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"results": [
{
"id": "jvasp-110927",
"created_at": "2022-09-04T14:38:37.458551Z",
"updated_at": "2022-09-04T14:38:37.458573Z",
"structure_string": "Rb2 Li1 Ru1 Cl6\n1.0\n6.922451 0.000000 0.000000\n-3.461225 5.995018 0.000000\n-0.000000 -0.000000 5.913364\nRb Li Ru Cl\n2 1 1 6\ndirect\n0.333333 0.666667 0.258439 Rb\n0.666666 0.333333 0.741560 Rb\n0.000000 0.000000 0.000000 Li\n0.000000 0.000000 0.500000 Ru\n0.837703 0.162297 0.265688 Cl\n0.162296 0.837703 0.734311 Cl\n0.837703 0.675405 0.265688 Cl\n0.162297 0.324595 0.734311 Cl\n0.324595 0.162297 0.265688 Cl\n0.675405 0.837703 0.734311 Cl\n",
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{
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"structure_string": "Rb2 Li1 Rh1 F6\n1.0\n5.046791 -0.000000 2.913766\n1.682264 4.758160 2.913766\n-0.000000 -0.000000 5.827532\nRb Li Rh F\n2 1 1 6\ndirect\n0.749999 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500001 Li\n0.000000 0.000000 0.000000 Rh\n0.755513 0.244486 0.244487 F\n0.244486 0.244486 0.755514 F\n0.244486 0.755514 0.755514 F\n0.244486 0.755514 0.244487 F\n0.755513 0.244486 0.755514 F\n0.755513 0.755514 0.244488 F\n",
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{
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"created_at": "2022-09-04T14:36:49.908619Z",
"updated_at": "2022-09-04T14:36:49.908641Z",
"structure_string": "Rb2 Li1 Pr1 I6\n1.0\n7.358026 -0.000000 4.248158\n2.452675 6.937213 4.248158\n-0.000000 -0.000000 8.496316\nRb Li Pr I\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500001 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Pr\n0.742080 0.257920 0.257921 I\n0.257921 0.257920 0.742080 I\n0.257921 0.742079 0.742080 I\n0.257921 0.742079 0.257921 I\n0.742080 0.257920 0.742080 I\n0.742080 0.742079 0.257921 I\n",
"nsites": 10,
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"density_atomic": 0.023058072270599517,
"volume": 433.6875989737713,
"volume_molar": 26.117277668864826,
"formula_full": "Rb2 Li1 Pr1 I6",
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"spacegroup": 225
},
{
"id": "jvasp-106456",
"created_at": "2022-09-04T14:36:46.217488Z",
"updated_at": "2022-09-04T14:36:46.217497Z",
"structure_string": "Rb2 Li1 Pr1 F6\n1.0\n5.353521 -0.000000 3.090857\n1.784507 5.047348 3.090857\n-0.000000 -0.000000 6.181713\nRb Li Pr F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Pr\n0.737714 0.262286 0.262286 F\n0.262286 0.262286 0.737714 F\n0.262286 0.737714 0.737714 F\n0.262286 0.737714 0.262286 F\n0.737714 0.262286 0.737714 F\n0.737714 0.737714 0.262286 F\n",
"nsites": 10,
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"elements": [
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"density_atomic": 0.05986712495610805,
"volume": 167.03658322212002,
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"formula_full": "Rb2 Li1 Pr1 F6",
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{
"id": "jvasp-102905",
"created_at": "2022-09-04T14:36:54.854012Z",
"updated_at": "2022-09-04T14:36:54.854032Z",
"structure_string": "Rb2 Li1 Pr1 Cl6\n1.0\n6.428870 -0.000000 3.711710\n2.142957 6.061197 3.711710\n0.000000 -0.000000 7.423420\nRb Li Pr Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Pr\n0.739911 0.260089 0.260089 Cl\n0.260089 0.260089 0.739911 Cl\n0.260089 0.739912 0.739911 Cl\n0.260089 0.739912 0.260088 Cl\n0.739911 0.260089 0.739911 Cl\n0.739911 0.739912 0.260089 Cl\n",
