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{
"id": "jvasp-98840",
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"updated_at": "2022-09-04T14:36:05.452654Z",
"structure_string": "Zr16 Cu8\n1.0\n7.506850 -0.000000 4.334082\n2.502284 7.077526 4.334082\n-0.000000 -0.000000 8.668163\nZr Cu\n16 8\ndirect\n0.940281 0.940283 0.309717 Zr\n0.500000 0.500000 -0.000000 Zr\n0.500000 0.000000 0.500000 Zr\n-0.000000 0.500000 0.500000 Zr\n0.059717 0.690283 0.059718 Zr\n0.309717 0.940283 0.940282 Zr\n0.059717 0.690283 0.690282 Zr\n0.309717 0.940283 0.309717 Zr\n0.690282 0.059718 0.059718 Zr\n0.309718 0.309718 0.940282 Zr\n0.940282 0.309718 0.940282 Zr\n0.059718 0.059718 0.690282 Zr\n0.690282 0.059718 0.690282 Zr\n0.690282 0.690283 0.059718 Zr\n0.940282 0.309718 0.309717 Zr\n0.500000 0.500000 0.500000 Zr\n0.709407 0.371779 0.709407 Cu\n0.709407 0.709408 0.371778 Cu\n0.371778 0.709408 0.709407 Cu\n0.290593 0.290593 0.290593 Cu\n0.290593 0.290593 0.628221 Cu\n0.628221 0.290593 0.290592 Cu\n0.290592 0.628222 0.290592 Cu\n0.709407 0.709408 0.709407 Cu\n",
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{
"id": "jvasp-20625",
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"structure_string": "Zr1 Cu1\n1.0\n3.265114 0.000000 -0.000000\n0.000000 3.265114 -0.000000\n0.000000 0.000000 3.265114\nZr Cu\n1 1\ndirect\n0.499999 0.499999 0.499999 Zr\n0.000000 0.000000 0.000000 Cu\n",
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{
"id": "jvasp-78780",
"created_at": "2022-09-04T14:36:36.790632Z",
"updated_at": "2022-09-04T14:36:36.790646Z",
"structure_string": "Zr1 Cu1\n1.0\n3.267806 0.000000 -0.000000\n0.000000 3.267806 0.000000\n-0.000000 0.000000 3.267806\nZr Cu\n1 1\ndirect\n0.500001 0.500001 0.500001 Zr\n0.000000 0.000000 0.000000 Cu\n",
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},
{
"id": "jvasp-18691",
"created_at": "2022-09-04T14:36:31.502712Z",
"updated_at": "2022-09-04T14:36:31.502727Z",
"structure_string": "Zr1 Cu5\n1.0\n4.230068 -0.000000 2.442231\n1.410022 3.988146 2.442231\n0.000000 0.000000 4.884461\nZr Cu\n1 5\ndirect\n0.000000 0.000000 0.000000 Zr\n0.250000 0.250000 0.250000 Cu\n0.624242 0.624243 0.624242 Cu\n0.624242 0.624243 0.127273 Cu\n0.127273 0.624243 0.624242 Cu\n0.624243 0.127273 0.624242 Cu\n",
"nsites": 6,
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"volume": 82.40148606122914,
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"formula_full": "Zr1 Cu5",
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"spacegroup": 216
},
{
"id": "jvasp-19943",
"created_at": "2022-09-04T14:37:58.107315Z",
"updated_at": "2022-09-04T14:37:58.107335Z",
"structure_string": "Zr2 Fe4\n1.0\n4.285848 -0.000000 2.474436\n1.428616 4.040737 2.474436\n0.000000 0.000000 4.948872\nZr Fe\n2 4\ndirect\n0.875001 0.875001 0.875000 Zr\n0.125000 0.125000 0.125000 Zr\n0.500000 0.000000 0.500000 Fe\n0.000000 0.500000 0.500000 Fe\n0.500001 0.500000 0.500000 Fe\n0.500001 0.500000 0.000000 Fe\n",
"nsites": 6,
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},
{
"id": "jvasp-90790",
"created_at": "2022-09-04T14:36:11.877569Z",
"updated_at": "2022-09-04T14:36:11.877592Z",
"structure_string": "Zr6 Fe2\n1.0\n3.287889 0.000000 0.000000\n-1.643945 5.407171 0.000000\n-0.000000 0.000000 8.932913\nZr Fe\n6 2\ndirect\n0.136854 0.273708 0.440595 Zr\n0.863145 0.726292 0.559405 Zr\n0.136854 0.273708 0.059405 Zr\n0.863145 0.726292 0.940594 Zr\n0.418332 0.836667 0.250000 Zr\n0.581666 0.163333 0.750000 Zr\n0.728843 0.457687 0.250000 Fe\n0.271156 0.542313 0.750000 Fe\n",
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"spacegroup": 63
},
{
"id": "jvasp-20102",
"created_at": "2022-09-04T14:36:45.499317Z",
"updated_at": "2022-09-04T14:36:45.499326Z",
