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{
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{
"id": "mp-1120806",
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"volume_molar": 17.21665901718116,
"formula_full": "Ba1 Sn32 Se32",
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"updated_at": "2021-11-28T01:37:30.324000Z",
"spacegroup": 8
},
{
"id": "mp-1196224",
"created_at": "2022-09-04T14:46:13.381374Z",
"structure_string": "Ba24 Sn24 Se52\n1.0\n9.393684 0.000000 0.000000\n0.000000 12.677847 0.000000\n0.000000 0.000000 27.454611\nBa Sn Se\n24 24 52\ndirect\n0.507584 0.403548 0.293708 Ba\n0.992416 0.596452 0.793708 Ba\n0.007584 0.096452 0.706292 Ba\n0.492416 0.903548 0.206292 Ba\n0.001619 0.415813 0.293914 Ba\n0.498381 0.584187 0.793914 Ba\n0.501619 0.084187 0.706086 Ba\n0.998381 0.915813 0.206086 Ba\n0.490546 0.921049 0.372854 Ba\n0.009454 0.078951 0.872854 Ba\n0.990546 0.578951 0.627146 Ba\n0.509454 0.421049 0.127146 Ba\n0.999337 0.906458 0.372101 Ba\n0.500663 0.093542 0.872101 Ba\n0.499337 0.593542 0.627899 Ba\n0.000663 0.406458 0.127899 Ba\n0.002169 0.433251 0.464265 Ba\n0.497831 0.566749 0.964265 Ba\n0.502169 0.066749 0.535735 Ba\n0.997831 0.933251 0.035735 Ba\n0.501455 0.429626 0.463033 Ba\n0.998545 0.570374 0.963033 Ba\n0.001455 0.070374 0.536967 Ba\n0.498545 0.929626 0.036967 Ba\n0.245542 0.166741 0.279921 Sn\n0.254458 0.833259 0.779921 Sn\n0.745542 0.333259 0.720079 Sn\n0.754458 0.666741 0.220079 Sn\n0.254231 0.657233 0.367223 Sn\n0.245769 0.342767 0.867223 Sn\n0.754231 0.842767 0.632777 Sn\n0.745769 0.157233 0.132777 Sn\n0.774045 0.168588 0.284177 Sn\n0.725955 0.831412 0.784177 Sn\n0.274045 0.331412 0.715823 Sn\n0.225955 0.668588 0.215823 Sn\n0.724533 0.674379 0.366248 Sn\n0.775467 0.325621 0.866248 Sn\n0.224533 0.825621 0.633752 Sn\n0.275467 0.174379 0.133752 Sn\n0.241217 0.771369 0.497317 Sn\n0.258783 0.228631 0.997317 Sn\n0.741217 0.728631 0.502683 Sn\n0.758783 0.271369 0.002683 Sn\n0.743259 0.160835 0.419909 Sn\n0.756741 0.839165 0.919909 Sn\n0.243259 0.339165 0.580091 Sn\n0.256741 0.660835 0.080091 Sn\n0.011738 0.184238 0.216981 Se\n0.488262 0.815762 0.716981 Se\n0.511738 0.315762 0.783019 Se\n0.988262 0.684238 0.283019 Se\n0.251988 0.461179 0.210946 Se\n0.248012 0.538821 0.710946 Se\n0.751988 0.038821 0.789054 Se\n0.748012 0.961179 0.289054 Se\n0.754032 0.458012 0.211117 Se\n0.745968 0.541988 0.711117 Se\n0.254032 0.041988 0.788883 Se\n0.245968 0.958012 0.288883 Se\n0.484948 0.688580 0.433790 Se\n0.015052 0.311420 0.933790 Se\n0.984948 0.811420 0.566210 Se\n0.515052 0.188580 0.066210 Se\n0.253365 0.448978 0.375299 Se\n0.246635 0.551022 0.875299 Se\n0.753365 0.051022 0.624701 Se\n0.746635 0.948978 0.124701 Se\n0.751475 0.467675 0.376827 Se\n0.748525 0.532325 0.876827 Se\n0.251475 0.032325 0.623173 Se\n0.248525 0.967675 0.123173 Se\n0.510854 0.192916 0.374082 Se\n0.989146 0.807084 0.874082 Se\n0.010854 0.307084 0.625918 Se\n0.489146 0.692916 0.125918 Se\n0.535313 0.680098 0.287618 Se\n0.964687 0.319902 0.787618 Se\n0.035313 0.819902 0.712382 Se\n0.464687 0.180098 0.212382 Se\n0.750084 0.967841 0.453089 Se\n0.749916 0.032159 0.953089 Se\n0.250084 0.532159 0.546911 Se\n0.249916 0.467841 0.046911 Se\n0.040737 0.686229 0.434971 Se\n0.459263 0.313771 0.934971 Se\n0.540737 0.813771 0.565029 Se\n0.959263 0.186229 0.065029 Se\n0.968048 0.186854 0.365896 Se\n0.531952 0.813146 0.865896 Se\n0.468048 0.313146 0.634104 Se\n0.031952 0.686854 0.134104 Se\n0.245554 0.966211 0.457501 Se\n0.254446 0.033789 0.957501 Se\n0.745554 0.533789 0.542499 Se\n0.754446 0.466211 0.042499 Se\n0.754226 0.259132 0.501217 Se\n0.745774 0.740868 0.001217 Se\n0.254226 0.240868 0.498783 Se\n0.245774 0.759132 0.998783 Se\n",
