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{
"id": "jvasp-111943",
"created_at": "2022-09-04T14:38:53.168876Z",
"updated_at": "2022-09-04T14:38:53.168900Z",
"structure_string": "Li4 Fe2 F8\n1.0\n4.981479 -0.030255 -0.000000\n-4.172654 2.721215 0.000000\n0.000000 0.000000 9.798950\nLi Fe F\n4 2 8\ndirect\n0.623773 0.376226 0.063152 Li\n0.623773 0.376226 0.436848 Li\n0.376228 0.623774 0.563152 Li\n0.376228 0.623774 0.936848 Li\n0.875750 0.124248 0.250000 Fe\n0.124251 0.875752 0.750000 Fe\n0.000000 0.000000 0.000000 F\n0.000000 0.000000 0.500000 F\n0.536069 0.463932 0.250000 F\n0.726358 0.273641 0.618532 F\n0.726358 0.273641 0.881468 F\n0.463932 0.536069 0.750000 F\n0.273643 0.726359 0.118532 F\n0.273643 0.726359 0.381468 F\n",
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{
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"structure_string": "K1 Na1 Be1\n1.0\n2.594203 -4.493291 -0.000000\n2.594203 4.493291 0.000000\n-0.000000 -0.000000 4.377044\nK Na Be\n1 1 1\ndirect\n0.666666 0.333332 0.666648 K\n0.333332 0.666666 0.166918 Na\n-0.000000 0.000000 0.166434 Be\n",
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{
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"created_at": "2022-09-04T14:36:58.232792Z",
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"structure_string": "Zr2 Zn3 Ga3\n1.0\n4.019139 -0.000000 0.000000\n0.000000 4.063375 0.000000\n-0.000000 -0.000000 8.231361\nZr Zn Ga\n2 3 3\ndirect\n0.000000 0.000000 0.754420 Zr\n0.000000 0.000000 0.245580 Zr\n0.500000 0.000000 0.500000 Zn\n-0.000000 0.500001 -0.000000 Zn\n-0.000000 0.500001 0.500000 Zn\n0.500000 0.500001 0.740786 Ga\n0.500000 0.500001 0.259214 Ga\n0.500000 0.000000 -0.000000 Ga\n",
"nsites": 8,
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"volume": 134.42857018486808,
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{
"id": "jvasp-108606",
"created_at": "2022-09-04T14:38:20.213074Z",
"updated_at": "2022-09-04T14:38:20.213095Z",
"structure_string": "In4 Sb1 Te3\n1.0\n6.993723 -0.018531 3.113244\n-4.177744 5.608829 3.113244\n-0.000151 -0.000300 6.226712\nIn Sb Te\n4 1 3\ndirect\n0.001457 0.001457 0.000771 In\n0.501317 0.501317 0.000766 In\n0.247537 0.756210 0.499839 In\n0.756210 0.247536 0.499840 In\n0.001440 0.001440 0.500709 Sb\n0.751812 0.251844 0.999924 Te\n0.251845 0.751812 0.999923 Te\n0.501536 0.501536 0.500530 Te\n",
"nsites": 8,
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"elements": [
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"formula_full": "In4 Sb1 Te3",
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{
"id": "jvasp-35034",
"created_at": "2022-09-04T14:37:27.479138Z",
"updated_at": "2022-09-04T14:37:27.479159Z",
"structure_string": "Pr2 Cu2 Pb2\n1.0\n2.333037 -4.040938 -0.000000\n2.333037 4.040938 0.000000\n0.000000 -0.000000 7.948907\nPr Cu Pb\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Pr\n0.000000 0.000000 0.000000 Pr\n0.333334 0.666668 0.250000 Cu\n0.666668 0.333334 0.750000 Cu\n0.333334 0.666668 0.750000 Pb\n0.666668 0.333334 0.250000 Pb\n",
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{
"id": "jvasp-113488",
"created_at": "2022-09-04T14:38:47.211303Z",
"updated_at": "2022-09-04T14:38:47.211321Z",
"structure_string": "Rb1 Cl1\n1.0\n7.668979 0.000000 0.000000\n0.000000 7.668979 0.000000\n0.000000 -0.000000 6.041758\nRb Cl\n1 1\ndirect\n0.000000 0.000000 0.750016 Rb\n0.000000 0.000000 0.249984 Cl\n",
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{
"id": "jvasp-107645",
"created_at": "2022-09-04T14:36:58.007580Z",
"updated_at": "2022-09-04T14:36:58.007602Z",
