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{
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"results": [
{
"id": "jvasp-5461",
"created_at": "2022-09-04T14:38:10.624996Z",
"updated_at": "2022-09-04T14:38:10.625013Z",
"structure_string": "Al2 Sb2 I12\n1.0\n6.896856 0.057715 2.377134\n2.925097 9.655246 1.807437\n0.096631 -0.023674 10.248752\nAl Sb I\n2 2 12\ndirect\n0.374415 0.795783 0.795782 Al\n0.625585 0.204218 0.204217 Al\n-0.000000 0.200494 0.799506 Sb\n0.000000 0.799507 0.200494 Sb\n0.066792 0.783285 0.454439 I\n0.933209 0.545561 0.216715 I\n0.933209 0.216715 0.545561 I\n0.066791 0.454439 0.783285 I\n0.533809 0.971638 0.290618 I\n0.466192 0.709382 0.028362 I\n0.466192 0.028362 0.709382 I\n0.533808 0.290618 0.971638 I\n0.018591 0.145055 0.145055 I\n0.981410 0.854945 0.854944 I\n0.442079 0.380140 0.380140 I\n0.557922 0.619860 0.619859 I\n",
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{
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"structure_string": "Zr4 Al4 Ir4\n1.0\n5.350003 -0.001094 0.000000\n-2.631311 4.658190 0.000000\n-0.000000 0.000000 8.236969\nZr Al Ir\n4 4 4\ndirect\n0.334664 0.665336 0.208360 Zr\n0.669997 0.330003 0.322843 Zr\n0.669997 0.330003 0.677157 Zr\n0.334664 0.665336 0.791640 Zr\n0.994350 0.005651 0.253501 Al\n0.994350 0.005651 0.746499 Al\n0.829234 0.653757 -0.000000 Al\n0.346243 0.170766 -0.000000 Al\n0.829678 0.170323 -0.000000 Ir\n0.168585 0.337710 0.500000 Ir\n0.662290 0.831415 0.500000 Ir\n0.166338 0.833662 0.500000 Ir\n",
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"formula_full": "Zr4 Al4 Ir4",
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{
"id": "jvasp-41982",
"created_at": "2022-09-04T14:37:31.953871Z",
"updated_at": "2022-09-04T14:37:31.953900Z",
"structure_string": "Al1 Zn1 Ir2\n1.0\n0.000000 3.028780 3.028780\n3.028780 0.000000 3.028780\n3.028780 3.028780 -0.000000\nAl Zn Ir\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Al\n0.750001 0.750001 0.750001 Zn\n0.000000 0.000000 0.000000 Ir\n0.500001 0.500001 0.500001 Ir\n",
"nsites": 4,
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"spacegroup": 225
},
{
"id": "jvasp-89911",
"created_at": "2022-09-04T14:35:45.877809Z",
"updated_at": "2022-09-04T14:35:45.877834Z",
"structure_string": "U3 Al3 Ir3\n1.0\n0.000000 0.000000 -4.118374\n-3.458031 -5.989485 0.000000\n-3.458172 5.989567 0.000000\nU Al Ir\n3 3 3\ndirect\n0.499999 0.577567 -0.000000 U\n0.499999 0.422408 0.422412 U\n0.499999 -0.000005 0.577587 U\n0.000000 0.236043 -0.000000 Al\n0.000000 0.763925 0.763953 Al\n0.000000 -0.000029 0.236046 Al\n0.000000 0.333330 0.666658 Ir\n0.000000 0.666671 0.333341 Ir\n0.499999 0.999990 -0.000001 Ir\n",
"nsites": 9,
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"density": 13.35108856280175,
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"volume": 170.60272736955346,
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"formula_full": "U3 Al3 Ir3",
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"spacegroup": 189
