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{
"id": "jvasp-76228",
"created_at": "2022-09-04T14:36:04.980402Z",
"updated_at": "2022-09-04T14:36:04.980437Z",
"structure_string": "Ho10 Rh6\n1.0\n8.167787 0.000000 -0.000000\n-4.083893 7.073511 -0.000000\n-0.000000 0.000000 6.236773\nHo Rh\n10 6\ndirect\n0.000000 0.751240 0.750000 Ho\n0.000000 0.248760 0.250000 Ho\n0.751241 0.751240 0.250000 Ho\n0.751240 0.000000 0.750000 Ho\n0.248760 0.248760 0.750000 Ho\n0.248760 0.000000 0.250000 Ho\n0.333333 0.666667 0.500000 Ho\n0.666667 0.333333 0.000000 Ho\n0.666667 0.333333 0.500000 Ho\n0.333333 0.666667 0.000000 Ho\n0.396582 0.000000 0.750000 Rh\n0.396582 0.396582 0.250000 Rh\n0.000000 0.603418 0.250000 Rh\n0.000000 0.396582 0.750000 Rh\n0.603418 0.603418 0.750000 Rh\n0.603418 0.000000 0.250000 Rh\n",
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{
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"updated_at": "2022-09-04T14:36:32.918892Z",
"structure_string": "Y4 Mg2 Cu4\n1.0\n3.710795 0.000000 0.000000\n0.000000 7.624794 0.000000\n-0.000000 -0.000000 7.624794\nY Mg Cu\n4 2 4\ndirect\n0.499999 0.330172 0.830172 Y\n0.499999 0.169828 0.330172 Y\n0.499999 0.830172 0.669828 Y\n0.499999 0.669828 0.169828 Y\n0.000000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.000000 0.876117 0.376117 Cu\n0.000000 0.623883 0.876117 Cu\n0.000000 0.123883 0.623883 Cu\n0.000000 0.376117 0.123883 Cu\n",
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"spacegroup": 127
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{
"id": "jvasp-76235",
"created_at": "2022-09-04T14:37:05.328896Z",
"updated_at": "2022-09-04T14:37:05.328929Z",
"structure_string": "Tb16 Mg4 Ir4\n1.0\n8.390647 0.000000 4.844342\n2.796883 7.910778 4.844342\n-0.000000 0.000000 9.688685\nTb Mg Ir\n16 4 4\ndirect\n0.811952 0.811952 0.188048 Tb\n0.040562 0.653146 0.653146 Tb\n0.653146 0.040562 0.653146 Tb\n0.188048 0.811952 0.188048 Tb\n0.436438 0.436438 0.063562 Tb\n0.436438 0.063562 0.436438 Tb\n0.063562 0.436438 0.436438 Tb\n0.188048 0.811952 0.811951 Tb\n0.063562 0.063562 0.436438 Tb\n0.811952 0.188048 0.188048 Tb\n0.063562 0.436438 0.063562 Tb\n0.653146 0.653146 0.653146 Tb\n0.653146 0.653146 0.040562 Tb\n0.436438 0.063562 0.063562 Tb\n0.188048 0.188048 0.811951 Tb\n0.811952 0.188048 0.811951 Tb\n0.420209 0.739374 0.420208 Mg\n0.739374 0.420209 0.420208 Mg\n0.420209 0.420209 0.420208 Mg\n0.420209 0.420209 0.739373 Mg\n0.858576 0.858576 0.858575 Ir\n0.858576 0.424273 0.858575 Ir\n0.424273 0.858576 0.858576 Ir\n0.858576 0.858576 0.424273 Ir\n",
"nsites": 24,
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"volume": 643.1014426111298,
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"spacegroup": 216
},
{
"id": "jvasp-76236",
"created_at": "2022-09-04T14:36:55.173713Z",
"updated_at": "2022-09-04T14:36:55.173733Z",
"structure_string": "Er16 In4 Ir4\n1.0\n8.242840 -0.000000 4.759006\n2.747613 7.771424 4.759006\n-0.000000 -0.000000 9.518011\nEr In Ir\n16 4 4\ndirect\n0.939543 0.560456 0.560458 Er\n0.939543 0.560456 0.939544 Er\n0.560457 0.939543 0.939544 Er\n0.939543 0.939543 0.560458 Er\n0.191073 0.808926 0.808927 Er\n0.191073 0.808926 0.191074 Er\n0.808926 0.808926 0.191075 Er\n0.349631 0.349631 0.951106 Er\n0.191074 0.191074 0.808927 Er\n0.951105 0.349631 0.349632 Er\n0.349631 0.951105 0.349632 Er\n0.808926 0.191074 0.191074 Er\n0.560457 0.939543 0.560458 Er\n0.808926 0.191074 0.808927 Er\n0.349631 0.349631 0.349632 Er\n0.560457 0.560456 0.939544 Er\n0.248386 0.583871 0.583872 In\n0.583871 0.583871 0.248387 In\n0.583871 0.583871 0.583872 In\n0.583871 0.248386 0.583872 In\n0.141447 0.141447 0.575659 Ir\n0.141447 0.575659 0.141447 Ir\n0.575659 0.141447 0.141447 Ir\n0.141447 0.141447 0.141447 Ir\n",
