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{
"id": "jvasp-37168",
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{
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{
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{
"id": "jvasp-30932",
"created_at": "2022-09-04T14:36:42.490268Z",
"updated_at": "2022-09-04T14:36:42.490286Z",
"structure_string": "Ti4 Zn8\n1.0\n2.539919 -4.399270 -0.000000\n2.539919 4.399270 0.000000\n0.000000 -0.000000 8.126123\nTi Zn\n4 8\ndirect\n0.333333 0.666667 0.931790 Ti\n0.666667 0.333333 0.431790 Ti\n0.666667 0.333333 0.068209 Ti\n0.333333 0.666667 0.568209 Ti\n0.000000 0.000000 0.000000 Zn\n0.000000 0.000000 0.500000 Zn\n0.344506 0.172254 0.750000 Zn\n0.172254 0.827747 0.250000 Zn\n0.172254 0.344506 0.250000 Zn\n0.827747 0.655494 0.750000 Zn\n0.827747 0.172254 0.750000 Zn\n0.655494 0.827747 0.250000 Zn\n",
"nsites": 12,
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"elements": [
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"density_atomic": 0.0660795953353063,
"volume": 181.59917504198765,
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"formula_full": "Ti4 Zn8",
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"spacegroup": 194
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{
"id": "jvasp-36527",
"created_at": "2022-09-04T14:37:39.961195Z",
"updated_at": "2022-09-04T14:37:39.961221Z",
"structure_string": "Ti1 Zn1\n1.0\n3.139769 0.000000 -0.000000\n0.000000 3.139769 0.000000\n-0.000000 -0.000000 3.139769\nTi Zn\n1 1\ndirect\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Zn\n",
"nsites": 2,
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"elements": [
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"density": 6.077065407085477,
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"volume": 30.952311799848285,
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"spacegroup": 221
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{
"id": "jvasp-100760",
"created_at": "2022-09-04T14:36:40.481483Z",
"updated_at": "2022-09-04T14:36:40.481499Z",
"structure_string": "Ti3 Zn1\n1.0\n3.625680 0.019230 -3.447398\n-0.654430 3.566181 -3.447398\n-0.015936 -0.019230 5.002985\nTi Zn\n3 1\ndirect\n0.749999 0.250000 0.499999 Ti\n0.249999 0.750000 0.499999 Ti\n0.500000 0.500000 -0.000000 Ti\n0.000000 0.000000 0.000000 Zn\n",
"nsites": 4,
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{
"id": "jvasp-18033",
"created_at": "2022-09-04T14:38:08.988252Z",
"updated_at": "2022-09-04T14:38:08.988263Z",
"structure_string": "Ti1 Zn3\n1.0\n3.921483 0.000000 -0.000000\n0.000000 3.921483 0.000000\n0.000000 0.000000 3.921483\nTi Zn\n1 3\ndirect\n0.000000 0.000000 0.000000 Ti\n0.000000 0.500000 0.500000 Zn\n0.500000 0.500000 0.000000 Zn\n0.500000 0.000000 0.500000 Zn\n",
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"elements": [
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"volume": 60.30467898050018,
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"spacegroup": 221
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{
"id": "jvasp-36526",
"created_at": "2022-09-04T14:37:39.167227Z",
"updated_at": "2022-09-04T14:37:39.167257Z",
"structure_string": "Ti2 Zn1\n1.0\n2.832295 0.000000 0.000000\n0.000000 2.832294 0.000000\n-1.416146 -1.416146 6.017291\nTi Zn\n2 1\ndirect\n0.665371 0.665372 0.330747 Ti\n0.334626 0.334626 0.669253 Ti\n0.000000 0.000000 0.000000 Zn\n",
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"elements": [
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"density": 5.5434828636745825,
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"spacegroup": 139
},
{
"id": "jvasp-40063",
"created_at": "2022-09-04T14:37:59.337388Z",
"updated_at": "2022-09-04T14:37:59.337409Z",
"structure_string": "Ti3 Zn1\n1.0\n4.001980 0.000000 -0.000000\n0.000000 4.001980 0.000000\n0.000000 0.000000 4.001980\nTi Zn\n3 1\ndirect\n0.000000 0.500000 0.500000 Ti\n0.500000 0.000000 0.500000 Ti\n0.500000 0.500000 0.000000 Ti\n0.000000 0.000000 0.000000 Zn\n",
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"formula_full": "Ti3 Zn1",
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"spacegroup": 221
},
{
"id": "jvasp-109347",
"created_at": "2022-09-04T14:38:16.547213Z",
"updated_at": "2022-09-04T14:38:16.547235Z",
"structure_string": "Zr1 Ti1\n1.0\n3.091707 0.000000 0.000000\n-1.545854 2.677497 0.000000\n-0.000000 -0.000000 4.880881\nZr Ti\n1 1\ndirect\n0.000000 0.000000 0.000000 Zr\n0.333335 0.666668 0.500000 Ti\n",
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"volume": 40.40410969071702,
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"formula_full": "Zr1 Ti1",
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"spacegroup": 187
},
{
"id": "jvasp-36206",
"created_at": "2022-09-04T14:37:29.373928Z",
"updated_at": "2022-09-04T14:37:29.373950Z",
"structure_string": "Zr1 Ti2\n1.0\n2.345643 -4.062772 -0.000000\n2.345643 4.062772 -0.000000\n-0.000000 0.000000 3.010710\nZr Ti\n1 2\ndirect\n0.000000 0.000000 0.000000 Zr\n0.666666 0.333333 0.500000 Ti\n0.333333 0.666666 0.500000 Ti\n",
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"spacegroup": 191
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{
"id": "jvasp-104549",
"created_at": "2022-09-04T14:36:51.860383Z",
"updated_at": "2022-09-04T14:36:51.860418Z",
"structure_string": "Zr2 Ti6\n1.0\n6.024650 0.000000 0.000000\n-3.012325 5.217500 0.000000\n-0.000000 -0.000000 4.734119\nZr Ti\n2 6\ndirect\n0.333333 0.666667 0.750000 Zr\n0.666666 0.333333 0.250000 Zr\n0.159965 0.319931 0.250000 Ti\n0.680069 0.840035 0.250000 Ti\n0.159965 0.840035 0.250000 Ti\n0.840034 0.680070 0.750000 Ti\n0.319930 0.159965 0.750000 Ti\n0.840035 0.159965 0.750000 Ti\n",
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