374635 O\n0.159610 0.248091 0.625365 O\n0.340390 0.748091 0.625365 O\n0.840390 0.751909 0.374635 O\n0.219199 0.010629 0.105851 O\n0.719199 0.489371 0.894149 O\n0.780801 0.989371 0.894149 O\n0.280801 0.510629 0.105851 O\n0.339322 0.316869 0.867021 O\n0.839322 0.183131 0.132979 O\n0.660678 0.683131 0.132979 O\n0.160678 0.816869 0.867021 O\n0.499245 0.200002 0.123836 O\n0.999245 0.299998 0.876164 O\n0.500755 0.799998 0.876164 O\n0.000755 0.700002 0.123836 O\n",
"nsites": 40,
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"elements": [
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],
"chemical_system": "Mg-O-Si",
"density": 3.08414086453738,
"density_atomic": 0.09250608094502005,
"volume": 432.4040062163432,
"volume_molar": 6.509994476556836,
"formula_full": "Mg8 Si8 O24",
"formula_reduced": "MgSiO3",
"formula_anonymous": "ABC3",
"energy": -304.13174277,
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"updated_at": "2021-11-28T01:35:48.575000Z",
"spacegroup": 14
},
{
"id": "mp-1233496",
"created_at": "2022-09-04T14:42:59.794021Z",
"structure_string": "Mg1 Si8 O16\n1.0\n7.197030 0.000000 0.000000\n0.000000 7.197330 0.000000\n0.000000 0.000000 8.928483\nMg Si O\n1 8 16\ndirect\n0.000000 0.000000 0.500000 Mg\n0.780999 0.500000 0.180066 Si\n0.500000 0.781289 0.679993 Si\n0.500000 0.218711 0.679993 Si\n0.780999 0.500000 0.819934 Si\n0.219001 0.500000 0.819934 Si\n0.219001 0.500000 0.180066 Si\n0.500000 0.781289 0.320007 Si\n0.500000 0.218711 0.320007 Si\n0.685866 0.314057 0.249887 O\n0.685866 0.685943 0.750113 O\n0.314134 0.314057 0.750113 O\n0.314134 0.685943 0.249887 O\n0.314134 0.685943 0.750113 O\n0.314134 0.314057 0.249887 O\n0.685866 0.685943 0.249887 O\n0.685866 0.314057 0.750113 O\n0.752163 0.500000 0.000000 O\n0.500000 0.751424 0.500000 O\n0.500000 0.248576 0.500000 O\n0.247837 0.500000 0.000000 O\n0.000000 0.500000 0.222249 O\n0.500000 0.000000 0.722742 O\n0.000000 0.500000 0.777751 O\n0.500000 0.000000 0.277258 O\n",
"nsites": 25,
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"elements": [
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"Si",
"O"
],
"chemical_system": "Mg-O-Si",
"density": 1.8130941419030915,
"density_atomic": 0.05405521560604801,
"volume": 462.49006168431333,
"volume_molar": 11.140721006256072,
"formula_full": "Mg1 Si8 O16",
"formula_reduced": "Mg(SiO2)8",
"formula_anonymous": "AB8C16",
"energy": -200.70631583,
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"updated_at": "2021-11-28T01:36:04.691000Z",
"spacegroup": 47
},
{
"id": "mp-1196427",
"created_at": "2022-09-04T14:43:12.576702Z",