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{
"id": "jvasp-62432",
"created_at": "2022-09-04T14:35:56.590264Z",
"updated_at": "2022-09-04T14:35:56.590283Z",
"structure_string": "U3 Al3 Ir3\n1.0\n3.458080 -5.989568 0.000000\n3.458080 5.989568 0.000000\n0.000000 0.000000 4.117404\nU Al Ir\n3 3 3\ndirect\n0.577602 0.000002 0.500000 U\n0.000002 0.577602 0.500000 U\n0.422399 0.422399 0.500000 U\n0.236062 0.000001 0.000000 Al\n0.000001 0.236062 0.000000 Al\n0.763935 0.763935 0.000000 Al\n0.333334 0.666669 0.000000 Ir\n0.666669 0.333334 0.000000 Ir\n0.999996 0.999996 0.500000 Ir\n",
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{
"id": "jvasp-119069",
"created_at": "2022-09-04T14:38:50.591237Z",
"updated_at": "2022-09-04T14:38:50.591269Z",
"structure_string": "Tm4 Al18 Ir6\n1.0\n7.515828 0.007054 0.000000\n-3.716026 6.532907 0.000000\n0.000000 0.000000 9.449412\nTm Al Ir\n4 18 6\ndirect\n0.995702 0.671777 0.250000 Tm\n0.004298 0.328223 0.750000 Tm\n0.671777 0.995702 0.250000 Tm\n0.328223 0.004298 0.750000 Tm\n0.450892 0.660739 0.750000 Al\n0.549108 0.339261 0.250000 Al\n0.660739 0.450892 0.750000 Al\n0.339261 0.549108 0.250000 Al\n0.333047 0.333047 0.943939 Al\n0.666952 0.666952 0.056061 Al\n0.666952 0.666952 0.443939 Al\n0.333047 0.333047 0.556061 Al\n0.335303 0.000717 0.075243 Al\n0.664696 0.999283 0.575243 Al\n0.000717 0.335304 0.424757 Al\n0.335303 0.000717 0.424757 Al\n0.999283 0.664696 0.575243 Al\n0.999283 0.664696 0.924757 Al\n0.000717 0.335304 0.075243 Al\n0.871217 0.871217 0.750000 Al\n0.128783 0.128783 0.250000 Al\n0.664696 0.999283 0.924757 Al\n0.000000 0.000000 0.000000 Ir\n0.672089 0.327910 -0.000000 Ir\n0.327910 0.672090 -0.000000 Ir\n0.327910 0.672090 0.500000 Ir\n0.672089 0.327910 0.500000 Ir\n0.000000 0.000000 0.500000 Ir\n",
"nsites": 28,
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"elements": [
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"density_atomic": 0.060316779549200006,
"volume": 464.2157656504287,
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"formula_full": "Tm4 Al18 Ir6",
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{
"id": "jvasp-112308",
"created_at": "2022-09-04T14:38:26.469303Z",
"updated_at": "2022-09-04T14:38:26.469328Z",
"structure_string": "Ti6 Al16 Ir7\n1.0\n7.439956 -0.000000 4.295461\n2.479985 7.014458 4.295461\n0.000000 0.000000 8.590922\nTi Al Ir\n6 16 7\ndirect\n0.674656 0.674656 0.325344 Ti\n0.325345 0.674656 0.325344 Ti\n0.674656 0.325345 0.325344 Ti\n0.325345 0.325345 0.674655 Ti\n0.674656 0.325345 0.674655 Ti\n0.325345 0.674656 0.674655 Ti\n0.342688 0.342688 0.342687 Al\n0.971937 0.342688 0.342687 Al\n0.342688 0.971937 0.342687 Al\n0.342688 0.342688 0.971936 Al\n0.657313 0.657312 0.657312 Al\n0.028064 0.657312 0.657312 Al\n0.657313 0.028063 0.657312 Al\n0.657313 0.657312 0.028063 Al\n0.638811 0.120397 0.120397 Al\n0.120397 0.638810 0.120397 Al\n0.120397 0.120397 0.638810 Al\n0.879604 0.879603 0.879602 Al\n0.361190 0.879603 0.879602 Al\n0.879604 0.361190 0.879602 Al\n0.879604 0.879603 0.361189 Al\n0.120397 0.120397 0.120397 Al\n0.000000 0.500000 -0.000000 Ir\n0.000000 0.000000 0.000000 Ir\n0.000000 0.000000 0.500000 Ir\n0.500000 0.000000 0.500000 Ir\n0.000000 0.500000 0.500000 Ir\n0.500001 0.500000 -0.000000 Ir\n0.500000 0.000000 -0.000000 Ir\n",
