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{
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"results": [
{
"id": "jvasp-41038",
"created_at": "2022-09-04T14:37:46.928479Z",
"updated_at": "2022-09-04T14:37:46.928496Z",
"structure_string": "Yb4 Si4 Pt8\n1.0\n5.556336 -0.000000 0.000000\n-0.000000 6.909832 0.000000\n0.000000 0.000000 7.293989\nYb Si Pt\n4 4 8\ndirect\n0.869400 0.250000 0.480704 Yb\n0.630601 0.250000 0.980704 Yb\n0.369400 0.750000 0.019296 Yb\n0.130601 0.750000 0.519297 Yb\n0.871231 0.750000 0.876834 Si\n0.628770 0.750000 0.376834 Si\n0.371230 0.250000 0.623166 Si\n0.128770 0.250000 0.123166 Si\n0.898697 0.949305 0.175253 Pt\n0.898697 0.550694 0.175253 Pt\n0.601304 0.949305 0.675253 Pt\n0.601304 0.550694 0.675253 Pt\n0.398697 0.449305 0.324748 Pt\n0.398697 0.050694 0.324748 Pt\n0.101304 0.449305 0.824748 Pt\n0.101304 0.050694 0.824748 Pt\n",
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{
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"updated_at": "2022-09-04T14:37:47.312730Z",
"structure_string": "Dy4 Co4 Sn4\n1.0\n4.581151 0.000000 0.000000\n0.000000 7.292024 0.000000\n0.000000 0.000000 7.212249\nDy Co Sn\n4 4 4\ndirect\n0.750000 0.699560 0.523497 Dy\n0.250000 0.300439 0.476503 Dy\n0.750000 0.800439 0.023497 Dy\n0.250000 0.199561 0.976503 Dy\n0.250000 0.937906 0.663633 Co\n0.750000 0.437906 0.836368 Co\n0.250000 0.562093 0.163632 Co\n0.750000 0.062093 0.336368 Co\n0.750000 0.394683 0.200234 Sn\n0.250000 0.894683 0.299767 Sn\n0.750000 0.105317 0.700234 Sn\n0.250000 0.605316 0.799767 Sn\n",
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"volume": 240.93140230166517,
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"formula_full": "Dy4 Co4 Sn4",
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{
"id": "jvasp-20250",
"created_at": "2022-09-04T14:37:47.892491Z",
"updated_at": "2022-09-04T14:37:47.892517Z",
"structure_string": "Yb4 Cu4\n1.0\n4.238297 -0.000000 0.000000\n0.000000 5.537440 0.000000\n0.000000 0.000000 7.189615\nYb Cu\n4 4\ndirect\n0.250000 0.132442 0.180825 Yb\n0.750001 0.867558 0.819175 Yb\n0.750001 0.632442 0.319175 Yb\n0.250000 0.367558 0.680825 Yb\n0.250000 0.621225 0.034448 Cu\n0.750001 0.378775 0.965552 Cu\n0.750001 0.121225 0.465552 Cu\n0.250000 0.878775 0.534449 Cu\n",
"nsites": 8,
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"density_atomic": 0.047411525788623426,
"volume": 168.73534160589344,
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"formula_full": "Yb4 Cu4",
"formula_reduced": "YbCu",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-32164",
"created_at": "2022-09-04T14:37:47.780530Z",
"updated_at": "2022-09-04T14:37:47.780557Z",
"structure_string": "Pb4 C4 O12\n1.0\n5.229115 0.000000 0.000000\n-0.000000 6.080136 0.000000\n0.000000 0.000000 8.559078\nPb C O\n4 4 12\ndirect\n0.749999 0.744580 0.416707 Pb\n0.749999 0.244580 0.083293 Pb\n0.250000 0.755421 0.916707 Pb\n0.250000 0.255420 0.583293 Pb\n0.250000 0.910585 0.261397 C\n0.749999 0.589416 0.761398 C\n0.250000 0.410585 0.238603 C\n0.749999 0.089415 0.738603 C\n0.964958 0.591188 0.685104 O\n0.035041 0.908813 0.185104 O\n0.535041 0.091187 0.814896 O\n0.749999 0.599411 0.912895 O\n0.749999 0.099411 0.587106 O\n0.250000 0.900590 0.412895 O\n0.535041 0.591188 0.685104 O\n0.035041 0.408813 0.314896 O\n0.964958 0.091187 0.814896 O\n0.464958 0.908813 0.185104 O\n0.464958 0.408813 0.314896 O\n0.250000 0.400590 0.087105 O\n",
