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{
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{
"id": "jvasp-20808",
"created_at": "2022-09-04T14:38:34.626229Z",
"updated_at": "2022-09-04T14:38:34.626247Z",
"structure_string": "Al4 Pd8\n1.0\n4.100289 0.000000 0.000000\n0.000000 5.489718 0.000000\n0.000000 0.000000 7.856624\nAl Pd\n4 8\ndirect\n0.750000 0.301414 0.605499 Al\n0.250000 0.698587 0.394501 Al\n0.750000 0.801414 0.894500 Al\n0.250000 0.198587 0.105499 Al\n0.750000 0.959124 0.210020 Pd\n0.250000 0.040877 0.789980 Pd\n0.750000 0.459124 0.289980 Pd\n0.250000 0.540877 0.710019 Pd\n0.750000 0.835061 0.566770 Pd\n0.250000 0.164939 0.433230 Pd\n0.750000 0.335061 0.933229 Pd\n0.250000 0.664939 0.066770 Pd\n",
"nsites": 12,
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{
"id": "jvasp-19854",
"created_at": "2022-09-04T14:37:00.273278Z",
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"structure_string": "Al1 Pd1\n1.0\n3.078511 0.000000 0.000000\n0.000000 3.078511 -0.000000\n0.000000 0.000000 3.078511\nAl Pd\n1 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Pd\n",
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{
"id": "jvasp-17427",
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"updated_at": "2022-09-04T14:38:32.879579Z",
"structure_string": "Al2 Pd1\n1.0\n3.643069 0.000000 2.103326\n1.214357 3.434718 2.103326\n-0.000000 -0.000000 4.206654\nAl Pd\n2 1\ndirect\n0.250000 0.250000 0.250000 Al\n0.750001 0.750000 0.750000 Al\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 3,
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"elements": [
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"formula_full": "Al2 Pd1",
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"spacegroup": 225
},
{
"id": "jvasp-16374",
"created_at": "2022-09-04T14:37:55.807801Z",
"updated_at": "2022-09-04T14:37:55.807815Z",
"structure_string": "Al3 Pd2\n1.0\n2.123885 -3.678677 0.000000\n2.123885 3.678677 -0.000000\n0.000000 -0.000000 5.215198\nAl Pd\n3 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.666668 0.333334 0.354235 Al\n0.333334 0.666668 0.645765 Al\n0.666668 0.333334 0.840111 Pd\n0.333334 0.666668 0.159890 Pd\n",
"nsites": 5,
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"elements": [
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"Pd"
],
"chemical_system": "Al-Pd",
"density": 5.986247870553361,
"density_atomic": 0.061354518539055374,
"volume": 81.4935903509248,
"volume_molar": 9.815317442620941,
"formula_full": "Al3 Pd2",
"formula_reduced": "Al3Pd2",
"formula_anonymous": "A2B3",
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"spacegroup": 164
},
{
"id": "jvasp-105113",
"created_at": "2022-09-04T14:36:41.115052Z",
"updated_at": "2022-09-04T14:36:41.115073Z",
"structure_string": "Al3 Pd1\n1.0\n3.963060 -0.000000 0.000000\n0.000000 3.963060 0.000000\n-0.000000 -0.000000 3.963060\nAl Pd\n3 1\ndirect\n-0.000000 0.500000 0.500000 Al\n0.500000 0.000000 0.500000 Al\n0.500000 0.500000 -0.000000 Al\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 4,
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"elements": [
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"chemical_system": "Al-Pd",
"density": 4.998557954275783,
"density_atomic": 0.06426404362326564,
"volume": 62.243204356220616,
"volume_molar": 9.370933449665143,
"formula_full": "Al3 Pd1",
"formula_reduced": "Al3Pd",
"formula_anonymous": "AB3",
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"spacegroup": 221
},
{
"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",
"nsites": 16,
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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",
"formula_reduced": "Al3Pt5",
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"spacegroup": 55
},
{
"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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"elements": [
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"volume": 29.624787995536877,
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"formula_full": "Al1 Pt1",
"formula_reduced": "AlPt",
"formula_anonymous": "AB",
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"spacegroup": 221
},
{
"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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"Pt"
],
"chemical_system": "Al-Pt",
"density": 15.348397791995641,
"density_atomic": 0.0664727178790744,
"volume": 361.0503792497282,
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"formula_full": "Al8 Pt16",
"formula_reduced": "AlPt2",
"formula_anonymous": "AB2",
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"spacegroup": 51
},
{
"id": "jvasp-16377",
"created_at": "2022-09-04T14:37:57.674751Z",
"updated_at": "2022-09-04T14:37:57.674765Z",
"structure_string": "Al4 Pt4\n1.0\n4.923696 0.000000 -0.000000\n-0.000000 4.923696 0.000000\n-0.000000 -0.000000 4.923696\nAl Pt\n4 4\ndirect\n0.843317 0.843317 0.843317 Al\n0.656684 0.156684 0.343316 Al\n0.343316 0.656684 0.156684 Al\n0.156684 0.343316 0.656684 Al\n0.158096 0.158096 0.158096 Pt\n0.341905 0.841905 0.658096 Pt\n0.658096 0.341905 0.841905 Pt\n0.841905 0.658096 0.341905 Pt\n",
"nsites": 8,
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"elements": [
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],
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"density": 12.357100077419584,
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"volume": 119.36409024142903,
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"formula_full": "Al4 Pt4",
"formula_reduced": "AlPt",
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"spacegroup": 198
},
{
"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",
"nsites": 3,
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"elements": [
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{
"id": "jvasp-7864",
"created_at": "2022-09-04T14:36:41.787258Z",
"updated_at": "2022-09-04T14:36:41.787274Z",
"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-98460",
"created_at": "2022-09-04T14:36:11.917019Z",
"updated_at": "2022-09-04T14:36:11.917048Z",
"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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