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{
"id": "jvasp-16791",
"created_at": "2022-09-04T14:38:29.364236Z",
"updated_at": "2022-09-04T14:38:29.364266Z",
"structure_string": "Pr2 Pt2\n1.0\n3.713917 0.000000 -1.325888\n0.000000 4.578017 0.000000\n-0.006130 -0.000000 5.847260\nPr Pt\n2 2\ndirect\n0.136738 0.750001 0.273475 Pr\n0.863263 0.250000 0.726525 Pr\n0.410148 0.750001 0.820295 Pt\n0.589853 0.250000 0.179705 Pt\n",
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{
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"structure_string": "Pr4 Pt4\n1.0\n0.000000 4.621493 0.000000\n0.000000 0.000000 5.782564\n7.421677 0.000000 0.000000\nPr Pt\n4 4\ndirect\n0.250000 0.358248 0.683276 Pr\n0.250000 0.141752 0.183275 Pr\n0.750000 0.641752 0.316725 Pr\n0.750000 0.858247 0.816725 Pr\n0.250000 0.843237 0.545202 Pt\n0.250000 0.656762 0.045202 Pt\n0.750000 0.156763 0.454799 Pt\n0.750000 0.343237 0.954799 Pt\n",
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{
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"structure_string": "Pr1 Pt5\n1.0\n2.716711 -4.705481 -0.000000\n2.716711 4.705481 -0.000000\n0.000000 0.000000 4.441626\nPr Pt\n1 5\ndirect\n0.000000 0.000000 0.000000 Pr\n0.333333 0.666667 0.000000 Pt\n0.666667 0.333333 0.000000 Pt\n-0.000000 0.500000 0.500000 Pt\n0.500000 0.500000 0.500000 Pt\n0.500000 -0.000000 0.500000 Pt\n",
"nsites": 6,
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"elements": [
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"volume": 113.5584478186013,
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"formula_full": "Pr1 Pt5",
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"spacegroup": 191
},
{
"id": "jvasp-16787",
"created_at": "2022-09-04T14:38:07.342464Z",
"updated_at": "2022-09-04T14:38:07.342490Z",
"structure_string": "Pr1 Pt3\n1.0\n4.226731 -0.000000 -0.000000\n0.000000 4.226731 -0.000000\n0.000000 -0.000000 4.226731\nPr Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Pr\n0.000000 0.500000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n",
"nsites": 4,
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"elements": [
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"density": 15.968619891286327,
"density_atomic": 0.05297197483307965,
"volume": 75.51162690468738,
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"formula_full": "Pr1 Pt3",
"formula_reduced": "PrPt3",
"formula_anonymous": "AB3",
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"spacegroup": 221
},
{
"id": "jvasp-20062",
"created_at": "2022-09-04T14:35:55.733404Z",
"updated_at": "2022-09-04T14:35:55.733413Z",
"structure_string": "Pr2 Pt4\n1.0\n4.796284 -0.000000 2.769136\n1.598761 4.521980 2.769136\n0.000000 -0.000000 5.538273\nPr Pt\n2 4\ndirect\n0.874999 0.875000 0.875001 Pr\n0.125000 0.125000 0.125000 Pr\n0.499999 0.500000 0.500001 Pt\n0.499999 0.500000 0.000001 Pt\n-0.000000 0.500000 0.500000 Pt\n0.500000 0.000000 0.500000 Pt\n",
"nsites": 6,
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"elements": [
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"density": 14.683432619335841,
"density_atomic": 0.049950905170011446,
"volume": 120.11794340019615,
"volume_molar": 12.05611938262824,
"formula_full": "Pr2 Pt4",
"formula_reduced": "PrPt2",
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"spacegroup": 227
},
{
"id": "jvasp-119565",
"created_at": "2022-09-04T14:38:51.628598Z",
"updated_at": "2022-09-04T14:38:51.628625Z",
"structure_string": "Yb1 P4 Rh6\n1.0\n7.028132 0.000000 0.000000\n-3.514066 6.086541 0.000000\n-0.000000 -0.000000 3.704204\nYb P Rh\n1 4 6\ndirect\n0.000000 0.000000 0.499999 Yb\n0.666666 0.333333 0.499999 P\n0.193755 0.372536 -0.000000 P\n0.178781 0.806244 -0.000000 P\n0.627463 0.821219 -0.000000 P\n0.487307 0.932210 0.499999 Rh\n0.444901 0.512692 0.499999 Rh\n0.067790 0.555098 0.499999 Rh\n0.789976 0.605144 -0.000000 Rh\n0.815167 0.210024 -0.000000 Rh\n0.394856 0.184833 -0.000000 Rh\n",
"nsites": 11,
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"elements": [
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],
"chemical_system": "P-Rh-Yb",
"density": 9.582190068099099,
"density_atomic": 0.0694204344496291,
"volume": 158.45478477927864,
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"formula_full": "Yb1 P4 Rh6",
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"formula_anonymous": "AB4C6",
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},
{
"id": "jvasp-16069",
"created_at": "2022-09-04T14:36:46.432863Z",
"updated_at": "2022-09-04T14:36:46.432882Z",