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"volume": 3269.615981604411,
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"updated_at": "2021-11-28T01:37:23.943000Z",
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{
"id": "mp-31307",
"created_at": "2022-09-04T14:43:59.300663Z",
"structure_string": "Ba32 Sn16 Se80\n1.0\n12.571135 0.000000 0.000000\n0.000000 17.593366 0.000000\n0.000000 0.000000 18.447931\nBa Sn Se\n32 16 80\ndirect\n0.363367 0.177449 0.003208 Ba\n0.863367 0.322551 0.996792 Ba\n0.636633 0.677449 0.496792 Ba\n0.136633 0.822551 0.503208 Ba\n0.358425 0.177450 0.253829 Ba\n0.858425 0.322550 0.746171 Ba\n0.641575 0.677450 0.246171 Ba\n0.141575 0.822550 0.753829 Ba\n0.495464 0.427381 0.743451 Ba\n0.995464 0.072619 0.256549 Ba\n0.504536 0.927381 0.756549 Ba\n0.004536 0.572619 0.243451 Ba\n0.489023 0.434484 0.494184 Ba\n0.989023 0.065516 0.505816 Ba\n0.510977 0.934484 0.005816 Ba\n0.010977 0.565516 0.994184 Ba\n0.366314 0.176811 0.753482 Ba\n0.866314 0.323189 0.246518 Ba\n0.633686 0.676811 0.746518 Ba\n0.133686 0.823189 0.253482 Ba\n0.867180 0.317437 0.496488 Ba\n0.367180 0.182563 0.503512 Ba\n0.132820 0.817437 0.003512 Ba\n0.632820 0.682563 0.996488 Ba\n0.005591 0.566505 0.746136 Ba\n0.505591 0.933495 0.253864 Ba\n0.994409 0.066505 0.753864 Ba\n0.494409 0.433495 0.246136 Ba\n0.006946 0.568759 0.493849 Ba\n0.506946 0.931241 0.506151 Ba\n0.993054 0.068759 0.006151 Ba\n0.493054 0.431241 0.993849 Ba\n0.184736 0.371206 0.871383 Sn\n0.684736 0.128794 0.128617 Sn\n0.815264 0.871206 0.628617 Sn\n0.315264 0.628794 0.371383 Sn\n0.181479 0.367352 0.072814 Sn\n0.681479 0.132648 0.927186 Sn\n0.818521 0.867352 0.427186 Sn\n0.318521 0.632648 0.572814 Sn\n0.679371 0.130338 0.328686 Sn\n0.179371 0.369662 0.671314 Sn\n0.320629 0.630338 0.171314 Sn\n0.820629 0.869662 0.828686 Sn\n0.151519 0.314157 0.360044 Sn\n0.651519 0.185843 0.639956 Sn\n0.848481 0.814157 0.139956 Sn\n0.348481 0.685843 0.860044 Sn\n0.357570 0.325199 0.369831 Se\n0.857570 0.174801 0.630169 Se\n0.642430 0.825199 0.130169 Se\n0.142430 0.674801 0.869831 Se\n0.362148 0.324570 0.123623 Se\n0.862148 0.175430 0.876377 Se\n0.637852 0.824570 0.376377 Se\n0.137852 0.675430 0.623623 Se\n0.013918 0.422590 0.368513 Se\n0.513918 0.077410 0.631487 Se\n0.986082 0.922590 0.131487 Se\n0.486082 0.577410 0.868513 Se\n0.508102 0.074987 0.879408 Se\n0.008102 0.425013 0.120592 Se\n0.491898 0.574987 0.620592 Se\n0.991898 0.925013 0.379408 Se\n0.379889 0.315951 0.872877 Se\n0.879889 0.184049 0.127123 Se\n0.620111 0.815951 0.627123 Se\n0.120111 0.684049 0.372877 Se\n0.857486 0.173998 0.381014 Se\n0.357486 0.326002 0.618986 Se\n0.142514 0.673998 0.118986 Se\n0.642514 0.826002 0.881014 Se\n0.489842 0.075248 0.131492 Se\n0.989842 0.424752 0.868508 Se\n0.510158 