"nsites": 10,
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{
"id": "jvasp-110382",
"created_at": "2022-09-04T14:38:39.350875Z",
"updated_at": "2022-09-04T14:38:39.350904Z",
"structure_string": "Rb2 Li1 Pr1 Br6\n1.0\n6.790114 -0.000000 3.920275\n2.263372 6.401781 3.920275\n-0.000000 -0.000000 7.840548\nRb Li Pr Br\n2 1 1 6\ndirect\n0.749999 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Pr\n0.740696 0.259304 0.259304 Br\n0.259304 0.259304 0.740696 Br\n0.259304 0.740696 0.740696 Br\n0.259304 0.740696 0.259304 Br\n0.740696 0.259304 0.740696 Br\n0.740695 0.740696 0.259304 Br\n",
"nsites": 10,
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],
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"density_atomic": 0.029341053490806637,
"volume": 340.8193916122772,
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{
"id": "jvasp-31312",
"created_at": "2022-09-04T14:38:33.998785Z",
"updated_at": "2022-09-04T14:38:33.998806Z",
"structure_string": "Rb2 Li14 Pb3 O14\n1.0\n6.574561 0.000000 -3.166436\n-1.825541 6.808078 -3.790420\n0.018112 0.003405 8.446299\nRb Li Pb O\n2 14 3 14\ndirect\n0.231743 0.500000 -0.000000 Rb\n0.768257 0.500000 -0.000000 Rb\n0.138621 0.709924 0.731967 Li\n0.861379 0.977959 0.268034 Li\n0.593345 0.022042 0.731966 Li\n0.500000 0.841469 -0.000000 Li\n0.500000 0.158531 -0.000000 Li\n0.768536 0.413907 0.537072 Li\n0.231464 0.586094 0.462928 Li\n0.231464 0.876836 0.462928 Li\n0.768536 0.123165 0.537072 Li\n0.593345 0.709924 0.731966 Li\n0.861379 0.290077 0.268034 Li\n0.406655 0.977959 0.268034 Li\n0.138621 0.022042 0.731966 Li\n0.406655 0.290077 0.268034 Li\n0.727382 0.727383 0.454764 Pb\n0.000000 0.000000 0.000000 Pb\n0.272618 0.272618 0.545236 Pb\n0.044854 0.751375 0.502749 O\n0.542104 0.248626 0.497251 O\n0.955145 0.248626 0.497251 O\n0.457896 0.751375 0.502749 O\n0.702886 -0.000000 -0.000000 O\n0.297114 -0.000000 -0.000000 O\n0.873081 0.682779 0.746163 O\n0.126919 0.317222 0.253837 O\n0.126919 0.936615 0.253837 O\n0.873081 0.063386 0.746163 O\n0.627899 0.408358 0.255797 O\n0.372101 0.591642 0.744203 O\n0.372101 0.152561 0.744203 O\n0.627899 0.847440 0.255797 O\n",
"nsites": 33,
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],
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},
{
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"created_at": "2022-09-04T14:38:11.515511Z",
"updated_at": "2022-09-04T14:38:11.515543Z",
"structure_string": "Rb1 Li7 Ni2 O6\n1.0\n3.646610 -0.002704 0.001012\n-1.819665 4.978325 -0.022224\n-0.003087 -0.467543 9.859651\nRb Li Ni O\n1 7 2 6\ndirect\n0.010796 0.022222 0.007649 Rb\n0.180018 0.360663 0.259828 Li\n0.744831 0.490239 0.096001 Li\n0.223400 0.447408 0.580649 Li\n0.742768 0.486141 0.410717 Li\n0.277015 0.554565 0.895751 Li\n0.825227 0.650953 0.724716 Li\n0.468801 0.937791 0.534675 Li\n0.576277 0.153054 0.755331 Ni\n0.432956 0.866513 0.263071 Ni\n0.613955 0.228543 0.240846 O\n0.657661 0.315909 0.586572 O\n0.709531 0.419612 0.891018 O\n0.316449 0.633495 0.108477 O\n0.321686 0.643982 0.409531 O\n0.391233 0.782949 0.723095 O\n",
"nsites": 16,
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],
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"density_atomic": 0.08943210315745424,
