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{
"id": "jvasp-5353",
"created_at": "2022-09-04T14:36:00.776854Z",
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"structure_string": "Al2 P2 S8\n1.0\n5.695531 0.000000 0.000000\n0.000000 5.697591 0.000000\n0.000000 0.000000 9.367187\nAl P S\n2 2 8\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.000000 0.500000 Al\n0.000000 0.500000 0.000000 P\n0.000000 0.000000 0.500000 P\n0.212321 0.275747 0.117277 S\n0.212321 0.724252 0.882723 S\n0.787679 0.275747 0.882723 S\n0.787679 0.724252 0.117277 S\n0.774380 0.791612 0.619776 S\n0.774380 0.208388 0.380224 S\n0.225620 0.791612 0.380224 S\n0.225620 0.208388 0.619776 S\n",
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{
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{
"id": "jvasp-21270",
"created_at": "2022-09-04T14:37:29.864224Z",
"updated_at": "2022-09-04T14:37:29.864256Z",
"structure_string": "Al4 Si4 P12\n1.0\n5.922357 -0.000000 0.000000\n0.000000 6.151006 0.000000\n0.000000 0.000000 9.971882\nAl Si P\n4 4 12\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Al\n0.500000 0.500000 0.000000 Al\n0.000000 0.000000 0.500000 Al\n0.000126 0.561936 0.750000 Si\n-0.000126 0.438065 0.250000 Si\n0.499874 0.061935 0.250000 Si\n0.500126 0.938065 0.750000 Si\n0.111450 0.085597 0.250000 P\n0.888550 0.914404 0.750000 P\n0.610939 0.892304 0.441307 P\n0.110938 0.607697 0.058693 P\n0.889062 0.392303 0.558693 P\n0.110938 0.607697 0.441307 P\n0.389062 0.107697 0.558693 P\n0.610939 0.892304 0.058693 P\n0.611451 0.414404 0.250000 P\n0.388550 0.585597 0.750000 P\n0.389062 0.107697 0.941307 P\n0.889062 0.392303 0.941307 P\n",
"nsites": 20,
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"chemical_system": "Al-P-Si",
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"volume": 363.26023915756195,
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"formula_full": "Al4 Si4 P12",
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{
"id": "jvasp-10575",
"created_at": "2022-09-04T14:37:19.784930Z",
"updated_at": "2022-09-04T14:37:19.784962Z",
"structure_string": "Sr6 Al4 P8\n1.0\n6.667216 -0.014015 0.085882\n0.074598 8.085080 2.097549\n-0.022967 0.004432 8.353038\nSr Al P\n6 4 8\ndirect\n0.750001 0.598516 0.401485 Sr\n0.039959 0.748299 0.008663 Sr\n0.460041 0.991337 0.251701 Sr\n0.960041 0.251701 0.991337 Sr\n0.539959 0.008663 0.748299 Sr\n0.250000 0.401485 0.598515 Sr\n0.418458 0.418076 0.172261 Al\n0.918458 0.172262 0.418076 Al\n0.581543 0.581924 0.827739 Al\n0.081543 0.827738 0.581924 Al\n0.575590 0.259295 0.420765 P\n0.024160 0.058646 0.705814 P\n0.424411 0.740705 0.579235 P\n0.975840 0.941354 0.294186 P\n0.524161 0.705814 0.058646 P\n0.475840 0.294186 0.941354 P\n0.924411 0.579235 0.740705 P\n0.075590 0.420765 0.259295 P\n",
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"formula_full": "Sr6 Al4 P8",
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"spacegroup": 15
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{
"id": "jvasp-98682",
"created_at": "2022-09-04T14:35:52.711175Z",
"updated_at": "2022-09-04T14:35:52.711206Z",
"structure_string": "Al8 Pt16\n1.0\n3.957397 0.000000 0.000000\n0.000000 5.514333 -0.000000\n0.000000 0.000000 16.544940\nAl Pt\n8 16\ndirect\n0.000000 0.202707 0.750000 Al\n0.000000 0.797293 0.250000 Al\n0.000000 0.683811 0.591997 Al\n0.000000 0.316188 0.408003 Al\n0.000000 0.683811 0.908003 Al\n0.000000 0.316188 0.091997 Al\n0.500000 0.000000 0.500000 Al\n0.500000 0.000000 0.000000 Al\n0.000000 0.799709 0.431937 Pt\n0.000000 0.200290 0.568063 Pt\n0.500000 0.500000 0.000000 Pt\n0.500000 0.500000 0.500000 Pt\n0.500000 0.058298 0.154592 Pt\n0.500000 0.941702 0.845408 Pt\n0.000000 0.729063 0.750000 Pt\n0.500000 0.437064 0.831920 Pt\n0.500000 0.437064 0.668080 Pt\n0.500000 0.562936 0.331920 Pt\n0.000000 0.200290 0.931937 Pt\n0.500000 0.562936 0.168080 Pt\n0.500000 0.941702 0.654592 Pt\n0.500000 0.058298 0.345408 Pt\n0.000000 0.270937 0.250000 Pt\n0.000000 0.799709 0.068063 Pt\n",
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"elements": [
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"density": 15.348397791995641,
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"volume": 361.0503792497282,