0.575248 0.368508 Se\n0.010158 0.924752 0.631492 Se\n0.621118 0.238429 0.241861 Se\n0.121118 0.261571 0.758139 Se\n0.378882 0.738429 0.258139 Se\n0.878882 0.761571 0.741861 Se\n0.188247 0.101282 0.128324 Se\n0.688247 0.398718 0.871676 Se\n0.811753 0.601282 0.371676 Se\n0.311753 0.898718 0.628324 Se\n0.508268 0.076625 0.383098 Se\n0.008268 0.423375 0.616902 Se\n0.491732 0.576625 0.116902 Se\n0.991732 0.923375 0.883098 Se\n0.239028 0.474411 0.761799 Se\n0.739028 0.025589 0.238201 Se\n0.760972 0.974411 0.738201 Se\n0.260972 0.525589 0.261799 Se\n0.621392 0.237129 0.019866 Se\n0.121392 0.262871 0.980134 Se\n0.378608 0.737129 0.480134 Se\n0.878608 0.762871 0.519866 Se\n0.188741 0.103709 0.387401 Se\n0.688741 0.396291 0.612599 Se\n0.811259 0.603709 0.112599 Se\n0.311259 0.896291 0.887401 Se\n0.187610 0.107401 0.880374 Se\n0.687610 0.392599 0.119626 Se\n0.812390 0.607401 0.619626 Se\n0.312390 0.892599 0.380374 Se\n0.239386 0.472691 0.981239 Se\n0.739386 0.027309 0.018761 Se\n0.760614 0.972691 0.518761 Se\n0.260614 0.527309 0.481239 Se\n0.811068 0.608402 0.873585 Se\n0.311068 0.891598 0.126415 Se\n0.188932 0.108402 0.626415 Se\n0.688932 0.391598 0.373585 Se\n0.248743 0.996059 0.053229 Se\n0.748743 0.503941 0.946771 Se\n0.751257 0.496059 0.446771 Se\n0.251257 0.003941 0.553229 Se\n0.250381 0.997283 0.306701 Se\n0.750381 0.502717 0.693299 Se\n0.749619 0.497283 0.193299 Se\n0.249619 0.002717 0.806701 Se\n0.112451 0.234099 0.474077 Se\n0.612451 0.265901 0.525923 Se\n0.887549 0.734099 0.025923 Se\n0.387549 0.765901 0.974077 Se\n0.110357 0.248448 0.238674 Se\n0.610357 0.251552 0.761326 Se\n0.889643 0.748448 0.261326 Se\n0.389643 0.751552 0.738674 Se\n",
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"volume": 4080.1026864279265,
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"formula_full": "Ba32 Sn16 Se80",
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"updated_at": "2021-11-28T01:36:09.051000Z",
"spacegroup": 19
},
{
"id": "mp-1200486",
"created_at": "2022-09-04T14:44:22.994984Z",
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{
"id": "mp-1193757",
"created_at": "2022-09-04T14:46:12.456902Z",
"structure_string": "Ba4 Sm8 Se16\n1.0\n4.294818 0.000000 0.000000\n0.000000 13.016861 0.000000\n0.000000 0.000000 15.440778\nBa Sm Se\n4 8 16\ndirect\n0.250000 0.756557 0.336989 Ba\n0.250000 0.256557 0.163011 Ba\n0.750000 0.243443 0.663011 Ba\n0.750000 0.743443 0.836989 Ba\n0.250000 0.432086 0.390715 Sm\n0.250000 0.932086 0.109285 Sm\n0.750000 0.567914 0.609285 Sm\n0.750000 0.067914 0.890715 Sm\n0.250000 0.420032 0.899927 Sm\n0.250000 0.920032 0.600073 Sm\n0.750000 0.579968 0.100073 Sm\n0.750000 0.079968 0.399927 Sm\n0.250000 0.206990 0.829209 Se\n0.250000 0.706990 0.670791 Se\n0.750000 0.793010 0.170791 Se\n0.750000 0.293010 0.329209 Se\n0.250000 0.128746 0.525577 Se\n0.250000 0.628746 0.974423 Se\n0.750000 0.871254 0.474423 Se\n0.750000 0.371254 0.025577 Se\n0.250000 0.524064 0.216289 Se\n0.250000 0.024064 0.283711 Se\n0.750000 0.475936 0.783711 Se\n0.750000 0.975936 0.716289 Se\n0.250000 0.416911 0.578081 Se\n0.250000 0.916911 0.921919 Se\n0.750000 0.583089 0.421919 Se\n0.750000 0.083089 0.078081 Se\n",
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