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{
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"results": [
{
"id": "mp-1198033",
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"structure_string": "Tb20 Pb16\n1.0\n-8.250454 0.000000 0.000000\n0.000000 0.000000 -8.330504\n0.000000 -15.815903 0.000000\nTb Pb\n20 16\ndirect\n0.376876 0.840768 0.880061 Tb\n0.876876 0.659232 0.619939 Tb\n0.623124 0.159232 0.380061 Tb\n0.123124 0.340768 0.119939 Tb\n0.623124 0.159232 0.119939 Tb\n0.123124 0.340768 0.380061 Tb\n0.376876 0.840768 0.619939 Tb\n0.876876 0.659232 0.880061 Tb\n0.533814 0.322541 0.899662 Tb\n0.033814 0.177459 0.600338 Tb\n0.466186 0.677459 0.399662 Tb\n0.966186 0.822541 0.100338 Tb\n0.466186 0.677459 0.100338 Tb\n0.966186 0.822541 0.399662 Tb\n0.533814 0.322541 0.600338 Tb\n0.033814 0.177459 0.899662 Tb\n0.208261 0.503687 0.750000 Tb\n0.708261 0.996313 0.750000 Tb\n0.791739 0.496313 0.250000 Tb\n0.291739 0.003687 0.250000 Tb\n0.281239 0.032045 0.042549 Pb\n0.781239 0.467955 0.457451 Pb\n0.718761 0.967955 0.542549 Pb\n0.218761 0.532045 0.957451 Pb\n0.718761 0.967955 0.957451 Pb\n0.218761 0.532045 0.542549 Pb\n0.281239 0.032045 0.457451 Pb\n0.781239 0.467955 0.042549 Pb\n0.571922 0.627193 0.750000 Pb\n0.071922 0.872807 0.750000 Pb\n0.428078 0.372807 0.250000 Pb\n0.928078 0.127193 0.250000 Pb\n0.343758 0.150326 0.750000 Pb\n0.843758 0.349674 0.750000 Pb\n0.656242 0.849674 0.250000 Pb\n0.156242 0.650326 0.250000 Pb\n",
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{
"id": "mp-505527",
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"structure_string": "Ti20 Si16\n1.0\n6.708585 0.000000 0.000000\n0.000000 6.708585 0.000000\n0.000000 0.000000 12.198843\nTi Si\n20 16\ndirect\n0.996076 0.148493 0.622074 Ti\n0.351507 0.496076 0.872074 Ti\n0.648493 0.503924 0.372074 Ti\n0.496076 0.351507 0.127926 Ti\n0.503924 0.648493 0.627926 Ti\n0.003924 0.851507 0.122074 Ti\n0.148493 0.996076 0.377926 Ti\n0.851507 0.003924 0.877926 Ti\n0.001574 0.346515 0.218043 Ti\n0.153485 0.501574 0.468043 Ti\n0.846515 0.498426 0.968043 Ti\n0.501574 0.153485 0.531957 Ti\n0.498426 0.846515 0.031957 Ti\n0.998426 0.653485 0.718043 Ti\n0.346515 0.001574 0.781957 Ti\n0.653485 0.998426 0.281957 Ti\n0.171738 0.171738 0.000000 Ti\n0.328262 0.671738 0.250000 Ti\n0.671738 0.328262 0.750000 Ti\n0.828262 0.828262 0.500000 Ti\n0.045171 0.301080 0.813457 Si\n0.198920 0.545171 0.063457 Si\n0.801080 0.454829 0.563457 Si\n0.545171 0.198920 0.936543 Si\n0.454829 0.801080 0.436543 Si\n0.954829 0.698920 0.313457 Si\n0.301080 0.045171 0.186543 Si\n0.698920 0.954829 0.686543 Si\n0.295426 0.356071 0.672867 Si\n0.143929 0.795426 0.922867 Si\n0.856071 0.204574 0.422867 Si\n0.795426 0.143929 0.077133 Si\n0.204574 0.856071 0.577133 Si\n0.704574 0.643929 0.172867 Si\n0.356071 0.295426 0.327133 Si\n0.643929 0.704574 0.827133 Si\n",
"nsites": 36,
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"elements": [
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"density": 4.254735424926698,
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"formula_full": "Ti20 Si16",
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"spacegroup": 92
},
{
"id": "mp-1195885",
"created_at": "2022-09-04T14:41:23.394721Z",
