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{
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"updated_at": "2022-09-04T14:36:36.655518Z",
"structure_string": "Te4 Mo3 W1 Se4\n1.0\n3.442599 0.000000 -0.000000\n-1.721299 2.981381 -0.000023\n-0.000000 -0.000290 36.682376\nTe Mo W Se\n4 3 1 4\ndirect\n0.333343 0.666688 0.332381 Te\n0.333377 0.666754 0.707642 Te\n0.333328 0.666657 0.230985 Te\n0.333359 0.666719 0.606292 Te\n0.333310 0.666620 0.094907 Mo\n0.666670 0.333339 0.281686 Mo\n0.666702 0.333404 0.657003 Mo\n0.333318 0.666637 0.469316 W\n0.666640 0.333279 0.050366 Se\n0.666655 0.333307 0.424522 Se\n0.666648 0.333295 0.139537 Se\n0.666650 0.333300 0.514109 Se\n",
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{
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"structure_string": "Pb2\n1.0\n3.520082 0.000000 -0.000000\n-1.760041 3.048480 0.000000\n0.000000 -0.000000 5.847821\nPb\n2\ndirect\n0.333333 0.666667 0.250000 Pb\n0.666667 0.333333 0.750000 Pb\n",
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{
"id": "jvasp-17815",
"created_at": "2022-09-04T14:37:30.537920Z",
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{
"id": "jvasp-85534",
"created_at": "2022-09-04T14:35:46.694978Z",
"updated_at": "2022-09-04T14:35:46.695005Z",
"structure_string": "Pb4 Se1 Br6\n1.0\n4.256782 0.000057 1.001664\n1.175193 8.154535 4.553146\n-0.068603 -0.168781 9.838541\nPb Se Br\n4 1 6\ndirect\n0.004763 -0.005843 -0.008378 Pb\n0.257282 0.499335 0.981038 Pb\n0.495642 0.533861 0.470032 Pb\n0.765441 0.010708 0.453529 Pb\n0.968955 0.747067 0.310186 Se\n0.359720 0.119184 0.156534 Br\n0.632567 0.819819 0.910330 Br\n0.120845 0.176384 0.576974 Br\n0.888207 0.401980 0.816746 Br\n0.301946 0.762737 0.628534 Br\n0.682066 0.401050 0.229834 Br\n",
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"volume": 345.14847112432693,
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"formula_full": "Pb4 Se1 Br6",
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"formula_anonymous": "AB4C6",
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"spacegroup": 8
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{
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"created_at": "2022-09-04T14:38:10.787709Z",
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"structure_string": "Pb4 Se1 Br6\n1.0\n4.256743 -0.000251 1.001800\n1.174942 8.644123 4.554686\n0.030786 0.049527 9.411794\nPb Se Br\n4 1 6\ndirect\n-0.008620 0.008964 0.005333 Pb\n0.230513 0.547126 0.988879 Pb\n0.500421 0.530607 0.465712 Pb\n0.738583 0.019597 0.500097 Pb\n0.027093 0.690449 0.252465 Se\n0.363555 0.090385 0.179614 Br\n0.636301 0.844047 0.880365 Br\n0.107772 0.183822 0.597559 Br\n0.875114 0.423724 0.823059 Br\n0.313817 0.770854 0.598406 Br\n0.694063 0.372107 0.236807 Br\n",
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"formula_full": "Pb4 Se1 Br6",
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{
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"created_at": "2022-09-04T14:38:18.429067Z",
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"structure_string": "Sn1 Te1 Pb1 Se1\n1.0\n4.270351 -0.000274 6.438548\n1.940903 3.803787 6.438548\n-0.000447 -0.000274 7.725982\nSn Te Pb Se\n1 1 1 1\ndirect\n0.495157 0.495159 0.495158 Sn\n0.247010 0.247011 0.247011 Te\n0.006194 0.006194 0.006194 Pb\n0.751635 0.751639 0.751637 Se\n",
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{
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"structure_string": "K2 Zn2 Sb2\n1.0\n4.576070 0.000000 0.000000\n-2.288035 3.962994 -0.000000\n0.000000 0.000000 10.383511\nK Zn Sb\n2 2 2\ndirect\n0.000000 0.000000 0.000000 K\n0.000000 0.000000 0.500000 K\n0.333332 0.666666 0.750000 Zn\n0.666667 0.333333 0.250000 Zn\n0.333332 0.666666 0.250000 Sb\n0.666667 0.333333 0.750000 Sb\n",
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{
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{
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