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{
"id": "jvasp-16554",
"created_at": "2022-09-04T14:37:43.380160Z",
"updated_at": "2022-09-04T14:37:43.380183Z",
"structure_string": "Hg2 Pt1\n1.0\n4.817073 0.000000 0.000000\n-0.000000 4.817073 -0.000000\n0.000000 -0.000000 2.986830\nHg Pt\n2 1\ndirect\n0.000000 0.500000 0.500000 Hg\n0.500000 0.000000 0.500000 Hg\n0.000000 0.000000 0.000000 Pt\n",
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{
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"structure_string": "Pm2 Au6\n1.0\n3.198733 -5.540368 0.000000\n3.198733 5.540368 -0.000000\n-0.000000 -0.000000 4.824145\nPm Au\n2 6\ndirect\n0.333332 0.666667 0.250000 Pm\n0.666667 0.333332 0.749999 Pm\n0.684600 0.842299 0.749999 Au\n0.157700 0.315399 0.749999 Au\n0.157699 0.842300 0.749999 Au\n0.315399 0.157700 0.250000 Au\n0.842299 0.684600 0.250000 Au\n0.842300 0.157699 0.250000 Au\n",
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{
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"structure_string": "Pu1 N1\n1.0\n3.019357 0.000000 1.743226\n1.006452 2.846676 1.743226\n-0.000000 -0.000000 3.486453\nPu N\n1 1\ndirect\n0.000000 0.000000 0.000000 Pu\n0.500000 0.500001 0.500000 N\n",
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"volume": 29.96652063455097,
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{
"id": "jvasp-94943",
"created_at": "2022-09-04T14:36:09.231764Z",
"updated_at": "2022-09-04T14:36:09.231792Z",
"structure_string": "Pu2 W2 C3\n1.0\n0.000000 3.278175 -0.000000\n0.226670 -0.000000 5.674024\n5.497563 -1.639088 -1.759898\nPu W C\n2 2 3\ndirect\n0.609456 0.833832 0.218913 Pu\n0.390542 0.166166 0.781086 Pu\n0.848050 0.622567 0.696103 W\n0.151947 0.377432 0.303896 W\n0.000000 0.500000 0.000000 C\n0.262854 0.747262 0.525709 C\n0.737144 0.252737 0.474290 C\n",
"nsites": 7,
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"elements": [
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"density": 14.297544983512834,
"density_atomic": 0.06759051481978408,
"volume": 103.5648273824224,
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"formula_full": "Pu2 W2 C3",
"formula_reduced": "Pu2W2C3",
"formula_anonymous": "A2B2C3",
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"spacegroup": 12
},
{
"id": "jvasp-15013",
"created_at": "2022-09-04T14:36:20.497376Z",
"updated_at": "2022-09-04T14:36:20.497400Z",
"structure_string": "V2 Pt2\n1.0\n3.826431 0.000000 0.000000\n0.000000 3.826431 0.000000\n0.000000 0.000000 3.903052\nV Pt\n2 2\ndirect\n0.500000 0.000000 0.500000 V\n0.000000 0.500000 0.500000 V\n0.500000 0.500000 0.000000 Pt\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 4,
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"elements": [
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"volume": 57.146825455719465,
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"formula_full": "V2 Pt2",
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"spacegroup": 123
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{
"id": "jvasp-17943",
"created_at": "2022-09-04T14:38:10.506362Z",
"updated_at": "2022-09-04T14:38:10.506384Z",
"structure_string": "U1 Ge2 Ir2\n1.0\n3.872796 -0.000000 -1.466640\n-0.555422 3.832760 -1.466640\n0.045168 0.052185 5.965823\nU Ge Ir\n1 2 2\ndirect\n0.000000 0.000000 0.000000 U\n0.617611 0.617610 0.235219 Ge\n0.382392 0.382391 0.764781 Ge\n0.750001 0.250001 0.500000 Ir\n0.250001 0.750001 0.500000 Ir\n",
"nsites": 5,
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"Ge",
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"volume": 89.14650208694577,
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"formula_full": "U1 Ge2 Ir2",
