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{
"id": "jvasp-108735",
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"structure_string": "Sr1 Nd1 Mn1 O4\n1.0\n3.662219 -0.030967 -5.765486\n-0.335652 3.646936 -5.765486\n0.028488 0.030967 6.830217\nSr Nd Mn O\n1 1 1 4\ndirect\n0.643009 0.643008 -0.000000 Sr\n0.360150 0.360150 -0.000000 Nd\n0.002558 0.002558 -0.000000 Mn\n0.835063 0.835062 -0.000000 O\n0.173417 0.173417 -0.000000 O\n0.992903 0.492902 0.500000 O\n0.492903 0.992903 0.500001 O\n",
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{
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"structure_string": "Sr1 Nd1 Mn1 Co1 O6\n1.0\n4.672582 0.000000 2.697717\n1.557527 4.405353 2.697717\n0.000000 0.000000 5.395434\nSr Nd Mn Co O\n1 1 1 1 6\ndirect\n0.500000 0.500000 0.500000 Sr\n0.000000 0.000000 0.000000 Nd\n0.750000 0.749999 0.750001 Mn\n0.250000 0.250000 0.250000 Co\n0.500211 0.500211 -0.000211 O\n-0.000211 -0.000211 0.500211 O\n-0.000211 0.500211 0.500211 O\n0.500211 -0.000211 -0.000211 O\n0.500211 -0.000211 0.500211 O\n-0.000211 0.500211 -0.000211 O\n",
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{
"id": "jvasp-110997",
"created_at": "2022-09-04T14:38:37.074081Z",
"updated_at": "2022-09-04T14:38:37.074105Z",
"structure_string": "Sr1 Nd1 Ga1 O4\n1.0\n3.697548 0.012152 -5.740620\n-0.309818 3.684565 -5.740620\n-0.011136 -0.012152 6.828356\nSr Nd Ga O\n1 1 1 4\ndirect\n0.643796 0.643796 0.000000 Sr\n0.359975 0.359975 0.000000 Nd\n0.006399 0.006399 0.000000 Ga\n0.992108 0.492109 0.500000 O\n0.492108 0.992110 0.500001 O\n0.834737 0.834737 0.000000 O\n0.170877 0.170877 0.000000 O\n",
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"volume": 92.5399243766202,
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"formula_full": "Sr1 Nd1 Ga1 O4",
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},
{
"id": "jvasp-108071",
"created_at": "2022-09-04T14:36:00.477832Z",
"updated_at": "2022-09-04T14:36:00.477856Z",
"structure_string": "Sr1 Nd1 Fe1 O4\n1.0\n3.702602 0.112792 -5.881257\n-0.213443 3.698165 -5.881257\n-0.103268 -0.112792 6.948941\nSr Nd Fe O\n1 1 1 4\ndirect\n0.643605 0.643605 0.000000 Sr\n0.357692 0.357692 0.000000 Nd\n0.000552 0.000552 0.000000 Fe\n0.833398 0.833398 0.000000 O\n0.177025 0.177025 0.000000 O\n0.993864 0.493865 0.499999 O\n0.493865 0.993865 0.500001 O\n",
"nsites": 7,
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"elements": [
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"density": 6.450209238807632,
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"volume": 90.54267955978531,
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"formula_full": "Sr1 Nd1 Fe1 O4",
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{
"id": "jvasp-106731",
"created_at": "2022-09-04T14:36:49.960322Z",
"updated_at": "2022-09-04T14:36:49.960347Z",
"structure_string": "Sr1 Nd1 Co1 O4\n1.0\n3.619457 -0.014156 -5.645667\n-0.322662 3.605074 -5.645667\n0.012996 0.014156 6.706255\nSr Nd Co O\n1 1 1 4\ndirect\n0.641600 0.641598 -0.000001 Sr\n0.361726 0.361724 -0.000001 Nd\n0.006712 0.006712 -0.000000 Co\n0.839683 0.839680 -0.000002 O\n0.168436 0.168436 -0.000000 O\n0.990924 0.490921 0.499999 O\n0.490924 0.990921 0.499999 O\n",
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{
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"created_at": "2022-09-04T14:36:38.470859Z",
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"structure_string": "Sr1 Nd1 Al1 O4\n1.0\n3.612935 0.005783 -5.719809\n-0.297677 3.600655 -5.719809\n-0.005316 -0.005783 6.765314\nSr Nd Al O\n1 1 1 4\ndirect\n0.643772 0.643774 -0.000001 Sr\n0.359447 0.359448 -0.000001 Nd\n0.004276 0.004276 -0.000000 Al\n0.838927 0.838929 -0.000001 O\n0.165409 0.165409 -0.000000 O\n0.994080 0.494082 0.499998 O\n0.494080 0.994083 0.499999 O\n",