"nsites": 20,
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"elements": [
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"O"
],
"chemical_system": "C-O-Pb",
"density": 6.522161329493107,
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},
{
"id": "jvasp-22796",
"created_at": "2022-09-04T14:37:47.861525Z",
"updated_at": "2022-09-04T14:37:47.861545Z",
"structure_string": "Tl12 P4 S16\n1.0\n8.865865 -0.000000 0.000000\n0.000000 9.083428 0.000000\n0.000000 0.000000 10.867916\nTl P S\n12 4 16\ndirect\n0.381179 0.607789 0.750000 Tl\n0.881179 0.892211 0.750000 Tl\n0.118820 0.107789 0.250000 Tl\n0.618820 0.392211 0.250000 Tl\n0.441674 0.802946 0.451561 Tl\n0.941674 0.697054 0.048439 Tl\n0.058325 0.302946 0.548439 Tl\n0.558325 0.197054 0.951562 Tl\n0.558325 0.197054 0.548439 Tl\n0.058325 0.302946 0.951562 Tl\n0.941674 0.697054 0.451561 Tl\n0.441674 0.802946 0.048439 Tl\n0.222766 0.526352 0.250000 P\n0.722765 0.973649 0.250000 P\n0.277234 0.026352 0.750000 P\n0.777234 0.473648 0.750000 P\n0.660678 0.534657 0.594121 S\n0.160678 0.965343 0.905880 S\n0.160678 0.965343 0.594121 S\n0.660678 0.534657 0.905880 S\n0.339321 0.465343 0.405879 S\n0.839321 0.034657 0.094121 S\n0.509299 0.064300 0.250000 S\n0.009299 0.435700 0.250000 S\n0.490700 0.935700 0.750000 S\n0.698709 0.745319 0.250000 S\n0.198709 0.754682 0.250000 S\n0.801290 0.245319 0.750000 S\n0.301291 0.254681 0.750000 S\n0.339321 0.465343 0.094121 S\n0.990700 0.564300 0.750000 S\n0.839321 0.034657 0.405879 S\n",
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"P",
"S"
],
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"density": 5.861719094721927,
"density_atomic": 0.03656224152104779,
"volume": 875.2198625890745,
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"formula_full": "Tl12 P4 S16",
"formula_reduced": "Tl3PS4",
"formula_anonymous": "AB3C4",
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"spacegroup": 62
},
{
"id": "jvasp-23343",
"created_at": "2022-09-04T14:37:47.931063Z",
"updated_at": "2022-09-04T14:37:47.931095Z",
"structure_string": "Co8 Si4\n1.0\n3.713690 -0.000000 0.000000\n0.000000 4.904398 0.000000\n0.000000 0.000000 7.059441\nCo Si\n8 4\ndirect\n0.750000 0.827568 0.434753 Co\n0.250000 0.172433 0.565247 Co\n0.750000 0.327567 0.065247 Co\n0.250000 0.672433 0.934753 Co\n0.250000 0.536541 0.283494 Co\n0.750000 0.463459 0.716506 Co\n0.250000 0.036541 0.216506 Co\n0.750000 0.963459 0.783494 Co\n0.250000 0.204398 0.894234 Si\n0.750000 0.795603 0.105766 Si\n0.250000 0.704398 0.605766 Si\n0.750000 0.295603 0.394234 Si\n",
"nsites": 12,
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"elements": [
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],
"chemical_system": "Co-Si",
"density": 7.539753442695543,
"density_atomic": 0.09332963734138348,
