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{
"id": "mp-504371",
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"formula_full": "Li2 Ni12 P14 O48",
"formula_reduced": "LiNi6P7O24",
"formula_anonymous": "AB6C7D24",
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"spacegroup": 11
},
{
"id": "mp-1220935",
"created_at": "2022-09-04T14:44:26.412568Z",
"structure_string": "Na1 Ti2 P4 O14\n1.0\n4.914458 0.000000 0.000000\n-1.921175 6.821408 0.000000\n-0.537065 -0.274346 8.089104\nNa Ti P O\n1 2 4 14\ndirect\n0.935696 0.992792 0.008909 Na\n0.498100 0.497143 0.999706 Ti\n0.000201 0.999828 0.500818 Ti\n0.010229 0.625687 0.756318 P\n0.989401 0.375229 0.244391 P\n0.622360 0.236659 0.697931 P\n0.378580 0.764435 0.301625 P\n0.268209 0.555010 0.810404 O\n0.731221 0.445671 0.190537 O\n0.794741 0.453057 0.643552 O\n0.206764 0.547406 0.355721 O\n0.818670 0.101534 0.691599 O\n0.179674 0.897517 0.308419 O\n0.853253 0.668119 0.905023 O\n0.142949 0.330838 0.094618 O\n0.367348 0.180328 0.571862 O\n0.632406 0.821161 0.428609 O\n0.089472 0.801273 0.647102 O\n0.909983 0.198009 0.351956 O\n0.541891 0.256103 0.876477 O\n0.465152 0.745301 0.124224 O\n",
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"density_atomic": 0.07744069137259178,
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"formula_full": "Na1 Ti2 P4 O14",
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"updated_at": "2021-11-28T01:36:26.774000Z",
"spacegroup": 1
},
{
"id": "mp-1221660",
"created_at": "2022-09-04T14:44:29.579101Z",
"structure_string": "Mn1 Al2 Cu1\n1.0\n2.806630 0.000000 0.000000\n0.000000 2.806630 0.000000\n0.000000 0.000000 6.683073\nMn Al Cu\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.748388 Al\n0.000000 0.000000 0.251612 Al\n0.500000 0.500000 0.000000 Cu\n",
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"formula_full": "Mn1 Al2 Cu1",
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"updated_at": "2021-11-28T01:36:43.853000Z",
"spacegroup": 123
},
{
"id": "mp-1228798",
"created_at": "2022-09-04T14:44:25.908839Z",
"structure_string": "Cs2 Ta2 Te6\n1.0\n0.000000 0.000000 -6.400979\n-4.159902 -7.205180 0.000000\n-4.159902 7.205180 0.000000\nCs Ta Te\n2 2 6\ndirect\n0.249033 0.666692 0.333308 Cs\n0.749033 0.333308 0.666692 Cs\n0.529940 0.000002 0.999998 Ta\n0.029940 0.999998 0.000002 Ta\n0.757211 0.839284 0.678585 Te\n0.757205 0.839297 0.160703 Te\n0.757211 0.321415 0.160716 Te\n0.257211 0.160716 0.321415 Te\n0.257205 0.160703 0.839297 Te\n0.257211 0.678585 0.839284 Te\n",
"nsites": 10,
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"elements": [
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"formula_reduced": "CsTaTe3",
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{
"id": "mp-1518260",
"created_at": "2022-09-04T14:44:25.795992Z",
"structure_string": "Sr1 La1 Eu1 Sb1 O6\n1.0\n-0.000000 -4.311002 -4.311002\n4.311002 0.000000 -4.311002\n4.311002 -4.311002 -0.000000\nSr La Eu Sb O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n-0.000000 -0.000000 -0.000000 La\n0.750000 0.750000 0.750000 Eu\n0.500000 0.500000 0.500000 Sb\n0.731342 0.268658 0.268658 O\n0.268658 0.731342 0.731342 O\n0.731342 0.268658 0.731342 O\n0.268658 0.731342 0.268658 O\n0.731342 0.731342 0.268658 O\n0.268658 0.268658 0.731342 O\n",
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"volume": 160.23768747875548,
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"formula_full": "Sr1 La1 Eu1 Sb1 O6",
"formula_reduced": "SrLaEuSbO6",
