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"id": "jvasp-100759",
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"structure_string": "Ta1 Tc2 Ge1\n1.0\n3.827245 -0.000000 2.209661\n1.275748 3.608361 2.209661\n-0.000000 -0.000000 4.419322\nTa Tc Ge\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Ta\n0.749999 0.750000 0.750000 Tc\n0.250000 0.250000 0.250000 Tc\n0.500000 0.500000 0.500000 Ge\n",
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{
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{
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"updated_at": "2022-09-04T14:38:07.803498Z",
"structure_string": "Ta3 Te6\n1.0\n3.690441 0.000062 -0.000025\n-1.845241 6.978399 -2.718339\n0.000062 -0.031892 9.534985\nTa Te\n3 6\ndirect\n0.363027 0.720783 0.709039 Ta\n0.640836 0.276376 0.289518 Ta\n0.001914 0.998577 0.999274 Ta\n0.354194 0.703130 0.985539 Te\n0.649647 0.294032 0.013019 Te\n0.706422 0.407618 0.619882 Te\n0.996017 0.986757 0.692089 Te\n0.007855 0.010403 0.306467 Te\n0.297377 0.589546 0.378672 Te\n",
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{
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"updated_at": "2022-09-04T14:38:30.825624Z",
"structure_string": "Ta9 Te18\n1.0\n8.958415 0.033740 2.702735\n2.144200 8.698087 2.702735\n0.035331 0.027786 9.493615\nTa Te\n9 18\ndirect\n0.000000 0.000000 0.000000 Ta\n0.695653 0.304347 -0.000000 Ta\n0.361801 0.361801 0.291543 Ta\n0.638199 0.638200 0.708456 Ta\n0.697615 0.020815 0.288650 Ta\n0.979184 0.302385 0.711349 Ta\n0.302384 0.979185 0.711349 Ta\n0.020815 0.697616 0.288650 Ta\n0.304347 0.695653 -0.000000 Ta\n0.685783 0.008653 0.011270 Te\n0.634498 0.634499 0.989311 Te\n0.365502 0.365502 0.010687 Te\n0.679022 0.337355 0.692238 Te\n0.959968 0.627392 0.621528 Te\n0.337354 0.679023 0.692238 Te\n0.993008 0.993009 0.309659 Te\n0.006991 0.006991 0.690340 Te\n0.991346 0.314217 0.988728 Te\n0.314216 0.991348 0.988728 Te\n0.008653 0.685784 0.011270 Te\n0.297549 0.297550 0.623199 Te\n0.702450 0.702451 0.376799 Te\n0.627391 0.959969 0.621527 Te\n0.040031 0.372609 0.378471 Te\n0.372608 0.040031 0.378471 Te\n0.320978 0.662646 0.307761 Te\n0.662645 0.320978 0.307761 Te\n",
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"created_at": "2022-09-04T14:38:32.630661Z",
"updated_at": "2022-09-04T14:38:32.630678Z",
"structure_string": "Ta2 Te8\n1.0\n6.627112 -0.000000 -0.000000\n0.000000 6.627112 0.000000\n0.000000 0.000000 6.880575\nTa Te\n2 8\ndirect\n0.000000 0.000000 0.750000 Ta\n0.000000 0.000000 0.250000 Ta\n0.323540 0.143193 0.500000 Te\n0.676460 0.856807 0.500000 Te\n0.143193 0.323540 0.000000 Te\n0.676460 0.143193 0.000000 Te\n0.323540 0.856807 0.000000 Te\n0.856807 0.676460 0.000000 Te\n0.856807 0.323540 0.500000 Te\n0.143193 0.676460 0.500000 Te\n",
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"volume": 302.1853138112826,
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{
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"created_at": "2022-09-04T14:35:56.570500Z",
"updated_at": "2022-09-04T14:35:56.570517Z",
"structure_string": "Ta2 Te8 I2\n1.0\n6.614387 0.019926 -1.472057\n-2.233485 7.022393 -3.005136\n-0.021671 0.000891 8.572797\nTa Te I\n2 8 2\ndirect\n0.750551 0.998626 0.001199 Ta\n0.249451 0.001374 0.998801 Ta\n0.118601 0.328992 0.167928 Te\n0.035127 0.881527 0.212897 Te\n0.382684 0.855286 0.689791 Te\n0.617317 0.144713 0.310209 Te\n0.881400 0.671008 0.832071 Te\n0.537745 0.252653 0.923624 Te\n0.462256 0.747347 0.076375 Te\n0.964874 0.118473 0.787102 Te\n0.249449 0.400186 0.574107 I\n0.750552 0.599814 0.425893 I\n",
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"elements": [
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"density": 6.821398403038297,
"density_atomic": 0.030122312299377087,
"volume": 398.37579136473374,
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"formula_full": "Ta2 Te8 I2",
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"created_at": "2022-09-04T14:37:37.535906Z",
"updated_at": "2022-09-04T14:37:37.535928Z",
