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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",
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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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{
"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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"volume": 48.27005934528161,
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"formula_reduced": "Ti2Zn",
"formula_anonymous": "AB2",
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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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"elements": [
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"density": 5.414912222920383,
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"volume": 64.09508705256238,
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"formula_full": "Ti3 Zn1",
"formula_reduced": "Ti3Zn",
"formula_anonymous": "AB3",
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"spacegroup": 221
},
{
"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",
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"elements": [
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"chemical_system": "Ti-Zn",
"density": 6.077065407085477,
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"volume": 30.952311799848285,
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"formula_full": "Ti1 Zn1",
"formula_reduced": "TiZn",
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"spacegroup": 221
},
{
"id": "jvasp-37480",
"created_at": "2022-09-04T14:38:04.613331Z",
"updated_at": "2022-09-04T14:38:04.613357Z",
"structure_string": "Yb3 Ti1\n1.0\n-2.479923 2.479923 4.909199\n2.479923 -2.479923 4.909199\n2.479923 2.479923 -4.909199\nYb Ti\n3 1\ndirect\n0.749997 0.250000 0.499998 Yb\n0.250000 0.749997 0.499998 Yb\n0.500000 0.500000 0.000000 Yb\n0.000000 0.000000 0.000000 Ti\n",
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"density": 7.796060083382735,
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"volume": 120.76665054969824,
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"formula_full": "Yb3 Ti1",
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"spacegroup": 139
},
{
"id": "jvasp-37487",
"created_at": "2022-09-04T14:38:09.553731Z",
"updated_at": "2022-09-04T14:38:09.553752Z",
"structure_string": "Yb3 Ti1\n1.0\n4.951627 0.000000 -0.000000\n0.000000 4.951627 0.000000\n-0.000000 0.000000 4.951627\nYb Ti\n3 1\ndirect\n0.000000 0.500000 0.500000 Yb\n0.500000 0.000000 0.500000 Yb\n0.500000 0.500000 0.000000 Yb\n0.000000 0.000000 0.000000 Ti\n",
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"volume": 121.40701101667254,
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"formula_anonymous": "AB3",
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"spacegroup": 221
},
{
"id": "jvasp-37168",
"created_at": "2022-09-04T14:35:43.798004Z",
"updated_at": "2022-09-04T14:35:43.798029Z",
"structure_string": "Y1 Ti1\n1.0\n3.635023 -0.000000 0.000000\n-0.000000 3.635023 0.000000\n0.000000 -0.000000 3.635023\nY Ti\n1 1\ndirect\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500000 Ti\n",
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"density_atomic": 0.04163978766904659,
"volume": 48.03098459329375,
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"spacegroup": 221
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{
"id": "jvasp-105971",
"created_at": "2022-09-04T14:36:09.410036Z",
"updated_at": "2022-09-04T14:36:09.410064Z",
"structure_string": "Ti1 W1\n1.0\n2.776868 0.002428 0.000000\n-0.969745 2.602037 0.000000\n0.000000 0.000000 4.443702\nTi W\n1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500001 0.500000 W\n",
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"volume": 32.11849069180669,
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"formula_reduced": "TiW",
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"spacegroup": 65
},
{
"id": "jvasp-51159",
"created_at": "2022-09-04T14:36:49.591202Z",
"updated_at": "2022-09-04T14:36:49.591223Z",
"structure_string": "Ti1 V1 W1\n1.0\n0.000000 2.975965 2.975965\n2.975965 -0.000000 2.975965\n2.975965 2.975965 0.000000\nTi V W\n1 1 1\ndirect\n0.250000 0.250000 0.250000 Ti\n0.000000 0.000000 0.000000 V\n0.500001 0.500001 0.500001 W\n",
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"volume": 52.712480492913514,
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"formula_full": "Ti1 V1 W1",
"formula_reduced": "TiVW",
"formula_anonymous": "ABC",
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"spacegroup": 216
},
{
"id": "jvasp-122998",
"created_at": "2022-09-04T14:38:55.378304Z",
"updated_at": "2022-09-04T14:38:55.378338Z",
"structure_string": "Ti1 V1\n1.0\n3.106985 -0.000000 0.000000\n0.000000 3.106985 0.000000\n-0.000000 -0.000000 3.106985\nTi V\n1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500001 0.500001 0.500001 V\n",
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"energy_above_hull": null,
"spacegroup": 221
},
{
"id": "jvasp-109355",
"created_at": "2022-09-04T14:38:19.137269Z",
"updated_at": "2022-09-04T14:38:19.137295Z",
"structure_string": "Ti4 V1\n1.0\n11.463961 -0.022498 1.886033\n11.169903 2.545830 0.885217\n0.007697 -0.067229 2.771251\nTi V\n4 1\ndirect\n0.408464 0.408463 0.591536 Ti\n0.801372 0.801371 0.198628 Ti\n0.198629 0.198628 0.801371 Ti\n0.591537 0.591536 0.408463 Ti\n0.000000 0.000000 0.000000 V\n",
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"formula_full": "Ti4 V1",
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"formula_anonymous": "AB4",
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}