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"formula_full": "Sr1 Nd1 Al1 O4",
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{
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"created_at": "2022-09-04T14:37:18.795275Z",
"updated_at": "2022-09-04T14:37:18.795301Z",
"structure_string": "Sr1 Nb6 O16\n1.0\n3.922420 0.000000 0.000000\n0.000000 8.576791 -3.209449\n0.000000 0.059500 9.157420\nSr Nb O\n1 6 16\ndirect\n0.500000 0.398505 0.601495 Sr\n0.000000 0.627398 0.999894 Nb\n0.000000 0.207842 0.792158 Nb\n0.000000 0.741519 0.621213 Nb\n0.000000 0.378787 0.258481 Nb\n0.000000 0.000105 0.372601 Nb\n0.000000 0.994219 0.005781 Nb\n0.000000 0.188423 0.557154 O\n0.000000 0.236760 0.014207 O\n0.000000 0.985793 0.763240 O\n0.500000 0.625761 0.001653 O\n0.000000 0.509916 0.490084 O\n0.500000 0.707334 0.633589 O\n0.500000 0.224469 0.775531 O\n0.500000 0.003802 0.996198 O\n0.000000 0.442846 0.811577 O\n0.000000 0.145646 0.238320 O\n0.000000 0.761680 0.854354 O\n0.000000 0.830456 0.463253 O\n0.000000 0.536747 0.169544 O\n0.000000 0.857235 0.142764 O\n0.500000 0.366411 0.292666 O\n0.500000 0.998346 0.374238 O\n",
"nsites": 23,
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"elements": [
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"formula_full": "Sr1 Nb6 O16",
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{
"id": "jvasp-15724",
"created_at": "2022-09-04T14:36:55.982119Z",
"updated_at": "2022-09-04T14:36:55.982139Z",
"structure_string": "Sr1 Nb1 O3\n1.0\n4.084495 -0.000000 0.000000\n-0.000000 4.084495 -0.000000\n0.000000 -0.000000 4.084495\nSr Nb O\n1 1 3\ndirect\n0.500001 0.500001 0.500001 Sr\n0.000000 0.000000 0.000000 Nb\n0.000000 0.500001 0.000000 O\n0.000000 0.000000 0.500001 O\n0.500001 0.000000 0.000000 O\n",
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{
"id": "jvasp-110540",
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"updated_at": "2022-09-04T14:38:39.679226Z",
"structure_string": "Sr1 Nb1 N1 O2\n1.0\n4.080223 0.000000 -0.000000\n0.000000 4.080223 -0.000000\n-0.000000 -0.000000 4.107939\nSr Nb N O\n1 1 1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Nb\n0.500000 0.500000 0.000000 N\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
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},
{
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"created_at": "2022-09-04T14:38:31.994130Z",
"updated_at": "2022-09-04T14:38:31.994157Z",
"structure_string": "Sr1 N2\n1.0\n3.386913 -0.000000 -1.756880\n-0.911340 3.261999 -1.756880\n0.002737 0.003606 4.148362\nSr N\n1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.599461 0.599462 0.198922 N\n0.400539 0.400539 0.801078 N\n",
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{
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"structure_string": "Sr1 N1 F2\n1.0\n3.673363 0.000000 0.000000\n0.000000 3.673363 0.000000\n0.000000 0.000000 4.776491\nSr N F\n1 1 2\ndirect\n0.499999 0.499999 0.502670 Sr\n0.000000 0.000000 0.002274 N\n0.000000 0.000000 0.502322 F\n0.499999 0.499999 0.002734 F\n",
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{
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"structure_string": "Sr1 N1 F1\n1.0\n4.117042 -1.482714 0.000000\n-0.769898 4.307587 0.000000\n0.000000 0.000000 4.746315\nSr N F\n1 1 1\ndirect\n0.055685 0.420084 0.000000 Sr\n0.389067 0.086665 0.000000 N\n-0.277605 -0.246701 0.000000 F\n",
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}
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}