"structure_string": "Ta4 Te16 Ir4\n1.0\n3.842058 0.000000 0.000000\n0.000000 12.618295 0.000000\n0.000000 0.000000 13.471993\nTa Te Ir\n4 16 4\ndirect\n0.000000 0.553611 0.003880 Ta\n0.500000 0.446388 0.503880 Ta\n0.000000 0.771385 0.491445 Ta\n0.500000 0.228615 0.991445 Ta\n0.500000 0.085307 0.137254 Te\n0.000000 0.914693 0.637254 Te\n0.500000 0.155825 0.595322 Te\n0.000000 0.844175 0.095322 Te\n0.500000 0.307282 0.354501 Te\n0.000000 0.692717 0.854501 Te\n0.500000 0.434563 0.891567 Te\n0.000000 0.565437 0.391567 Te\n0.000000 0.064960 0.395875 Te\n0.500000 0.935039 0.895875 Te\n0.000000 0.177775 0.849311 Te\n0.500000 0.822225 0.349311 Te\n0.000000 0.347207 0.105964 Te\n0.500000 0.652792 0.605964 Te\n0.000000 0.395774 0.646134 Te\n0.500000 0.604225 0.146135 Te\n0.000000 0.034250 -0.000185 Ir\n0.500000 0.965749 0.499815 Ir\n0.000000 0.255205 0.491989 Ir\n0.500000 0.744795 0.991989 Ir\n",
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{
"id": "jvasp-13990",
"created_at": "2022-09-04T14:36:04.566853Z",
"updated_at": "2022-09-04T14:36:04.566867Z",
"structure_string": "Ta2 Te10 Pt2\n1.0\n3.782283 0.000000 0.000000\n-1.891142 6.802384 -0.000000\n0.000000 0.000000 15.687891\nTa Te Pt\n2 10 2\ndirect\n0.489007 0.978013 0.750000 Ta\n0.510992 0.021987 0.250000 Ta\n0.831653 0.663308 0.750000 Te\n0.168346 0.336691 0.250000 Te\n0.609490 0.218981 0.080384 Te\n0.390509 0.781018 0.919616 Te\n0.100391 0.200783 0.851399 Te\n0.899608 0.799217 0.148601 Te\n0.899608 0.799217 0.351399 Te\n0.100391 0.200783 0.648601 Te\n0.609490 0.218981 0.419616 Te\n0.390509 0.781018 0.580384 Te\n0.000000 0.000000 0.000000 Pt\n0.000000 0.000000 0.500000 Pt\n",
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"structure_string": "Ta2 Te4 Br12\n1.0\n6.768955 -0.426230 -0.173109\n0.979436 6.993244 -0.190259\n2.066727 1.031821 12.315749\nTa Te Br\n2 4 12\ndirect\n0.793339 0.323670 0.818488 Ta\n0.206663 0.676330 0.181512 Ta\n0.252838 0.157234 0.528085 Te\n0.747164 0.842766 0.471915 Te\n0.426547 0.845216 0.631152 Te\n0.573454 0.154783 0.368848 Te\n0.484457 0.149088 0.863452 Br\n0.515545 0.850912 0.136548 Br\n0.698275 0.405986 0.620392 Br\n0.301727 0.594014 0.379608 Br\n0.883815 0.525099 0.253323 Br\n0.960245 0.005649 0.743538 Br\n0.039757 0.994350 0.256462 Br\n0.377726 0.369062 0.130439 Br\n0.094059 0.753970 0.004593 Br\n0.905943 0.246029 0.995407 Br\n0.116187 0.474900 0.746677 Br\n0.622276 0.630938 0.869561 Br\n",
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{
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"updated_at": "2022-09-04T14:38:31.785201Z",
"structure_string": "Ta2 Te2 Br18\n1.0\n0.000000 6.599807 0.018754\n11.386083 0.000000 0.000000\n0.000000 -2.261818 -9.668311\nTa Te Br\n2 2 18\ndirect\n0.636830 0.250000 0.136263 Ta\n0.363170 0.750000 0.863737 Ta\n0.758791 0.250000 0.540005 Te\n0.241209 0.750000 0.459996 Te\n0.965504 0.418761 0.676599 Br\n0.034496 0.918760 0.323401 Br\n0.243143 0.590105 0.990634 Br\n0.756857 0.090105 0.009367 Br\n0.756857 0.409895 0.009367 Br\n0.243143 0.909895 0.990634 Br\n0.001922 0.250000 0.314399 Br\n-0.001922 0.750000 0.685601 Br\n0.543507 0.750000 0.339272 Br\n0.965504 0.081239 0.676599 Br\n0.277071 0.250000 -0.000115 Br\n0.722929 0.750000 0.000115 Br\n0.466454 0.905666 0.693591 Br\n0.533546 0.405666 0.306410 Br\n0.533546 0.094334 0.306410 Br\n0.466454 0.594334 0.693591 Br\n0.456494 0.250000 0.660728 Br\n0.034496 0.581239 0.323401 Br\n",
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{
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"created_at": "2022-09-04T14:36:11.335600Z",
"updated_at": "2022-09-04T14:36:11.335617Z",
"structure_string": "Ta2 Te2 Br18\n1.0\n6.599774 -0.034666 0.000000\n-2.238506 9.673726 0.000000\n0.000000 0.000000 11.386106\nTa Te Br\n2 2 18\ndirect\n0.636832 0.136265 0.750000 Ta\n0.363166 0.863735 0.250000 Ta\n0.758792 0.540005 0.750000 Te\n0.241207 0.459995 0.250000 Te\n0.965503 0.676600 0.581239 Br\n0.034496 0.323400 0.081239 Br\n0.034496 0.323400 0.418761 Br\n0.965503 0.676600 0.918761 Br\n0.756858 0.009367 0.590106 Br\n0.243141 0.990633 0.090106 Br\n0.243141 0.990633 0.409894 Br\n0.533548 0.306411 0.594335 Br\n0.001924 0.314402 0.750000 Br\n0.543501 0.339269 0.250000 Br\n0.456497 0.660731 0.750000 Br\n0.722922 0.000114 0.250000 Br\n0.277077 -0.000115 0.750000 Br\n0.533548 0.306411 0.905666 Br\n0.466451 0.693589 0.405665 Br\n0.466451 0.693589 0.094335 Br\n-0.001924 0.685599 0.250000 Br\n0.756858 0.009367 0.909895 Br\n",
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]
}