"structure_string": "Er20 Pt16\n1.0\n7.430322 0.000000 0.000000\n0.000000 7.527554 0.000000\n0.000000 0.000000 14.629241\nEr Pt\n20 16\ndirect\n0.657373 0.167570 0.622594 Er\n0.157373 0.332430 0.877406 Er\n0.342627 0.832430 0.122594 Er\n0.842627 0.667570 0.377406 Er\n0.342627 0.832430 0.377406 Er\n0.842627 0.667570 0.122594 Er\n0.657373 0.167570 0.877406 Er\n0.157373 0.332430 0.622594 Er\n0.500751 0.680194 0.592442 Er\n0.000751 0.819806 0.907558 Er\n0.499249 0.319806 0.092442 Er\n0.999249 0.180194 0.407558 Er\n0.499249 0.319806 0.407558 Er\n0.999249 0.180194 0.092442 Er\n0.500751 0.680194 0.907558 Er\n0.000751 0.819806 0.592442 Er\n0.818527 0.511987 0.750000 Er\n0.318527 0.988013 0.750000 Er\n0.181473 0.488013 0.250000 Er\n0.681473 0.011987 0.250000 Er\n0.682670 0.967147 0.458439 Pt\n0.182670 0.532853 0.041561 Pt\n0.317330 0.032853 0.958439 Pt\n0.817330 0.467147 0.541561 Pt\n0.317330 0.032853 0.541561 Pt\n0.817330 0.467147 0.958439 Pt\n0.682670 0.967147 0.041561 Pt\n0.182670 0.532853 0.458439 Pt\n0.454284 0.387903 0.750000 Pt\n0.954284 0.112097 0.750000 Pt\n0.545716 0.612097 0.250000 Pt\n0.045716 0.887903 0.250000 Pt\n0.684195 0.856854 0.750000 Pt\n0.184195 0.643146 0.750000 Pt\n0.315805 0.143146 0.250000 Pt\n0.815805 0.356854 0.250000 Pt\n",
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"elements": [
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"formula_full": "Er20 Pt16",
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"updated_at": "2021-11-28T01:35:26.418000Z",
"spacegroup": 62
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{
"id": "mp-570196",
"created_at": "2022-09-04T14:41:22.131403Z",
"structure_string": "Zr10 Sb8\n1.0\n4.425917 -7.665913 0.000000\n4.425917 7.665913 0.000000\n0.000000 0.000000 5.964522\nZr Sb\n10 8\ndirect\n0.280743 0.280743 0.750000 Zr\n0.719257 0.719257 0.250000 Zr\n0.719257 0.000000 0.750000 Zr\n0.000000 0.280743 0.250000 Zr\n0.333333 0.666667 0.500000 Zr\n0.666667 0.333333 0.500000 Zr\n0.000000 0.719257 0.750000 Zr\n0.333333 0.666667 0.000000 Zr\n0.280743 0.000000 0.250000 Zr\n0.666667 0.333333 0.000000 Zr\n0.000000 0.000000 0.500000 Sb\n0.610325 0.610325 0.750000 Sb\n0.389675 0.000000 0.750000 Sb\n0.000000 0.000000 0.000000 Sb\n0.610325 0.000000 0.250000 Sb\n0.389675 0.389675 0.250000 Sb\n0.000000 0.389675 0.750000 Sb\n0.000000 0.610325 0.250000 Sb\n",
"nsites": 18,
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"elements": [
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"density": 7.739121680086917,
"density_atomic": 0.0444733365697458,
"volume": 404.73689154784466,
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"formula_full": "Zr10 Sb8",
"formula_reduced": "Zr5Sb4",
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"updated_at": "2021-11-28T01:35:25.044000Z",
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},
{
"id": "mp-1204902",
"created_at": "2022-09-04T14:39:18.586978Z",
"structure_string": "Nd20 Pb16\n1.0\n8.425718 0.000000 0.000000\n0.000000 8.575595 0.000000\n0.000000 0.000000 16.216614\nNd Pb\n20 16\ndirect\n0.625120 0.160612 0.619036 Nd\n0.125120 0.339388 0.880964 Nd\n0.374880 0.839388 0.119036 Nd\n0.874880 0.660612 0.380964 Nd\n0.374880 0.839388 0.380964 Nd\n0.874880 0.660612 0.119036 Nd\n0.625120 0.160612 0.880964 Nd\n0.125120 0.339388 0.619036 Nd\n0.470256 0.679258 0.600775 Nd\n0.970256 0.820742 0.899225 Nd\n0.529744 0.320742 0.100775 Nd\n0.029744 0.179258 0.399225 Nd\n0.529744 0.320742 0.399225 Nd\n0.029744 0.179258 0.100775 Nd\n0.470256 0.679258 0.899225 Nd\n0.970256 0.820742 0.600775 Nd\n0.793192 0.497626 0.750000 Nd\n0.293192 0.002374 0.750000 Nd\n0.206808 0.502374 0.250000 Nd\n0.706808 0.997626 0.250000 Nd\n0.717274 0.967896 0.456704 Pb\n0.217274 0.532104 0.043296 Pb\n0.282726 0.032104 0.956704 Pb\n0.782726 0.467896 0.543296 Pb\n0.282726 0.032104 0.543296 Pb\n0.782726 0.467896 0.956704 Pb\n0.717274 0.967896 0.043296 Pb\n0.217274 0.532104 0.456704 Pb\n0.427870 0.375215 0.750000 Pb\n0.927870 0.124785 0.750000 Pb\n0.572130 0.624785 0.250000 Pb\n0.072130 0.875215 0.250000 Pb\n0.662498 0.852222 0.750000 Pb\n0.162498 0.647778 0.750000 Pb\n0.337502 0.147778 0.250000 Pb\n0.837502 0.352222 0.250000 Pb\n",