"formula_anonymous": "ABCDE6",
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{
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"structure_string": "K1 Na4 Cl5\n1.0\n16.952993 -2.058688 0.000000\n16.952993 2.058688 0.000000\n16.702996 0.000000 3.556978\nK Na Cl\n1 4 5\ndirect\n0.000000 0.000000 0.000000 K\n0.596229 0.596229 0.596229 Na\n0.199226 0.199226 0.199226 Na\n0.800774 0.800774 0.800774 Na\n0.403771 0.403771 0.403771 Na\n0.705516 0.705516 0.705516 Cl\n0.500000 0.500000 0.500000 Cl\n0.102184 0.102184 0.102184 Cl\n0.294484 0.294484 0.294484 Cl\n0.897816 0.897816 0.897816 Cl\n",
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"formula_full": "K1 Na4 Cl5",
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{
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{
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"structure_string": "Zn20 Co2 B16 Rh36\n1.0\n17.914220 0.000000 0.000000\n0.000000 17.914220 0.000000\n0.000000 0.000000 2.878695\nZn Co B Rh\n20 2 16 36\ndirect\n0.550056 0.050056 0.000000 Zn\n0.449944 0.949944 0.000000 Zn\n0.050056 0.449944 0.000000 Zn\n0.949944 0.550056 0.000000 Zn\n0.031779 0.187529 0.000000 Zn\n0.968221 0.812471 0.000000 Zn\n0.187529 0.968221 0.000000 Zn\n0.531779 0.312471 0.000000 Zn\n0.812471 0.031779 0.000000 Zn\n0.468221 0.687529 0.000000 Zn\n0.687529 0.531779 0.000000 Zn\n0.312471 0.468221 0.000000 Zn\n0.209418 0.709418 0.000000 Zn\n0.790582 0.290582 0.000000 Zn\n0.709418 0.790582 0.000000 Zn\n0.290582 0.209418 0.000000 Zn\n0.668919 0.168919 0.000000 Zn\n0.331081 0.831081 0.000000 Zn\n0.168919 0.331081 0.000000 Zn\n0.831081 0.668919 0.000000 Zn\n0.000000 0.000000 0.000000 Co\n0.500000 0.500000 0.000000 Co\n0.334099 0.038830 0.000000 B\n0.665901 0.961170 0.000000 B\n0.038830 0.665901 0.000000 B\n0.834099 0.461170 0.000000 B\n0.961170 0.334099 0.000000 B\n0.165901 0.538830 0.000000 B\n0.538830 0.834099 0.000000 B\n0.461170 0.165901 0.000000 B\n0.166619 0.124135 0.000000 B\n0.833381 0.875865 0.000000 B\n0.124135 0.833381 0.000000 B\n0.666619 0.375865 0.000000 B\n0.875865 0.166619 0.000000 B\n0.333381 0.624135 0.000000 B\n0.624135 0.666619 0.000000 B\n0.375865 0.333381 0.000000 B\n0.255190 0.087601 0.500000 Rh\n0.744810 0.912399 0.500000 Rh\n0.087601 0.744810 0.500000 Rh\n0.755190 0.412399 0.500000 Rh\n0.912399 0.255190 0.500000 Rh\n0.244810 0.587601 0.500000 Rh\n0.587601 0.755190 0.500000 Rh\n0.412399 0.244810 0.500000 Rh\n0.047768 0.326090 0.500000 Rh\n0.952232 0.673910 0.500000 Rh\n0.326090 0.952232 0.500000 Rh\n0.547768 0.173910 0.500000 Rh\n0.673910 0.047768 0.500000 Rh\n0.452232 0.826090 0.500000 Rh\n0.826090 0.547768 0.500000 Rh\n0.173910 0.452232 0.500000 Rh\n0.159723 0.210911 0.500000 Rh\n0.840277 0.789089 0.500000 Rh\n0.210911 0.840277 0.500000 Rh\n0.659723 0.289089 0.500000 Rh\n0.789089 0.159723 0.500000 Rh\n0.340277 0.710911 0.500000 Rh\n0.710911 0.659723 0.500000 Rh\n0.289089 0.340277 0.500000 Rh\n0.098783 0.066755 0.500000 Rh\n0.901217 0.933245 0.500000 Rh\n0.066755 0.901217 0.500000 Rh\n0.598783 0.433245 0.500000 Rh\n0.933245 0.098783 0.500000 Rh\n0.401217 0.566755 0.500000 Rh\n0.566755 0.598783 0.500000 Rh\n0.433245 0.401217 0.500000 Rh\n0.082478 0.582478 0.500000 Rh\n0.917522 0.417522 0.500000 Rh\n0.582478 0.917522 0.500000 Rh\n0.417522 0.082478 0.500000 Rh\n",
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{
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{
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{
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}