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{
"id": "jvasp-103320",
"created_at": "2022-09-04T14:36:38.322410Z",
"updated_at": "2022-09-04T14:36:38.322431Z",
"structure_string": "Ti1 Al1 Ir2\n1.0\n3.770483 -0.000000 2.176889\n1.256827 3.554846 2.176889\n-0.000000 -0.000000 4.353779\nTi Al Ir\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500001 0.500000 Al\n0.750000 0.750001 0.750000 Ir\n0.250000 0.250000 0.250000 Ir\n",
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{
"id": "jvasp-89982",
"created_at": "2022-09-04T14:36:16.956752Z",
"updated_at": "2022-09-04T14:36:16.956775Z",
"structure_string": "Th3 Al3 Ir3\n1.0\n0.000000 0.000000 -4.155037\n-3.627799 -6.283534 0.000000\n-3.628056 6.283681 0.000000\nTh Al Ir\n3 3 3\ndirect\n0.500000 0.582166 0.000000 Th\n0.500000 0.417816 0.417823 Th\n0.500000 0.999992 0.582178 Th\n0.000000 0.229445 0.000000 Al\n0.000000 0.770517 0.770539 Al\n0.000000 0.999978 0.229462 Al\n0.000000 0.333336 0.666671 Ir\n0.000000 0.666666 0.333330 Ir\n0.500000 -0.000016 -0.000000 Ir\n",
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{
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"created_at": "2022-09-04T14:37:14.797417Z",
"updated_at": "2022-09-04T14:37:14.797445Z",
"structure_string": "Al2 Tc1 Ir1\n1.0\n-7.886525 -3.675496 -6.014766\n-5.280406 -3.045001 -0.740604\n-3.080503 0.926156 -2.993638\nAl Tc Ir\n2 1 1\ndirect\n0.753401 0.990206 0.996190 Al\n0.246598 0.009795 0.003812 Al\n0.000000 0.000000 0.000000 Tc\n0.500001 -0.000000 -0.000000 Ir\n",
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{
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{
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"structure_string": "Sc6 Al16 Ir7\n1.0\n0.000000 6.188124 6.188124\n6.188124 0.000000 6.188124\n6.188124 6.188124 0.000000\nSc Al Ir\n6 16 7\ndirect\n0.704973 0.295025 0.295025 Sc\n0.295024 0.704975 0.704975 Sc\n0.295025 0.704973 0.295025 Sc\n0.295025 0.295025 0.704973 Sc\n0.704975 0.295024 0.704975 Sc\n0.704975 0.704975 0.295024 Sc\n0.359583 0.880138 0.880138 Al\n0.880138 0.359583 0.880138 Al\n0.880138 0.880138 0.359583 Al\n0.880138 0.880138 0.880138 Al\n0.119861 0.640417 0.119861 Al\n0.640417 0.119861 0.119861 Al\n0.119861 0.119861 0.640417 Al\n0.119861 0.119861 0.119861 Al\n0.663602 0.009190 0.663602 Al\n0.663602 0.663602 0.009190 Al\n0.663602 0.663602 0.663602 Al\n0.336397 0.990808 0.336397 Al\n0.990808 0.336397 0.336397 Al\n0.336397 0.336397 0.990808 Al\n0.336397 0.336397 0.336397 Al\n0.009190 0.663602 0.663602 Al\n0.499999 0.000001 0.499999 Ir\n0.000000 0.000000 0.000000 Ir\n0.500000 0.000000 0.000000 Ir\n0.000001 0.499999 0.499999 Ir\n0.000000 0.500000 0.000000 Ir\n0.000000 0.000000 0.500000 Ir\n0.499999 0.499999 0.000001 Ir\n",
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]
}