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"formula_full": "Co8 Si4",
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"formula_anonymous": "AB2",
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"spacegroup": 62
},
{
"id": "jvasp-38175",
"created_at": "2022-09-04T14:37:48.079187Z",
"updated_at": "2022-09-04T14:37:48.079212Z",
"structure_string": "Rb4 Ga4 H8\n1.0\n4.511129 -0.000000 0.000000\n0.000000 7.462477 0.000000\n0.000000 0.000000 9.339395\nRb Ga H\n4 4 8\ndirect\n0.750000 0.620169 0.171425 Rb\n0.750000 0.120169 0.328575 Rb\n0.250000 0.879832 0.671425 Rb\n0.250000 0.379832 0.828574 Rb\n0.250000 0.937554 0.034836 Ga\n0.250000 0.437554 0.465164 Ga\n0.750000 0.562447 0.534836 Ga\n0.750000 0.062446 0.965164 Ga\n0.750000 0.278421 0.019146 H\n0.250000 0.896961 0.210864 H\n0.250000 0.396960 0.289136 H\n0.750000 0.778421 0.480854 H\n0.250000 0.221579 0.519146 H\n0.750000 0.603040 0.710863 H\n0.750000 0.103040 0.789136 H\n0.250000 0.721579 0.980854 H\n",
"nsites": 16,
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],
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"formula_full": "Rb4 Ga4 H8",
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"spacegroup": 62
},
{
"id": "jvasp-32166",
"created_at": "2022-09-04T14:37:48.101796Z",
"updated_at": "2022-09-04T14:37:48.101815Z",
"structure_string": "In4 Sb4 S12\n1.0\n3.882718 -0.000000 0.000000\n0.000000 9.444480 0.000000\n0.000000 0.000000 13.218657\nIn Sb S\n4 4 12\ndirect\n0.250000 0.153210 0.043858 In\n0.750000 0.846790 0.956142 In\n0.250000 0.653210 0.456142 In\n0.750000 0.346790 0.543858 In\n0.250000 0.524268 0.850719 Sb\n0.250000 0.024268 0.649281 Sb\n0.750000 0.975732 0.350719 Sb\n0.750000 0.475732 0.149281 Sb\n0.250000 -0.001127 0.882473 S\n0.750000 0.001127 0.117527 S\n0.250000 0.310902 0.208247 S\n0.750000 0.841422 0.520016 S\n0.250000 0.158578 0.479984 S\n0.750000 0.341422 0.979984 S\n0.250000 0.658578 0.020016 S\n0.750000 0.189098 0.708247 S\n0.250000 0.810902 0.291754 S\n0.750000 0.689098 0.791754 S\n0.750000 0.501127 0.382473 S\n0.250000 0.498873 0.617528 S\n",
"nsites": 20,
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],
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"density": 4.5599064915159,
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"spacegroup": 62
},
{
"id": "jvasp-21894",
"created_at": "2022-09-04T14:37:48.280417Z",
"updated_at": "2022-09-04T14:37:48.280435Z",
"structure_string": "Na4 Cd4 Sb4\n1.0\n4.765825 -0.000000 0.000000\n0.000000 8.002835 0.000000\n0.000000 0.000000 8.606441\nNa Cd Sb\n4 4 4\ndirect\n0.750001 0.485203 0.681392 Na\n0.250000 0.514796 0.318608 Na\n0.750001 0.985203 0.818608 Na\n0.250000 0.014796 0.181392 Na\n0.750001 0.349937 0.078082 Cd\n0.250000 0.650062 0.921918 Cd\n0.750001 0.849937 0.421918 Cd\n0.250000 0.150063 0.578082 Cd\n0.750001 0.726370 0.103806 Sb\n0.250000 0.273630 0.896194 Sb\n0.750001 0.226370 0.396194 Sb\n0.250000 0.773629 0.603806 Sb\n",
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},
{
"id": "jvasp-25002",
"created_at": "2022-09-04T14:37:49.136555Z",
"updated_at": "2022-09-04T14:37:49.136567Z",