"structure_string": "Zr4 Fe2\n1.0\n5.044435 0.145100 -1.488091\n-2.786033 4.207778 -1.488091\n-0.075282 -0.145100 5.258809\nZr Fe\n4 2\ndirect\n0.679132 0.179131 0.858262 Zr\n0.179132 0.320869 0.500000 Zr\n0.820871 0.679131 0.500001 Zr\n0.320870 0.820869 0.141740 Zr\n0.250000 0.250000 0.000000 Fe\n0.750001 0.750000 0.000001 Fe\n",
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"formula_full": "Zr4 Fe2",
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"spacegroup": 140
},
{
"id": "jvasp-30883",
"created_at": "2022-09-04T14:38:31.969922Z",
"updated_at": "2022-09-04T14:38:31.969952Z",
"structure_string": "Zr4 Ga6\n1.0\n5.406916 0.001566 -1.027988\n-2.960709 4.524262 -1.027988\n-0.005543 -0.010255 7.435434\nZr Ga\n4 6\ndirect\n0.113510 0.751627 0.895656 Zr\n0.855974 0.217855 0.104343 Zr\n0.001628 0.863511 0.395656 Zr\n0.467855 0.605972 0.604342 Zr\n0.603441 0.603441 -0.000000 Ga\n0.853442 0.353441 0.499999 Ga\n0.519364 0.158232 0.730520 Ga\n0.427712 0.788842 0.269479 Ga\n0.408233 0.269364 0.230520 Ga\n0.038842 0.177711 0.769479 Ga\n",
"nsites": 10,
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"formula_full": "Zr4 Ga6",
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"formula_anonymous": "A2B3",
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},
{
"id": "jvasp-123393",
"created_at": "2022-09-04T14:38:54.413681Z",
"updated_at": "2022-09-04T14:38:54.413729Z",
"structure_string": "Zr1 Ga1\n1.0\n1.563847 -2.708660 0.000000\n1.563847 2.708660 0.000000\n0.000000 0.000000 4.709194\nZr Ga\n1 1\ndirect\n0.333334 0.666668 0.749999 Zr\n0.666668 0.333334 0.250000 Ga\n",
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},
{
"id": "jvasp-120710",
"created_at": "2022-09-04T14:38:53.743251Z",
"updated_at": "2022-09-04T14:38:53.743278Z",
"structure_string": "Zr10 Ga6\n1.0\n8.131037 0.000000 0.000000\n-4.065518 7.041684 0.000000\n-0.000000 -0.000000 5.671515\nZr Ga\n10 6\ndirect\n0.666667 0.333333 -0.000000 Zr\n0.333333 0.666666 -0.000000 Zr\n0.333333 0.666666 0.500000 Zr\n0.666667 0.333333 0.500000 Zr\n0.758094 0.758094 0.749999 Zr\n0.241906 -0.000000 0.749999 Zr\n-0.000000 0.241905 0.749999 Zr\n0.241906 0.241905 0.250000 Zr\n0.758095 -0.000000 0.250000 Zr\n-0.000000 0.758094 0.250000 Zr\n0.390664 0.390664 0.749999 Ga\n0.609336 -0.000000 0.749999 Ga\n-0.000000 0.609335 0.749999 Ga\n0.609336 0.609335 0.250000 Ga\n0.390665 -0.000000 0.250000 Ga\n-0.000000 0.390664 0.250000 Ga\n",
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},
{
"id": "jvasp-18712",
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"updated_at": "2022-09-04T14:36:19.840656Z",
"structure_string": "Zr4 Ga4\n1.0\n3.820198 0.000000 -0.705783\n-0.130394 3.817971 -0.705783\n-0.015198 -0.015726 10.609444\nZr Ga\n4 4\ndirect\n0.321780 0.571779 0.143558 Zr\n0.071780 0.821778 0.643557 Zr\n0.678221 0.428220 0.856443 Zr\n0.928221 0.178220 0.356443 Zr\n0.459195 0.709194 0.418389 Ga\n0.209195 0.959193 0.918388 Ga\n0.540806 0.290805 0.581611 Ga\n0.790806 0.040806 0.081612 Ga\n",
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"volume": 154.65823784080465,
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"formula_full": "Zr4 Ga4",
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"spacegroup": 141
},
{
"id": "jvasp-56330",
"created_at": "2022-09-04T14:37:30.156152Z",
"updated_at": "2022-09-04T14:37:30.156170Z",
"structure_string": "Zr4 Ga2\n1.0\n4.742842 0.000000 2.718254\n2.371421 4.726544 1.359127\n0.021148 0.000000 5.459913\nZr Ga\n4 2\ndirect\n0.346334 0.807331 0.500000 Zr\n0.153667 0.500000 0.192668 Zr\n0.653666 0.192668 0.499999 Zr\n0.846333 0.500000 0.807331 Zr\n0.250000 -0.000000 -0.000000 Ga\n0.750000 -0.000000 -0.000000 Ga\n",
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}
]
}