"structure_string": "Mg14 Si4 O28\n1.0\n3.943845 -6.830940 0.000000\n3.943845 6.830940 0.000000\n0.000000 0.000000 9.800910\nMg Si O\n14 4 28\ndirect\n0.077626 0.463104 0.116890 Mg\n0.536896 0.614522 0.116890 Mg\n0.385478 0.922374 0.116890 Mg\n0.922374 0.536896 0.616890 Mg\n0.463104 0.385478 0.616890 Mg\n0.614522 0.077626 0.616890 Mg\n0.024857 0.241233 0.387602 Mg\n0.758767 0.783624 0.387602 Mg\n0.216376 0.975143 0.387602 Mg\n0.975143 0.758767 0.887602 Mg\n0.241233 0.216376 0.887602 Mg\n0.783624 0.024857 0.887602 Mg\n0.333333 0.666667 0.413157 Mg\n0.666667 0.333333 0.913157 Mg\n0.666667 0.333333 0.329830 Si\n0.333333 0.666667 0.829830 Si\n0.000000 0.000000 0.100583 Si\n0.000000 0.000000 0.600583 Si\n0.824613 0.026052 0.526668 O\n0.973948 0.798560 0.526668 O\n0.201440 0.175387 0.526668 O\n0.175387 0.973948 0.026668 O\n0.026052 0.201440 0.026668 O\n0.798560 0.824613 0.026668 O\n0.612510 0.085359 0.000356 O\n0.914641 0.527150 0.000356 O\n0.472850 0.387490 0.000356 O\n0.387490 0.914641 0.500356 O\n0.085359 0.472850 0.500356 O\n0.527150 0.612510 0.500356 O\n0.861139 0.323798 0.274380 O\n0.676202 0.537341 0.274380 O\n0.462659 0.138861 0.274380 O\n0.138861 0.676202 0.774380 O\n0.323798 0.462659 0.774380 O\n0.537341 0.861139 0.774380 O\n0.282169 0.471115 0.255768 O\n0.528885 0.811054 0.255768 O\n0.188946 0.717831 0.255768 O\n0.717831 0.528885 0.755768 O\n0.471115 0.188946 0.755768 O\n0.811054 0.282169 0.755768 O\n0.666667 0.333333 0.499466 O\n0.333333 0.666667 0.999466 O\n0.000000 0.000000 0.268990 O\n0.000000 0.000000 0.768990 O\n",
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"density": 2.8319267760516174,
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"formula_full": "Mg14 Si4 O28",
"formula_reduced": "Mg7(SiO7)2",
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"energy": -299.57116163,
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"updated_at": "2021-11-28T01:35:56.784000Z",
"spacegroup": 173
},
{
"id": "mp-5639",
"created_at": "2022-09-04T14:43:14.276982Z",
"structure_string": "Mg4 Si2 O8\n1.0\n0.000000 4.076690 4.076690\n4.076690 0.000000 4.076690\n4.076690 4.076690 0.000000\nMg Si O\n4 2 8\ndirect\n0.625000 0.625000 0.125000 Mg\n0.625000 0.125000 0.625000 Mg\n0.125000 0.625000 0.625000 Mg\n0.625000 0.625000 0.625000 Mg\n0.250000 0.250000 0.250000 Si\n0.000000 0.000000 0.000000 Si\n0.880935 0.880935 0.357194 O\n0.880935 0.357194 0.880935 O\n0.357194 0.880935 0.880935 O\n0.880935 0.880935 0.880935 O\n0.369065 0.369065 0.892806 O\n0.369065 0.892806 0.369065 O\n0.892806 0.369065 0.369065 O\n0.369065 0.369065 0.369065 O\n",
"nsites": 14,
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"elements": [
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"density": 3.4482506933238994,
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"volume": 135.50429462879865,
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"formula_full": "Mg4 Si2 O8",
"formula_reduced": "Mg2SiO4",
"formula_anonymous": "AB2C4",
"energy": -100.9360797,
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"updated_at": "2021-11-28T01:36:03.280000Z",
"spacegroup": 227
},
{
"id": "mp-556940",
"created_at": "2022-09-04T14:47:10.598737Z",
