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"id": "jvasp-115461",
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{
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{
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{
"id": "jvasp-49963",
"created_at": "2022-09-04T14:35:45.627759Z",
"updated_at": "2022-09-04T14:35:45.627784Z",
"structure_string": "Sr4 Ca4 I16\n1.0\n7.052338 -0.000000 0.000000\n-0.000000 7.881294 0.000000\n0.000000 0.000000 18.548973\nSr Ca I\n4 4 16\ndirect\n0.000000 0.750000 0.066920 Sr\n0.000000 0.250000 0.933080 Sr\n0.500000 0.250000 0.433080 Sr\n0.500000 0.750000 0.566920 Sr\n0.000000 0.750000 0.314156 Ca\n0.000000 0.250000 0.685844 Ca\n0.500000 0.750000 0.814156 Ca\n0.500000 0.250000 0.185844 Ca\n0.257219 0.086992 0.805094 I\n0.257219 0.586992 0.194906 I\n0.242781 0.086992 0.305094 I\n0.242781 0.586992 0.694906 I\n0.237416 0.088291 0.561356 I\n0.237416 0.588290 0.438644 I\n0.762584 0.411709 0.561356 I\n0.742782 0.413007 0.805094 I\n0.757219 0.913007 0.694906 I\n0.757219 0.413007 0.305094 I\n0.262584 0.088291 0.061356 I\n0.742782 0.913007 0.194906 I\n0.737417 0.911709 0.938644 I\n0.737417 0.411709 0.061356 I\n0.762584 0.911709 0.438644 I\n0.262584 0.588290 0.938644 I\n",
"nsites": 24,
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"elements": [
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{
"id": "jvasp-64152",
"created_at": "2022-09-04T14:36:05.109872Z",
"updated_at": "2022-09-04T14:36:05.109895Z",
"structure_string": "Ba4 Be1 Cl1\n1.0\n-0.000000 5.051312 5.051312\n5.051312 -0.000000 5.051312\n5.051312 5.051312 0.000000\nBa Be Cl\n4 1 1\ndirect\n0.124999 0.625000 0.625000 Ba\n0.625000 0.625000 0.625000 Ba\n0.625000 0.124999 0.625000 Ba\n0.625000 0.625000 0.124999 Ba\n0.250000 0.250000 0.250000 Be\n0.000000 0.000000 0.000000 Cl\n",
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{
"id": "jvasp-66040",
"created_at": "2022-09-04T14:35:54.230788Z",
"updated_at": "2022-09-04T14:35:54.230812Z",
"structure_string": "Ba1 Li1 Br1\n1.0\n0.000000 4.009272 4.009272\n4.009272 0.000000 4.009272\n4.009272 4.009272 -0.000000\nBa Li Br\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Br\n",
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{
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"created_at": "2022-09-04T14:35:54.214745Z",
"updated_at": "2022-09-04T14:35:54.214770Z",
"structure_string": "Ba4 Mg1 Zr1\n1.0\n-0.000000 5.051452 5.051452\n5.051452 0.000000 5.051452\n5.051452 5.051452 -0.000000\nBa Mg Zr\n4 1 1\ndirect\n0.123922 0.625359 0.625359 Ba\n0.625359 0.625359 0.625359 Ba\n0.625359 0.123922 0.625359 Ba\n0.625359 0.625359 0.123922 Ba\n0.250000 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 Zr\n",
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"structure_string": "Ba4 Zn1 Pb1\n1.0\n-0.000000 5.051475 5.051475\n5.051475 0.000000 5.051475\n5.051475 5.051475 0.000000\nBa Zn Pb\n4 1 1\ndirect\n0.127747 0.624085 0.624085 Ba\n0.624085 0.624085 0.624085 Ba\n0.624085 0.127747 0.624085 Ba\n0.624085 0.624085 0.127747 Ba\n0.000000 0.000000 0.000000 Zn\n0.250000 0.250000 0.250000 Pb\n",
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{
"id": "jvasp-99492",
"created_at": "2022-09-04T14:36:32.178531Z",
"updated_at": "2022-09-04T14:36:32.178559Z",
"structure_string": "Sr1 Ca3\n1.0\n5.404664 -0.000000 3.120384\n1.801555 5.095566 3.120384\n-0.000000 -0.000000 6.240768\nSr Ca\n1 3\ndirect\n0.000000 0.000000 0.000000 Sr\n0.250000 0.250000 0.250000 Ca\n0.749999 0.750001 0.750000 Ca\n0.499999 0.500000 0.500000 Ca\n",
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{
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"created_at": "2022-09-04T14:38:41.731428Z",
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"structure_string": "Ba1 Sn1 Te1\n1.0\n3.705658 -0.000000 -0.000000\n0.000000 3.705658 0.000000\n-0.000000 0.000000 9.387974\nBa Sn Te\n1 1 1\ndirect\n0.000000 0.000000 0.367294 Ba\n0.000000 0.000000 0.011471 Sn\n0.000000 0.000000 0.714780 Te\n",
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{
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"created_at": "2022-09-04T14:37:16.261037Z",
"updated_at": "2022-09-04T14:37:16.261058Z",
"structure_string": "Sr4 Mg2\n1.0\n6.807324 0.174402 -1.656874\n-4.171592 5.382183 -1.656874\n-0.082726 -0.174402 7.005573\nSr Mg\n4 2\ndirect\n0.665716 0.834283 0.500000 Sr\n0.334283 0.165716 0.500000 Sr\n0.165716 0.665716 0.831433 Sr\n0.834283 0.334283 0.168567 Sr\n0.250000 0.250000 0.000000 Mg\n0.749999 0.749999 0.000001 Mg\n",
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{
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"structure_string": "Ba1 Nd1\n1.0\n1.955365 -3.386792 0.000000\n1.955365 3.386792 0.000000\n-0.000000 -0.000000 6.490793\nBa Nd\n1 1\ndirect\n0.333334 0.666668 0.500000 Ba\n0.666668 0.333334 0.000000 Nd\n",
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