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{
"id": "jvasp-14676",
"created_at": "2022-09-04T14:37:04.012480Z",
"updated_at": "2022-09-04T14:37:04.012507Z",
"structure_string": "Al1 Rh1\n1.0\n3.003937 -0.000000 -0.000000\n-0.000000 3.003937 0.000000\n0.000000 0.000000 3.003937\nAl Rh\n1 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.500001 0.500001 0.500001 Rh\n",
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{
"id": "jvasp-22742",
"created_at": "2022-09-04T14:37:30.636093Z",
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"structure_string": "Al12 Re2\n1.0\n5.068797 0.002847 0.000000\n-0.704718 5.019570 -0.000000\n-0.000000 -0.000000 9.112579\nAl Re\n12 2\ndirect\n0.324484 0.675516 0.000000 Al\n0.675516 0.324485 0.500000 Al\n0.675516 0.324485 0.000000 Al\n0.324484 0.675516 0.500000 Al\n0.128725 0.128725 0.601480 Al\n0.871275 0.871276 0.101480 Al\n0.128725 0.128725 0.898520 Al\n0.871275 0.871276 0.398520 Al\n0.390830 0.031069 0.250000 Al\n0.609170 0.968932 0.750000 Al\n0.031069 0.390830 0.250000 Al\n0.968932 0.609171 0.750000 Al\n0.546436 0.546436 0.250000 Re\n0.453564 0.453564 0.750000 Re\n",
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{
"id": "jvasp-20179",
"created_at": "2022-09-04T14:37:56.891185Z",
"updated_at": "2022-09-04T14:37:56.891210Z",
"structure_string": "Al12 Re1\n1.0\n6.184212 -0.000000 -2.186450\n-3.092107 5.355685 -2.186450\n-0.000000 -0.000000 6.559348\nAl Re\n12 1\ndirect\n0.496713 0.307465 0.189247 Al\n0.307464 0.810752 0.118218 Al\n0.189246 0.881781 0.692534 Al\n0.692534 0.810752 0.503286 Al\n0.810753 0.118218 0.307465 Al\n0.692534 0.189247 0.881782 Al\n0.810752 0.503286 0.692535 Al\n0.189246 0.496713 0.307465 Al\n0.307465 0.189247 0.496713 Al\n0.118218 0.307465 0.810753 Al\n0.881781 0.692534 0.189246 Al\n0.503286 0.692534 0.810753 Al\n0.000000 0.000000 0.000000 Re\n",
"nsites": 13,
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"elements": [
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"chemical_system": "Al-Re",
"density": 3.8980448086418797,
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"volume": 217.25014118982088,
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"formula_full": "Al12 Re1",
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"spacegroup": 204
},
{
"id": "jvasp-16382",
"created_at": "2022-09-04T14:38:31.505756Z",
"updated_at": "2022-09-04T14:38:31.505784Z",
"structure_string": "Al1 Re2\n1.0\n2.882848 -0.000000 -0.841931\n-0.245884 2.872343 -0.841931\n-0.018436 -0.020082 5.293407\nAl Re\n1 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.331434 0.331434 0.662867 Re\n0.668567 0.668566 0.337134 Re\n",
"nsites": 3,
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"elements": [
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"density_atomic": 0.06859538169717531,
"volume": 43.73472274334669,
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"formula_full": "Al1 Re2",
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"formula_anonymous": "AB2",
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"spacegroup": 139
},
{
"id": "jvasp-56361",
"created_at": "2022-09-04T14:38:36.282524Z",
"updated_at": "2022-09-04T14:38:36.282552Z",
"structure_string": "Al6 Pt4\n1.0\n2.054021 -3.557669 0.000000\n2.054021 3.557669 -0.000000\n0.000000 0.000000 11.345275\nAl Pt\n6 4\ndirect\n0.333333 0.666667 0.333587 Al\n0.666667 0.333333 0.666413 Al\n0.000000 0.000000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.000000 0.000000 0.776872 Al\n0.000000 0.000000 0.223128 Al\n0.333333 0.666667 0.589490 Pt\n0.333333 0.666667 0.106830 Pt\n0.666667 0.333333 0.410510 Pt\n0.666667 0.333333 0.893170 Pt\n",
"nsites": 10,
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"elements": [
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"chemical_system": "Al-Pt",
"density": 9.436009847410226,
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"volume": 165.81180307240223,
"volume_molar": 9.985420177714067,
"formula_full": "Al6 Pt4",
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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",
"nsites": 24,
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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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"spacegroup": 51
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{
"id": "jvasp-90852",
"created_at": "2022-09-04T14:36:13.994568Z",
"updated_at": "2022-09-04T14:36:13.994583Z",
"structure_string": "Al2 Pt6\n1.0\n-5.520064 0.000000 -0.000000\n0.000000 5.520064 0.000000\n2.760032 -2.760032 -3.984933\nAl Pt\n2 6\ndirect\n0.250000 0.749999 0.500000 Al\n0.749999 0.250000 0.500000 Al\n0.749999 0.749999 0.500000 Pt\n0.250000 0.250000 0.500000 Pt\n0.794071 0.705928 0.000000 Pt\n0.205928 0.294071 0.000000 Pt\n0.705928 0.205928 0.000000 Pt\n0.294071 0.794071 0.000000 Pt\n",
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"elements": [
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"volume": 121.42531809378275,
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"formula_full": "Al2 Pt6",
"formula_reduced": "AlPt3",
"formula_anonymous": "AB3",
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"spacegroup": 140
},
{
"id": "jvasp-16376",
"created_at": "2022-09-04T14:38:02.811836Z",
"updated_at": "2022-09-04T14:38:02.811866Z",
"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",
"nsites": 2,
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"formula_full": "Al1 Pt1",
"formula_reduced": "AlPt",
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"spacegroup": 221
},
{
"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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},
{
"id": "jvasp-91675",
"created_at": "2022-09-04T14:35:41.417407Z",
"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",
"nsites": 8,
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"formula_full": "Al2 Pt6",
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},
{
"id": "jvasp-19733",
"created_at": "2022-09-04T14:38:28.565162Z",
"updated_at": "2022-09-04T14:38:28.565196Z",
"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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"spacegroup": 225
},
{
"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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"formula_full": "Al6 Pt10",
"formula_reduced": "Al3Pt5",
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}