"structure_string": "Mg16 Si16 O48\n1.0\n5.290159 0.000000 0.000000\n0.000000 9.185069 0.000000\n0.000000 0.000000 18.429241\nMg Si O\n16 16 48\ndirect\n0.644171 0.155325 0.389827 Mg\n0.144171 0.344675 0.389827 Mg\n0.154576 0.495527 0.133572 Mg\n0.855829 0.155325 0.889827 Mg\n0.654576 0.504473 0.366428 Mg\n0.644171 0.655325 0.110173 Mg\n0.845424 0.004473 0.633572 Mg\n0.144171 0.844675 0.110173 Mg\n0.154576 0.995527 0.366428 Mg\n0.654576 0.004473 0.133572 Mg\n0.355829 0.844675 0.610173 Mg\n0.345424 0.495527 0.633572 Mg\n0.345424 0.995527 0.866428 Mg\n0.355829 0.344675 0.889827 Mg\n0.855829 0.655325 0.610173 Mg\n0.845424 0.504473 0.866428 Mg\n0.577784 0.782756 0.740456 Si\n0.577784 0.282756 0.759544 Si\n0.201755 0.166042 0.034824 Si\n0.298245 0.666042 0.965176 Si\n0.922216 0.282756 0.259544 Si\n0.922216 0.782756 0.240456 Si\n0.077784 0.717244 0.740456 Si\n0.077784 0.217244 0.759544 Si\n0.798245 0.833958 0.965176 Si\n0.701755 0.333958 0.034824 Si\n0.422216 0.217244 0.259544 Si\n0.798245 0.333958 0.534824 Si\n0.298245 0.166042 0.534824 Si\n0.701755 0.833958 0.465176 Si\n0.422216 0.717244 0.240456 Si\n0.201755 0.666042 0.465176 Si\n0.196504 0.655933 0.553991 O\n0.678650 0.232881 0.206707 O\n0.681845 0.971415 0.923056 O\n0.929437 0.440409 0.298738 O\n0.540755 0.171170 0.827734 O\n0.178650 0.267119 0.206707 O\n0.681845 0.471415 0.576944 O\n0.181845 0.028585 0.576944 O\n0.040755 0.328830 0.827734 O\n0.929437 0.940409 0.201262 O\n0.070563 0.059591 0.798738 O\n0.318155 0.528585 0.423056 O\n0.959245 0.671170 0.172266 O\n0.070563 0.559591 0.701262 O\n0.821350 0.732881 0.793293 O\n0.459245 0.828830 0.172266 O\n0.892864 0.192096 0.058437 O\n0.696504 0.844067 0.553991 O\n0.196504 0.155933 0.946009 O\n0.303496 0.155933 0.446009 O\n0.892864 0.692096 0.441563 O\n0.107136 0.807904 0.941563 O\n0.607136 0.192096 0.558437 O\n0.821350 0.232881 0.706707 O\n0.607136 0.692096 0.941563 O\n0.959245 0.171170 0.327734 O\n0.678650 0.732881 0.293293 O\n0.803496 0.844067 0.053991 O\n0.321350 0.767119 0.793293 O\n0.570563 0.440409 0.798738 O\n0.181845 0.528585 0.923056 O\n0.803496 0.344067 0.446009 O\n0.696504 0.344067 0.946009 O\n0.429437 0.059591 0.298738 O\n0.459245 0.328830 0.327734 O\n0.040755 0.828830 0.672266 O\n0.321350 0.267119 0.706707 O\n0.318155 0.028585 0.076944 O\n0.392864 0.307904 0.058437 O\n0.392864 0.807904 0.441563 O\n0.429437 0.559591 0.201262 O\n0.178650 0.767119 0.293293 O\n0.818155 0.971415 0.423056 O\n0.818155 0.471415 0.076944 O\n0.540755 0.671170 0.672266 O\n0.107136 0.307904 0.558437 O\n0.570563 0.940409 0.701262 O\n0.303496 0.655933 0.053991 O\n",
"nsites": 80,
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"elements": [
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],
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"density": 2.978484282043063,
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"volume": 895.4855821140897,
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"formula_full": "Mg16 Si16 O48",
"formula_reduced": "MgSiO3",
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"spacegroup": 61
},
{
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