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{
"id": "jvasp-40457",
"created_at": "2022-09-04T14:38:06.275244Z",
"updated_at": "2022-09-04T14:38:06.275266Z",
"structure_string": "Th1 Pb1 Au2\n1.0\n-0.000042 3.643378 3.643377\n3.643249 -0.000021 3.643355\n3.643245 3.643352 -0.000016\nTh Pb Au\n1 1 2\ndirect\n0.750002 0.750001 0.750000 Th\n0.250000 0.250000 0.250000 Pb\n0.500000 0.500002 0.500002 Au\n0.000003 0.999999 0.999998 Au\n",
"nsites": 4,
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"density_atomic": 0.04135530118551092,
"volume": 96.72278729290028,
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"formula_full": "Th1 Pb1 Au2",
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{
"id": "jvasp-35623",
"created_at": "2022-09-04T14:37:40.706740Z",
"updated_at": "2022-09-04T14:37:40.706756Z",
"structure_string": "Ga4 Pt4\n1.0\n4.972623 0.000000 -0.000000\n-0.000000 4.972623 0.000000\n0.000000 0.000000 4.972623\nGa Pt\n4 4\ndirect\n0.092447 0.092447 0.092447 Ga\n0.407552 0.907552 0.592447 Ga\n0.907552 0.592447 0.407552 Ga\n0.592447 0.407552 0.907552 Ga\n0.400370 0.400370 0.400370 Pt\n0.099630 0.599630 0.900369 Pt\n0.599630 0.900369 0.099630 Pt\n0.900369 0.099630 0.599630 Pt\n",
"nsites": 8,
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"elements": [
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"volume": 122.95794698286993,
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"formula_full": "Ga4 Pt4",
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"formula_anonymous": "AB",
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"spacegroup": 198
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{
"id": "jvasp-90822",
"created_at": "2022-09-04T14:35:46.808590Z",
"updated_at": "2022-09-04T14:35:46.808616Z",
"structure_string": "Tl6 Ir2\n1.0\n5.718129 0.000000 -0.000000\n0.000000 5.718129 -0.000000\n-0.000000 0.000000 5.718129\nTl Ir\n6 2\ndirect\n0.000000 0.500000 0.750000 Tl\n0.500000 0.250000 0.000000 Tl\n0.750000 0.000000 0.500000 Tl\n0.000000 0.500000 0.250000 Tl\n0.500000 0.750000 0.000000 Tl\n0.250000 0.000000 0.500000 Tl\n0.500000 0.500000 0.500000 Ir\n0.000000 0.000000 0.000000 Ir\n",
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"volume": 186.96565968524988,
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},
{
"id": "jvasp-75736",
"created_at": "2022-09-04T14:35:51.310915Z",
"updated_at": "2022-09-04T14:35:51.310934Z",
"structure_string": "Nb1 As1 Os2\n1.0\n0.000000 3.168638 3.168638\n3.168638 0.000000 3.168638\n3.168638 3.168638 0.000000\nNb As Os\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Nb\n0.500000 0.500000 0.500000 As\n0.000000 0.000000 0.000000 Os\n0.750000 0.750000 0.750000 Os\n",
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},
{
"id": "jvasp-67892",
"created_at": "2022-09-04T14:35:58.335614Z",
"updated_at": "2022-09-04T14:35:58.335641Z",
"structure_string": "Be1 Ga1 Os2\n1.0\n-1.886612 1.886612 3.742754\n1.886612 -1.886612 3.742754\n1.886612 1.886612 -3.742754\nBe Ga Os\n1 1 2\ndirect\n0.499999 0.499999 0.000000 Be\n0.749999 0.250000 0.499999 Ga\n0.000000 0.000000 0.000000 Os\n0.250000 0.749999 0.499999 Os\n",
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{
"id": "jvasp-74102",
"created_at": "2022-09-04T14:35:49.387852Z",
"updated_at": "2022-09-04T14:35:49.387891Z",
"structure_string": "Be1 Cr1 Re2\n1.0\n2.999723 0.000000 0.000000\n0.000000 2.999723 0.000000\n0.000000 0.000000 5.589403\nBe Cr Re\n1 1 2\ndirect\n0.000000 0.000000 0.513133 Be\n0.500000 0.500000 0.725868 Cr\n0.000000 0.000000 0.973833 Re\n0.500000 0.500000 0.287166 Re\n",
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