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{
"id": "jvasp-101775",
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{
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{
"id": "jvasp-79363",
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"structure_string": "Zn2 Ni1 Ir1\n1.0\n-0.000000 2.976348 2.976348\n2.976348 -0.000000 2.976348\n2.976348 2.976348 0.000000\nZn Ni Ir\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Zn\n0.750000 0.750000 0.750000 Ni\n0.250000 0.250000 0.250000 Ir\n",
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"spacegroup": 225
},
{
"id": "jvasp-11532",
"created_at": "2022-09-04T14:36:48.151941Z",
"updated_at": "2022-09-04T14:36:48.151957Z",
"structure_string": "Zn4 Ni2 N4\n1.0\n3.557042 -0.001659 -0.001353\n-1.775922 5.667034 -0.009655\n-1.777499 -1.778300 6.179734\nZn Ni N\n4 2 4\ndirect\n0.149140 0.804037 0.492127 Zn\n0.852772 0.193996 0.509319 Zn\n0.299047 0.393566 0.202571 Zn\n0.702771 0.604486 0.798880 Zn\n0.494431 0.874129 0.112688 Ni\n0.507396 0.123925 0.888767 Ni\n0.554865 0.750855 0.356785 N\n0.447074 0.247214 0.644671 N\n0.294914 0.772374 0.815256 N\n0.706901 0.225674 0.186199 N\n",
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"volume": 124.47311372354577,
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"formula_full": "Zn4 Ni2 N4",
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"formula_anonymous": "AB2C2",
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"spacegroup": 12
},
{
"id": "jvasp-103668",
"created_at": "2022-09-04T14:36:42.429718Z",
"updated_at": "2022-09-04T14:36:42.429731Z",
"structure_string": "Zn2 Ni1 O3\n1.0\n3.900963 -0.004683 -3.492966\n-0.390117 2.872899 -4.360345\n-0.001459 0.004683 5.236251\nZn Ni O\n2 1 3\ndirect\n0.665645 0.665647 0.000000 Zn\n0.334354 0.334354 0.000000 Zn\n0.000000 0.000000 0.000000 Ni\n0.500000 0.000000 0.499999 O\n0.163075 0.663076 0.500000 O\n0.836923 0.336925 0.499999 O\n",
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},
{
"id": "jvasp-41045",
"created_at": "2022-09-04T14:37:35.913380Z",
"updated_at": "2022-09-04T14:37:35.913393Z",
"structure_string": "Zn2 Ni1 Rh1\n1.0\n-0.000000 2.960568 2.960568\n2.960568 0.000000 2.960568\n2.960568 2.960568 -0.000000\nZn Ni Rh\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Zn\n0.499999 0.499999 0.499999 Zn\n0.250000 0.250000 0.250000 Ni\n0.750002 0.750002 0.750002 Rh\n",
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"spacegroup": 225
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{
"id": "jvasp-21321",
"created_at": "2022-09-04T14:36:51.920933Z",
"updated_at": "2022-09-04T14:36:51.920959Z",
"structure_string": "Zn4 Ni2 W2 O12\n1.0\n0.000000 5.171336 0.005980\n5.201082 0.000000 0.000000\n0.000000 -5.036947 -7.692705\nZn Ni W O\n4 2 2 12\ndirect\n0.260552 0.965373 0.253543 Zn\n0.739448 0.465374 0.246457 Zn\n0.739448 0.034626 0.746456 Zn\n0.260551 0.534626 0.753543 Zn\n0.500000 0.000000 -0.000000 Ni\n0.500000 0.500000 0.500000 Ni\n-0.000001 0.000000 0.500000 W\n0.000000 0.500000 0.000000 W\n0.643187 0.079729 0.261293 O\n0.356813 0.579729 0.238707 O\n0.737987 0.673989 0.057131 O\n0.262013 0.173990 0.442869 O\n0.262013 0.326010 0.942868 O\n0.913045 0.185497 0.075111 O\n0.086954 0.814502 0.924888 O\n0.913045 0.314503 0.575111 O\n0.356812 0.920271 0.738706 O\n0.086955 0.685497 0.424888 O\n0.737986 0.826010 0.557131 O\n0.643187 0.420271 0.761293 O\n",
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"W",
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],
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"density_atomic": 0.09673495061173781,
"volume": 206.75050613581644,
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"formula_full": "Zn4 Ni2 W2 O12",
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"formula_anonymous": "ABC2D6",
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"spacegroup": 14
},
{
"id": "jvasp-34264",
"created_at": "2022-09-04T14:37:09.214811Z",
"updated_at": "2022-09-04T14:37:09.214831Z",
"structure_string": "Zn2 P2 O7\n1.0\n4.482865 0.021696 -0.735628\n-1.077300 5.073976 -1.195933\n0.017080 -0.007463 5.323128\nZn P O\n2 2 7\ndirect\n0.500002 0.691198 0.308801 Zn\n0.500000 0.308803 0.691199 Zn\n0.092231 0.784575 0.784574 P\n0.907771 0.215427 0.215426 P\n0.276708 0.930400 0.624844 O\n0.723294 0.375158 0.069602 O\n0.723294 0.069602 0.375157 O\n0.276708 0.624843 0.930399 O\n0.213600 0.381529 0.381529 O\n-0.000000 0.000000 0.000001 O\n0.786402 0.618472 0.618472 O\n",
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"volume": 121.2214021386689,
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{
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"created_at": "2022-09-04T14:36:38.894944Z",
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"structure_string": "Zn2 Pd1 Au1\n1.0\n0.000000 3.125584 3.125584\n3.125584 0.000000 3.125584\n3.125584 3.125584 0.000000\nZn Pd Au\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Zn\n0.499998 0.499998 0.499998 Zn\n0.749999 0.749999 0.749999 Pd\n0.250001 0.250001 0.250001 Au\n",
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},
{
"id": "jvasp-59756",
"created_at": "2022-09-04T14:38:34.321188Z",
"updated_at": "2022-09-04T14:38:34.321220Z",
"structure_string": "Zn4 Pd2 O8\n1.0\n5.294693 0.000000 3.056893\n1.764897 4.991885 3.056893\n0.000000 -0.000000 6.113786\nZn Pd O\n4 2 8\ndirect\n0.500000 0.500000 0.500000 Zn\n0.500000 0.500000 -0.000000 Zn\n0.500000 -0.000000 0.500000 Zn\n0.000000 0.500000 0.500000 Zn\n0.875000 0.874999 0.875000 Pd\n0.125000 0.125000 0.125000 Pd\n0.740836 0.740835 0.740835 O\n0.259165 0.259164 0.722505 O\n0.259165 0.722504 0.259164 O\n0.722505 0.259164 0.259165 O\n0.740835 0.277495 0.740836 O\n0.277495 0.740835 0.740836 O\n0.259165 0.259164 0.259165 O\n0.740836 0.740835 0.277495 O\n",
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},
{
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"structure_string": "Zn2 Pd1 Pt1\n1.0\n0.000000 3.075551 3.075551\n3.075551 -0.000000 3.075551\n3.075551 3.075551 0.000000\nZn Pd Pt\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Zn\n0.250000 0.250000 0.250000 Pd\n0.750000 0.750000 0.750000 Pt\n",
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{
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"structure_string": "Zn2 Pd1 Rh1\n1.0\n0.000000 3.039728 3.039728\n3.039728 0.000000 3.039728\n3.039728 3.039728 -0.000000\nZn Pd Rh\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500001 0.500001 0.500001 Zn\n0.250000 0.250000 0.250000 Pd\n0.750000 0.750000 0.750000 Rh\n",
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}
]
}