"nsites": 24,
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},
{
"id": "jvasp-76237",
"created_at": "2022-09-04T14:37:02.914537Z",
"updated_at": "2022-09-04T14:37:02.914550Z",
"structure_string": "Tb16 Cd4 Rh4\n1.0\n8.299929 0.000000 4.791966\n2.766643 7.825249 4.791966\n-0.000000 0.000000 9.583932\nTb Cd Rh\n16 4 4\ndirect\n0.949896 0.350034 0.350035 Tb\n0.189384 0.810615 0.810615 Tb\n0.563987 0.936013 0.936013 Tb\n0.936013 0.563987 0.563988 Tb\n0.810615 0.189384 0.189385 Tb\n0.936012 0.936013 0.563988 Tb\n0.350034 0.350034 0.350035 Tb\n0.189384 0.810615 0.189385 Tb\n0.350034 0.350034 0.949896 Tb\n0.810615 0.810615 0.189385 Tb\n0.810615 0.189384 0.810615 Tb\n0.563987 0.563987 0.936013 Tb\n0.189384 0.189384 0.810615 Tb\n0.936013 0.563987 0.936013 Tb\n0.563987 0.936013 0.563988 Tb\n0.350034 0.949896 0.350035 Tb\n0.255114 0.581629 0.581629 Cd\n0.581628 0.581629 0.581629 Cd\n0.581628 0.581629 0.255115 Cd\n0.581628 0.255115 0.581629 Cd\n0.142492 0.572525 0.142492 Rh\n0.142492 0.142492 0.572525 Rh\n0.142492 0.142492 0.142492 Rh\n0.572525 0.142492 0.142492 Rh\n",
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"elements": [
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"density_atomic": 0.03855626664125313,
"volume": 622.4669059198094,
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"spacegroup": 216
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{
"id": "jvasp-76238",
"created_at": "2022-09-04T14:36:32.557614Z",
"updated_at": "2022-09-04T14:36:32.557632Z",
"structure_string": "Yb10 Au6\n1.0\n6.939461 0.000000 -3.327851\n-1.595887 6.753464 -3.327852\n-0.033011 -0.041720 8.830407\nYb Au\n10 6\ndirect\n0.022946 0.522946 0.712065 Yb\n0.477054 0.310880 0.287935 Yb\n0.977054 0.477054 0.287935 Yb\n0.189120 0.022946 0.712065 Yb\n0.689120 0.189120 0.712065 Yb\n0.522946 0.689119 0.712065 Yb\n0.500000 0.500000 -0.000000 Yb\n0.810880 0.977053 0.287935 Yb\n0.310880 0.810880 0.287935 Yb\n0.000000 0.000000 0.000000 Yb\n0.865045 0.634954 -0.000000 Au\n0.250000 0.250000 0.500000 Au\n0.134954 0.365045 -0.000000 Au\n0.634954 0.134954 0.000000 Au\n0.365045 0.865045 -0.000000 Au\n0.750000 0.750000 0.500000 Au\n",
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"density": 11.739890757229816,
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"volume": 411.9136196985961,
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"formula_full": "Yb10 Au6",
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},
{
"id": "jvasp-76241",
"created_at": "2022-09-04T14:37:00.032701Z",
"updated_at": "2022-09-04T14:37:00.032730Z",
"structure_string": "Yb10 Pb6\n1.0\n9.309505 -0.000000 0.000000\n-4.654752 8.062267 -0.000000\n-0.000000 -0.000000 6.717387\nYb Pb\n10 6\ndirect\n0.000000 0.727432 0.750000 Yb\n0.727432 0.727432 0.250000 Yb\n0.272568 0.272568 0.750000 Yb\n0.727432 0.000000 0.750000 Yb\n0.333333 0.666667 0.500000 Yb\n0.272568 0.000000 0.250000 Yb\n0.000000 0.272568 0.250000 Yb\n0.666667 0.333333 0.500000 Yb\n0.333333 0.666667 0.000000 Yb\n0.666667 0.333333 0.000000 Yb\n0.383164 0.383164 0.250000 Pb\n0.000000 0.383164 0.750000 Pb\n0.616836 0.616836 0.750000 Pb\n0.000000 0.616836 0.250000 Pb\n0.616836 0.000000 0.250000 Pb\n0.383164 0.000000 0.750000 Pb\n",
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{
"id": "jvasp-76246",
"created_at": "2022-09-04T14:36:40.071754Z",
"updated_at": "2022-09-04T14:36:40.071780Z",