"structure_string": "Dy4 Se4 Cl4 O12\n1.0\n6.965149 0.000000 0.000000\n-0.000000 7.124381 0.000000\n0.000000 0.000000 8.871151\nDy Se Cl O\n4 4 4 12\ndirect\n0.750000 0.395641 0.039319 Dy\n0.750000 0.895641 0.460681 Dy\n0.250000 0.604358 0.960681 Dy\n0.250000 0.104359 0.539319 Dy\n0.750000 0.300334 0.632176 Se\n0.250000 0.699666 0.367824 Se\n0.750000 0.800334 0.867824 Se\n0.250000 0.199666 0.132176 Se\n0.250000 0.949828 0.820321 Cl\n0.750000 0.550172 0.320321 Cl\n0.250000 0.449828 0.679679 Cl\n0.750000 0.050172 0.179679 Cl\n0.750000 0.249438 0.819208 O\n0.927742 0.647731 0.935055 O\n0.572258 0.647731 0.935055 O\n0.750000 0.749438 0.680792 O\n0.072258 0.352269 0.064945 O\n0.072258 0.852269 0.435055 O\n0.250000 0.750562 0.180792 O\n0.927742 0.147731 0.564945 O\n0.250000 0.250562 0.319208 O\n0.427742 0.352269 0.064945 O\n0.572258 0.147731 0.564945 O\n0.427742 0.852269 0.435055 O\n",
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"formula_full": "Dy4 Se4 Cl4 O12",
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"formula_anonymous": "ABCD3",
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"spacegroup": 62
},
{
"id": "jvasp-21774",
"created_at": "2022-09-04T14:37:48.614548Z",
"updated_at": "2022-09-04T14:37:48.614564Z",
"structure_string": "Sr4 Zn4 Sb8\n1.0\n4.438553 -0.000000 0.000000\n-0.000000 4.476713 0.000000\n0.000000 0.000000 22.713427\nSr Zn Sb\n4 4 8\ndirect\n0.250000 0.770456 0.616867 Sr\n0.750000 0.229544 0.383133 Sr\n0.750000 0.270456 0.883133 Sr\n0.250000 0.729543 0.116867 Sr\n0.250000 0.271228 0.750024 Zn\n0.750000 0.728772 0.249976 Zn\n0.750000 0.771227 0.749976 Zn\n0.250000 0.228772 0.250024 Zn\n0.250000 0.221129 0.001132 Sb\n0.750000 0.778871 0.998868 Sb\n0.750000 0.721128 0.498868 Sb\n0.250000 0.278871 0.501132 Sb\n0.250000 0.729333 0.324437 Sb\n0.750000 0.270666 0.675563 Sb\n0.750000 0.229333 0.175563 Sb\n0.250000 0.770666 0.824437 Sb\n",
"nsites": 16,
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"formula_full": "Sr4 Zn4 Sb8",
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{
"id": "jvasp-32165",
"created_at": "2022-09-04T14:37:48.892451Z",
"updated_at": "2022-09-04T14:37:48.892485Z",
"structure_string": "Zr4 Pb4 S12\n1.0\n3.803540 -0.000000 0.000000\n-0.000000 9.113608 0.000000\n0.000000 0.000000 13.947818\nZr Pb S\n4 4 12\ndirect\n0.750000 0.831927 0.951182 Zr\n0.250000 0.168073 0.048818 Zr\n0.750000 0.331927 0.548818 Zr\n0.250000 0.668073 0.451182 Zr\n0.750000 0.484750 0.174584 Pb\n0.750000 0.984750 0.325416 Pb\n0.250000 0.015251 0.674584 Pb\n0.250000 0.515251 0.825416 Pb\n0.250000 0.773182 0.283760 S\n0.750000 0.226818 0.716240 S\n0.250000 0.509005 0.605628 S\n0.750000 0.832198 0.512572 S\n0.250000 0.167802 0.487429 S\n0.750000 0.332198 0.987429 S\n0.250000 0.667802 0.012571 S\n0.750000 0.990996 0.105628 S\n0.250000 0.009005 0.894372 S\n0.750000 0.490995 0.394372 S\n0.750000 0.726819 0.783760 S\n0.250000 0.273182 0.216240 S\n",
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"volume": 483.4867805957112,
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"formula_anonymous": "ABC3",
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}
]
}