"volume": 178.90667260536617,
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"formula_full": "Rb1 Li7 Ni2 O6",
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{
"id": "jvasp-106925",
"created_at": "2022-09-04T14:36:57.014684Z",
"updated_at": "2022-09-04T14:36:57.014704Z",
"structure_string": "Rb2 Li1 Nd1 F6\n1.0\n5.331822 -0.000000 3.078329\n1.777274 5.026890 3.078329\n-0.000000 -0.000000 6.156658\nRb Li Nd F\n2 1 1 6\ndirect\n0.749999 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.499999 0.500000 0.500001 Li\n0.000000 0.000000 0.000000 Nd\n0.738944 0.261055 0.261056 F\n0.261055 0.261055 0.738945 F\n0.261055 0.738945 0.738946 F\n0.261055 0.738945 0.261056 F\n0.738944 0.261055 0.738945 F\n0.738944 0.738945 0.261056 F\n",
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{
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"structure_string": "Rb2 Li1 Nd1 Cl6\n1.0\n6.404997 0.000000 3.697927\n2.134999 6.038689 3.697927\n0.000000 -0.000000 7.395853\nRb Li Nd Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Nd\n0.740868 0.259133 0.259133 Cl\n0.259133 0.259133 0.740867 Cl\n0.259133 0.740867 0.740867 Cl\n0.259133 0.740867 0.259133 Cl\n0.740868 0.259133 0.740867 Cl\n0.740868 0.740867 0.259133 Cl\n",
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{
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"structure_string": "Rb8 Li4 Nb4 S16\n1.0\n7.041695 0.043767 0.291883\n1.168688 10.789806 3.592270\n0.051034 0.006479 11.867612\nRb Li Nb S\n8 4 4 16\ndirect\n0.265482 0.371978 0.278110 Rb\n0.734519 0.628023 0.721889 Rb\n0.749500 0.156197 0.856334 Rb\n0.751747 0.651547 0.348109 Rb\n0.250500 0.843804 0.143665 Rb\n0.675466 0.098304 0.251823 Rb\n0.324534 0.901696 0.748177 Rb\n0.248253 0.348454 0.651891 Rb\n0.171084 0.009438 0.414394 Li\n0.783651 0.480603 0.071386 Li\n0.828916 0.990563 0.585605 Li\n0.216349 0.519398 0.928614 Li\n0.776769 0.274682 0.485938 Nb\n0.223231 0.725319 0.514062 Nb\n0.211578 0.229205 0.013202 Nb\n0.788423 0.770796 0.986797 Nb\n0.266098 0.101093 0.898369 S\n0.454786 0.856813 0.465290 S\n0.160576 0.115651 0.206984 S\n0.061115 0.146563 0.532168 S\n0.958472 0.376320 0.935533 S\n0.533698 0.661745 0.993905 S\n0.733902 0.898907 0.101631 S\n0.041529 0.623681 0.064466 S\n0.240331 0.619275 0.713297 S\n0.938885 0.853438 0.467831 S\n0.746900 0.404429 0.599367 S\n0.253100 0.595572 0.400633 S\n0.759669 0.380726 0.286702 S\n0.466302 0.338256 0.006094 S\n0.545214 0.143188 0.534709 S\n0.839424 0.884350 0.793015 S\n",
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],
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"formula_full": "Rb8 Li4 Nb4 S16",
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},
{
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"created_at": "2022-09-04T14:36:54.327028Z",
"updated_at": "2022-09-04T14:36:54.327057Z",
"structure_string": "Rb2 Li1 Nb1 F6\n1.0\n5.151796 -0.000000 2.974391\n1.717265 4.857160 2.974391\n-0.000000 -0.000000 5.948782\nRb Li Nb F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750001 0.750000 0.749999 Rb\n0.500001 0.500000 0.499999 Li\n0.000000 0.000000 0.000000 Nb\n0.251300 0.251299 0.748700 F\n0.251300 0.748701 0.748700 F\n0.748702 0.748701 0.251298 F\n0.251300 0.748701 0.251299 F\n0.748702 0.251299 0.748700 F\n0.748702 0.251299 0.251299 F\n",
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]
}