"structure_string": "Sc10 Si6\n1.0\n7.896434 -0.000000 -0.000000\n-3.948216 6.838512 0.000000\n-0.000000 -0.000000 5.823690\nSc Si\n10 6\ndirect\n-0.000000 0.758115 0.750000 Sc\n-0.000000 0.241885 0.250000 Sc\n0.758114 0.758115 0.250000 Sc\n0.758114 0.000000 0.750000 Sc\n0.241885 0.241885 0.750000 Sc\n0.241885 0.000000 0.250000 Sc\n0.333332 0.666667 0.500000 Sc\n0.666666 0.333333 0.000000 Sc\n0.666666 0.333333 0.500000 Sc\n0.333332 0.666667 0.000000 Sc\n0.394074 0.000000 0.750000 Si\n0.394073 0.394074 0.250000 Si\n-0.000000 0.605926 0.250000 Si\n-0.000000 0.394074 0.750000 Si\n0.605926 0.605926 0.750000 Si\n0.605926 0.000000 0.250000 Si\n",
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"formula_full": "Sc10 Si6",
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{
"id": "jvasp-76247",
"created_at": "2022-09-04T14:36:40.097799Z",
"updated_at": "2022-09-04T14:36:40.097823Z",
"structure_string": "Ba6 Fe2 N6\n1.0\n8.055437 -0.000000 0.000000\n-4.027718 6.976213 -0.000000\n-0.000000 -0.000000 5.621925\nBa Fe N\n6 2 6\ndirect\n0.726070 0.637207 0.749999 Ba\n0.088862 0.726069 0.250000 Ba\n0.637207 0.911137 0.250000 Ba\n0.362793 0.088863 0.749999 Ba\n0.911138 0.273930 0.749999 Ba\n0.273930 0.362793 0.250000 Ba\n0.666667 0.333333 0.250000 Fe\n0.333333 0.666667 0.749999 Fe\n0.556260 0.873162 0.749999 N\n0.683099 0.556260 0.250000 N\n0.873163 0.316901 0.250000 N\n0.126837 0.683098 0.749999 N\n0.316901 0.443740 0.749999 N\n0.443740 0.126838 0.250000 N\n",
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{
"id": "jvasp-76249",
"created_at": "2022-09-04T14:37:04.305249Z",
"updated_at": "2022-09-04T14:37:04.305269Z",
"structure_string": "Tb4 Mg2 Ge4\n1.0\n-0.000000 -0.000000 4.252242\n7.266039 0.000000 0.000000\n-0.000000 7.266039 0.000000\nTb Mg Ge\n4 2 4\ndirect\n0.500000 0.177407 0.677407 Tb\n0.500000 0.822593 0.322593 Tb\n0.500000 0.322593 0.177407 Tb\n0.500000 0.677407 0.822593 Tb\n0.000000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.000000 0.375944 0.875944 Ge\n0.000000 0.624057 0.124057 Ge\n0.000000 0.124057 0.375944 Ge\n0.000000 0.875944 0.624057 Ge\n",
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},
{
"id": "jvasp-76251",
"created_at": "2022-09-04T14:37:01.028618Z",
"updated_at": "2022-09-04T14:37:01.028652Z",
"structure_string": "Nd5 Fe2 B6\n1.0\n5.193631 -0.002460 6.967792\n2.309358 4.651954 6.967792\n-0.003970 -0.002460 8.690450\nNd Fe B\n5 2 6\ndirect\n0.583916 0.583915 0.583916 Nd\n0.416084 0.416084 0.416084 Nd\n0.748088 0.748087 0.748087 Nd\n0.251913 0.251912 0.251913 Nd\n0.000000 0.000000 0.000000 Nd\n0.878896 0.878895 0.878896 Fe\n0.121104 0.121104 0.121104 Fe\n0.833579 0.499999 0.166421 B\n0.500000 0.166421 0.833579 B\n0.166422 0.833578 0.500000 B\n0.166421 0.499999 0.833579 B\n0.500000 0.833578 0.166421 B\n0.833579 0.166421 0.500000 B\n",
"nsites": 13,
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"density": 7.092397239974925,
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"volume": 210.193460014161,
"volume_molar": 9.737035407974686,
"formula_full": "Nd5 Fe2 B6",
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{
"id": "jvasp-76256",
"created_at": "2022-09-04T14:36:42.568171Z",
"updated_at": "2022-09-04T14:36:42.568202Z",
"structure_string": "Li4 Nd2 Ge2\n1.0\n-2.170058 -3.758649 0.000000\n-2.170058 3.758649 -0.000000\n0.000000 0.000000 -9.476226\nLi Nd Ge\n4 2 2\ndirect\n0.666668 0.333334 0.433707 Li\n0.333334 0.666668 0.566294 Li\n0.333334 0.666668 0.933707 Li\n0.666668 0.333334 0.066293 Li\n0.666668 0.333334 0.750000 Nd\n0.333334 0.666668 0.250000 Nd\n0.000000 0.000000 0.000000 Ge\n0.000000 0.000000 0.500000 Ge\n",
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"spacegroup": 194
}
]
}