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"formula_full": "Al8 Pt16",
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{
"id": "jvasp-20161",
"created_at": "2022-09-04T14:38:13.634678Z",
"updated_at": "2022-09-04T14:38:13.634694Z",
"structure_string": "Al6 Pt10\n1.0\n4.003127 0.000000 0.000000\n0.000000 5.473913 0.000000\n0.000000 0.000000 10.917031\nAl Pt\n6 10\ndirect\n0.500000 0.179137 0.640136 Al\n0.500000 0.820862 0.359863 Al\n0.500000 0.679137 0.859863 Al\n0.500000 0.320863 0.140136 Al\n0.000000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.500000 0.292428 0.393099 Pt\n0.500000 0.707572 0.606901 Pt\n0.500000 0.792427 0.106901 Pt\n0.500000 0.207572 0.893099 Pt\n0.000000 0.426010 0.729348 Pt\n0.000000 0.573989 0.270651 Pt\n0.000000 0.926010 0.770651 Pt\n0.000000 0.073990 0.229348 Pt\n0.000000 0.500000 0.000000 Pt\n0.000000 0.000000 0.500000 Pt\n",
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"elements": [
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"chemical_system": "Al-Pt",
"density": 14.665306233178969,
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"volume": 239.22237766044375,
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"formula_full": "Al6 Pt10",
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{
"id": "jvasp-98460",
"created_at": "2022-09-04T14:36:11.917019Z",
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"structure_string": "Al4 Pt8\n1.0\n4.113315 0.000000 0.000000\n0.000000 5.480551 0.000000\n0.000000 0.000000 7.990255\nAl Pt\n4 8\ndirect\n0.749999 0.307171 0.396387 Al\n0.250000 0.692828 0.603612 Al\n0.749999 0.807171 0.103613 Al\n0.250000 0.192828 0.896387 Al\n0.749999 0.957992 0.792856 Pt\n0.250000 0.042008 0.207143 Pt\n0.749999 0.457992 0.707143 Pt\n0.250000 0.542008 0.292856 Pt\n0.749999 0.840484 0.430724 Pt\n0.250000 0.159516 0.569275 Pt\n0.749999 0.340484 0.069275 Pt\n0.250000 0.659516 0.930724 Pt\n",
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{
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"structure_string": "Al1 Pt3\n1.0\n3.925145 -0.000000 0.000000\n0.000000 3.925145 0.000000\n0.000000 0.000000 3.925145\nAl Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Al\n0.000000 0.499999 0.499999 Pt\n0.499999 0.499999 0.000000 Pt\n0.499999 0.000000 0.499999 Pt\n",
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{
"id": "jvasp-91675",
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"updated_at": "2022-09-04T14:35:41.417432Z",
"structure_string": "Al2 Pt6\n1.0\n0.000000 -0.000000 3.924818\n5.551413 -0.000000 0.000000\n0.000000 5.551413 -0.000000\nAl Pt\n2 6\ndirect\n0.500000 0.500000 0.000000 Al\n0.500000 0.000000 0.500000 Al\n0.000000 0.251100 0.751100 Pt\n0.000000 0.748900 0.248900 Pt\n0.000000 0.248900 0.251100 Pt\n0.000000 0.751100 0.748900 Pt\n0.500000 0.500000 0.500000 Pt\n0.500000 0.000000 0.000000 Pt\n",
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{
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"created_at": "2022-09-04T14:38:28.565162Z",
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"structure_string": "Al2 Pt1\n1.0\n3.643281 0.000000 2.103449\n1.214427 3.434918 2.103449\n-0.000000 0.000000 4.206898\nAl Pt\n2 1\ndirect\n0.250000 0.250000 0.250000 Al\n0.750000 0.750000 0.750000 Al\n0.000000 0.000000 0.000000 Pt\n",
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{
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"structure_string": "Al1 Pt1\n1.0\n3.094224 -0.000000 0.000000\n0.000000 3.094224 -0.000000\n0.000000 0.000000 3.094224\nAl Pt\n1 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.499999 0.499999 0.499999 Pt\n",
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{
"id": "jvasp-16378",
"created_at": "2022-09-04T14:38:03.082199Z",
"updated_at": "2022-09-04T14:38:03.082235Z",
"structure_string": "Al3 Pt2\n1.0\n2.118111 -3.668677 -0.000000\n2.118111 3.668677 0.000000\n0.000000 0.000000 5.260502\nAl Pt\n3 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.333333 0.666667 0.647718 Al\n0.666667 0.333333 0.352282 Al\n0.333333 0.666667 0.170739 Pt\n0.666667 0.333333 0.829260 Pt\n",
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}