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{
"id": "mp-1198040",
"created_at": "2022-09-04T14:39:07.571490Z",
"structure_string": "Er20 Pb16\n1.0\n-8.138910 0.000000 0.000000\n0.000000 0.000000 -8.195404\n0.000000 -15.572827 0.000000\nEr Pb\n20 16\ndirect\n0.377624 0.840121 0.879844 Er\n0.877624 0.659879 0.620156 Er\n0.622376 0.159879 0.379844 Er\n0.122376 0.340121 0.120156 Er\n0.622376 0.159879 0.120156 Er\n0.122376 0.340121 0.379844 Er\n0.377624 0.840121 0.620156 Er\n0.877624 0.659879 0.879844 Er\n0.534389 0.322806 0.899947 Er\n0.034389 0.177194 0.600053 Er\n0.465611 0.677194 0.399947 Er\n0.965611 0.822806 0.100053 Er\n0.465611 0.677194 0.100053 Er\n0.965611 0.822806 0.399947 Er\n0.534389 0.322806 0.600053 Er\n0.034389 0.177194 0.899947 Er\n0.208592 0.503695 0.750000 Er\n0.708592 0.996305 0.750000 Er\n0.791408 0.496305 0.250000 Er\n0.291408 0.003695 0.250000 Er\n0.280571 0.031814 0.042278 Pb\n0.780571 0.468186 0.457722 Pb\n0.719429 0.968186 0.542278 Pb\n0.219429 0.531814 0.957722 Pb\n0.719429 0.968186 0.957722 Pb\n0.219429 0.531814 0.542278 Pb\n0.280571 0.031814 0.457722 Pb\n0.780571 0.468186 0.042278 Pb\n0.571580 0.627340 0.750000 Pb\n0.071580 0.872660 0.750000 Pb\n0.428420 0.372660 0.250000 Pb\n0.928420 0.127340 0.250000 Pb\n0.345658 0.151472 0.750000 Pb\n0.845658 0.348528 0.750000 Pb\n0.654342 0.848528 0.250000 Pb\n0.154342 0.651472 0.250000 Pb\n",
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"formula_full": "Er20 Pb16",
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{
"id": "mp-1203353",
"created_at": "2022-09-04T14:39:05.746161Z",
"structure_string": "Sr20 Pb16\n1.0\n8.615907 0.000000 0.000000\n0.000000 9.026430 0.000000\n0.000000 0.000000 17.707516\nSr Pb\n20 16\ndirect\n0.657438 0.176440 0.623605 Sr\n0.157438 0.323560 0.876395 Sr\n0.342562 0.823560 0.123605 Sr\n0.842562 0.676440 0.376395 Sr\n0.342562 0.823560 0.376395 Sr\n0.842562 0.676440 0.123605 Sr\n0.657438 0.176440 0.876395 Sr\n0.157438 0.323560 0.623605 Sr\n0.495596 0.678332 0.597455 Sr\n0.995596 0.821668 0.902545 Sr\n0.504404 0.321668 0.097455 Sr\n0.004404 0.178332 0.402545 Sr\n0.504404 0.321668 0.402545 Sr\n0.004404 0.178332 0.097455 Sr\n0.495596 0.678332 0.902545 Sr\n0.995596 0.821668 0.597455 Sr\n0.826911 0.504525 0.750000 Sr\n0.326911 0.995475 0.750000 Sr\n0.173089 0.495475 0.250000 Sr\n0.673089 0.004525 0.250000 Sr\n0.672278 0.975223 0.462167 Pb\n0.172278 0.524777 0.037833 Pb\n0.327722 0.024777 0.962167 Pb\n0.827722 0.475223 0.537833 Pb\n0.327722 0.024777 0.537833 Pb\n0.827722 0.475223 0.962167 Pb\n0.672278 0.975223 0.037833 Pb\n0.172278 0.524777 0.462167 Pb\n0.453719 0.392703 0.750000 Pb\n0.953719 0.107297 0.750000 Pb\n0.546281 0.607297 0.250000 Pb\n0.046281 0.892703 0.250000 Pb\n0.702254 0.863672 0.750000 Pb\n0.202254 0.636328 0.750000 Pb\n0.297746 0.136328 0.250000 Pb\n0.797746 0.363672 0.250000 Pb\n",
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{
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{
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