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{
"id": "jvasp-31166",
"created_at": "2022-09-04T14:37:42.461062Z",
"updated_at": "2022-09-04T14:37:42.461090Z",
"structure_string": "Sn1 P2 S6\n1.0\n7.375856 -0.021330 -0.013967\n4.898380 5.514487 -0.013967\n4.898380 2.192200 5.060042\nSn P S\n1 2 6\ndirect\n0.666265 0.666265 0.666263 Sn\n0.275888 0.275888 0.275887 P\n0.391500 0.391500 0.391499 P\n0.249794 0.570297 0.922434 S\n0.922436 0.249794 0.570295 S\n0.570297 0.922436 0.249792 S\n0.740767 0.425499 0.091591 S\n0.091592 0.740767 0.425498 S\n0.425499 0.091592 0.740766 S\n",
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"structure_string": "Lu1 As1\n1.0\n3.481851 -0.000000 2.010247\n1.160617 3.282721 2.010247\n0.000000 0.000000 4.020496\nLu As\n1 1\ndirect\n0.500000 0.500000 0.500001 Lu\n0.000000 0.000000 0.000000 As\n",
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{
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"density": 6.816541422755155,
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"volume": 551.4478726897099,
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"formula_full": "Dy6 Cu2 Si2 Se14",
"formula_reduced": "Dy3CuSiSe7",
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{
"id": "jvasp-17577",
"created_at": "2022-09-04T14:38:32.084213Z",
"updated_at": "2022-09-04T14:38:32.084242Z",
"structure_string": "Fe1 Ag2 Sn1 S4\n1.0\n5.058357 0.000000 -2.346807\n-1.088794 4.939788 -2.346807\n0.219066 0.272609 7.097025\nFe Ag Sn S\n1 2 1 4\ndirect\n0.000000 0.000000 0.000000 Fe\n0.750001 0.250000 0.500000 Ag\n0.250001 0.750000 0.500000 Ag\n0.500001 0.500000 -0.000000 Sn\n0.882898 0.882897 0.230682 S\n0.652216 0.117103 0.769319 S\n0.117104 0.652215 0.769319 S\n0.347786 0.347785 0.230682 S\n",
"nsites": 8,
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{
"id": "jvasp-29284",
"created_at": "2022-09-04T14:38:00.038551Z",
"updated_at": "2022-09-04T14:38:00.038577Z",
"structure_string": "Sn1 P2 S6\n1.0\n7.375764 -0.021281 -0.013935\n4.898355 5.514385 -0.013935\n4.898355 2.192189 5.059936\nSn P S\n1 2 6\ndirect\n0.666253 0.666254 0.666256 Sn\n0.275894 0.275895 0.275896 P\n0.391504 0.391505 0.391506 P\n0.249762 0.570309 0.922451 S\n0.922449 0.249762 0.570311 S\n0.570309 0.922450 0.249763 S\n0.740773 0.425501 0.091585 S\n0.091584 0.740774 0.425502 S\n0.425500 0.091584 0.740775 S\n",
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{
"id": "jvasp-104725",
"created_at": "2022-09-04T14:36:47.240175Z",
"updated_at": "2022-09-04T14:36:47.240204Z",
"structure_string": "Li1 Mg1 In2\n1.0\n4.386739 0.000000 2.532685\n1.462246 4.135857 2.532685\n0.000000 0.000000 5.065370\nLi Mg In\n1 1 2\ndirect\n0.500000 0.500000 0.499999 Li\n0.250000 0.250000 0.249999 Mg\n0.000000 0.000000 0.000000 In\n0.750001 0.750000 0.749998 In\n",
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"spacegroup": 216
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{
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"created_at": "2022-09-04T14:38:37.946057Z",
"updated_at": "2022-09-04T14:38:37.946084Z",
"structure_string": "La2 O3\n1.0\n6.348777 0.000539 -0.000020\n-3.175016 5.497787 0.000013\n-0.000098 0.000035 3.290795\nLa O\n2 3\ndirect\n0.333345 0.666668 0.500077 La\n0.666668 0.333344 0.499910 La\n0.499963 0.499964 0.000003 O\n0.000001 0.500042 0.000004 O\n0.500044 0.000003 0.000002 O\n",
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"spacegroup": 191
},
{
"id": "jvasp-118681",
"created_at": "2022-09-04T14:38:51.306497Z",
"updated_at": "2022-09-04T14:38:51.306517Z",
"structure_string": "Mg2 Cl2\n1.0\n3.392004 -0.565161 -0.415341\n-0.717355 -5.204728 1.221021\n-0.391445 1.589576 -5.364815\nMg Cl\n2 2\ndirect\n0.196184 0.891351 0.009377 Mg\n0.696037 0.639005 0.505954 Mg\n0.196092 0.446004 0.119189 Cl\n0.696088 0.084438 0.396033 Cl\n",
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},
{
"id": "jvasp-106101",
"created_at": "2022-09-04T14:36:12.304710Z",
"updated_at": "2022-09-04T14:36:12.304740Z",
"structure_string": "Co1 Cu2 Sn1 Se4\n1.0\n5.190697 0.008771 -4.655333\n-1.028645 5.087760 -4.655333\n-0.007163 -0.008771 6.972476\nCo Cu Sn Se\n1 2 1 4\ndirect\n0.500000 0.500000 0.000000 Co\n0.000000 0.000000 0.000000 Cu\n0.750001 0.250000 0.500001 Cu\n0.250000 0.750000 0.500001 Sn\n0.123036 0.157720 0.509931 Se\n0.842281 0.352210 0.965317 Se\n0.647790 0.613105 0.490071 Se\n0.386894 0.876964 0.034684 Se\n",
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{
"id": "jvasp-19596",
"created_at": "2022-09-04T14:37:41.132858Z",
"updated_at": "2022-09-04T14:37:41.132873Z",
"structure_string": "Th1 Au2\n1.0\n2.406342 -4.167908 0.000000\n2.406342 4.167908 0.000000\n0.000000 0.000000 3.435652\nTh Au\n1 2\ndirect\n0.000000 0.000000 0.000000 Th\n0.666667 0.333332 0.500000 Au\n0.333332 0.666667 0.500000 Au\n",
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{
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"structure_string": "Sb8 Ir4\n1.0\n0.000000 6.709150 -0.007532\n6.651956 0.000000 0.000000\n0.000000 -2.863545 -6.173406\nSb Ir\n8 4\ndirect\n0.149165 0.134859 0.877330 Sb\n0.850834 0.634859 0.622671 Sb\n0.850835 0.865142 0.122670 Sb\n0.149165 0.365141 0.377329 Sb\n0.344376 0.637367 0.176999 Sb\n0.655624 0.137367 0.323001 Sb\n0.655624 0.362634 0.823002 Sb\n0.344376 0.862634 0.676999 Sb\n0.270948 0.499066 0.789307 Ir\n0.729051 0.999066 0.710694 Ir\n0.729051 0.500935 0.210694 Ir\n0.270948 0.000935 0.289306 Ir\n",
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{
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"structure_string": "Nb1 Cu3 Se4\n1.0\n5.685356 0.000000 0.000000\n0.000000 5.685356 0.000000\n0.000000 0.000000 5.685356\nNb Cu Se\n1 3 4\ndirect\n0.000000 0.000000 0.000000 Nb\n0.500000 0.000000 0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.000000 0.500000 0.000000 Cu\n0.251626 0.251626 0.251626 Se\n0.748375 0.748375 0.251626 Se\n0.748375 0.251626 0.748375 Se\n0.251626 0.748375 0.748375 Se\n",
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}