"structure_string": "Sr1 P2 Rh2\n1.0\n3.783005 0.000000 -1.205288\n-0.384013 3.763465 -1.205288\n0.002907 0.003219 6.548576\nSr P Rh\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.640229 0.640229 0.280458 P\n0.359770 0.359770 0.719542 P\n0.750000 0.250000 0.500000 Rh\n0.250000 0.749999 0.500000 Rh\n",
"nsites": 5,
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"elements": [
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"P",
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],
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"density": 6.327496244771871,
"density_atomic": 0.05361195244532548,
"volume": 93.2627851055993,
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"formula_full": "Sr1 P2 Rh2",
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"formula_anonymous": "AB2C2",
"energy_above_hull": 2.190756661999999,
"spacegroup": 139
},
{
"id": "jvasp-106000",
"created_at": "2022-09-04T14:35:50.794599Z",
"updated_at": "2022-09-04T14:35:50.794635Z",
"structure_string": "Si3 P3 Rh1\n1.0\n4.692116 0.003614 -1.545030\n-0.978886 4.589920 -1.605013\n-0.006214 -0.005739 5.567102\nSi P Rh\n3 3 1\ndirect\n0.586442 0.602270 0.364770 Si\n0.403424 0.409494 0.632812 Si\n0.712258 0.159180 0.158966 Si\n0.839540 0.291756 0.844478 P\n0.150928 0.708918 0.148057 P\n0.292285 0.839911 0.851753 P\n0.000725 0.002867 0.499164 Rh\n",
"nsites": 7,
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"elements": [
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"density": 3.881588481498028,
"density_atomic": 0.05842130312352051,
"volume": 119.8193060705931,
"volume_molar": 10.308124670323345,
"formula_full": "Si3 P3 Rh1",
"formula_reduced": "Si3P3Rh",
"formula_anonymous": "AB3C3",
"energy_above_hull": 3.411600757142857,
"spacegroup": 1
},
{
"id": "jvasp-105326",
"created_at": "2022-09-04T14:36:57.258406Z",
"updated_at": "2022-09-04T14:36:57.258442Z",
"structure_string": "Si2 P4 Rh1\n1.0\n4.676137 0.007574 1.568001\n-1.125470 4.538682 1.568001\n0.006551 0.008388 5.624445\nSi P Rh\n2 4 1\ndirect\n0.589130 0.589129 0.136247 Si\n0.410871 0.410870 0.863752 Si\n0.161121 0.710145 0.345076 P\n0.289854 0.838879 0.654923 P\n0.710146 0.161120 0.345076 P\n0.838879 0.289854 0.654923 P\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 7,
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"elements": [
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],
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"density": 3.938835230421213,
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"volume": 119.29549795867655,
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"formula_full": "Si2 P4 Rh1",
"formula_reduced": "Si2P4Rh",
"formula_anonymous": "AB2C4",
"energy_above_hull": 3.3959617428571427,
"spacegroup": 12
},
{
"id": "jvasp-15035",
"created_at": "2022-09-04T14:36:47.564134Z",
"updated_at": "2022-09-04T14:36:47.564161Z",
"structure_string": "P1 Rh2\n1.0\n3.405085 -0.000000 1.965926\n1.135029 3.210345 1.965926\n0.000000 0.000000 3.931853\nP Rh\n1 2\ndirect\n0.000000 0.000000 0.000000 P\n0.250001 0.250000 0.250000 Rh\n0.750002 0.749999 0.750001 Rh\n",
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"formula_full": "P1 Rh2",
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"spacegroup": 225
},
{
"id": "jvasp-18483",
"created_at": "2022-09-04T14:36:42.310838Z",
"updated_at": "2022-09-04T14:36:42.310860Z",
"structure_string": "P2 Rh3\n1.0\n3.378575 0.000000 0.000000\n0.000000 3.378575 0.000000\n0.000000 -0.000000 6.255355\nP Rh\n2 3\ndirect\n0.000000 0.500001 0.255278 P\n0.500001 0.000000 0.744722 P\n0.000000 0.000000 0.000000 Rh\n0.000000 0.500001 0.631631 Rh\n0.500001 0.000000 0.368370 Rh\n",
"nsites": 5,
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"formula_anonymous": "A2B3",
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"spacegroup": 115
},
{
"id": "jvasp-11413",
"created_at": "2022-09-04T14:36:42.577782Z",
"updated_at": "2022-09-04T14:36:42.577811Z",
"structure_string": "P8 Rh4\n1.0\n0.000000 5.813192 0.001639\n5.856811 0.000000 0.000000\n0.000000 -2.253577 -5.458296\nP Rh\n8 4\ndirect\n0.840001 0.120487 0.133559 P\n0.159998 0.620487 0.366441 P\n0.159998 0.879512 0.866441 P\n0.840001 0.379512 0.633560 P\n0.665800 0.622940 0.813253 P\n0.334199 0.122940 0.686748 P\n0.334199 0.377059 0.186748 P\n0.665800 0.877059 0.313252 P\n0.728188 0.501385 0.210767 Rh\n0.271812 0.001385 0.289233 Rh\n0.271812 0.498615 0.789233 Rh\n0.728187 0.998615 0.710768 Rh\n",
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