"structure_string": "Ba3 La1\n1.0\n5.885553 -0.000000 0.000000\n0.000000 5.885553 0.000000\n-0.000000 -0.000000 5.885553\nBa La\n3 1\ndirect\n-0.000000 0.500000 0.500000 Ba\n0.500000 0.000000 0.500000 Ba\n0.500000 0.500000 -0.000000 Ba\n0.000000 0.000000 0.000000 La\n",
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{
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"created_at": "2022-09-04T14:35:50.917908Z",
"updated_at": "2022-09-04T14:35:50.917935Z",
"structure_string": "K4 Be1 P1\n1.0\n0.000000 4.689190 4.689190\n4.689190 0.000000 4.689190\n4.689190 4.689190 0.000000\nK Be P\n4 1 1\ndirect\n0.129598 0.623468 0.623468 K\n0.623468 0.623468 0.623468 K\n0.623468 0.129598 0.623468 K\n0.623468 0.623468 0.129598 K\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 P\n",
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"volume": 206.2165354155911,
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"formula_full": "K4 Be1 P1",
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"spacegroup": 216
},
{
"id": "jvasp-38419",
"created_at": "2022-09-04T14:37:52.552279Z",
"updated_at": "2022-09-04T14:37:52.552311Z",
"structure_string": "Pr1 Tm1 Mg2\n1.0\n0.000000 3.809292 3.809292\n3.809292 -0.000000 3.809292\n3.809292 3.809292 0.000000\nPr Tm Mg\n1 1 2\ndirect\n0.250001 0.250001 0.250001 Pr\n0.750001 0.750001 0.750001 Tm\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n",
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},
{
"id": "jvasp-47303",
"created_at": "2022-09-04T14:38:04.714671Z",
"updated_at": "2022-09-04T14:38:04.714696Z",
"structure_string": "Li4 Mn2 F12\n1.0\n0.000000 4.976863 0.026573\n5.174089 0.000000 0.000000\n0.000000 -5.009419 -7.377722\nLi Mn F\n4 2 12\ndirect\n0.492855 0.238450 0.495693 Li\n0.740469 0.310750 0.231702 Li\n0.492855 0.761550 -0.004307 Li\n0.740469 0.689250 0.731702 Li\n0.998423 0.242584 0.001091 Mn\n0.998423 0.757416 0.501091 Mn\n0.252555 0.570920 0.453397 F\n0.751000 0.069196 0.062043 F\n0.080027 0.062920 0.428586 F\n0.367684 0.801571 0.733954 F\n0.655358 0.689880 0.268936 F\n0.751000 0.930804 0.562043 F\n0.252555 0.429081 0.953397 F\n0.892885 0.531571 0.074015 F\n0.080026 0.937080 0.928585 F\n0.367684 0.198430 0.233954 F\n0.892885 0.468430 0.574015 F\n0.655358 0.310121 0.768936 F\n",
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{
"id": "jvasp-111963",
"created_at": "2022-09-04T14:38:52.978673Z",
"updated_at": "2022-09-04T14:38:52.978699Z",
"structure_string": "Li4 V4 F16\n1.0\n4.665532 0.000000 0.000000\n0.000000 5.503476 0.634654\n0.000000 -0.046724 10.222329\nLi V F\n4 4 16\ndirect\n0.505829 0.100766 0.625230 Li\n0.994170 0.100765 0.125230 Li\n0.005829 -0.100765 0.874770 Li\n0.494170 -0.100765 0.374770 Li\n0.010699 0.635027 0.625815 V\n0.489301 0.635027 0.125815 V\n0.510699 0.364974 0.874185 V\n0.989300 0.364974 0.374185 V\n0.696809 0.160347 0.449839 F\n0.803190 0.160347 0.949839 F\n0.310192 0.353644 0.049155 F\n0.189808 0.353644 0.549155 F\n0.786655 0.409036 0.201240 F\n0.713344 0.409036 0.701240 F\n0.286655 0.590965 0.298760 F\n0.196810 0.839654 0.050160 F\n0.810192 0.646357 0.450845 F\n0.689808 0.646358 0.950845 F\n0.318287 0.108646 0.801185 F\n0.303190 0.839654 0.550160 F\n0.681712 0.891355 0.198815 F\n0.818287 0.891355 0.698815 F\n0.213345 0.590965 0.798760 F\n0.181713 0.108646 0.301185 F\n",
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{
"id": "jvasp-55234",
"created_at": "2022-09-04T14:37:04.478978Z",
"updated_at": "2022-09-04T14:37:04.479012Z",
"structure_string": "Ba8 Cd4 S12\n1.0\n4.373406 0.000000 0.000000\n-0.000000 8.994090 0.000000\n0.000000 0.000000 17.378029\nBa Cd S\n8 4 12\ndirect\n0.250000 0.263544 0.541818 Ba\n0.750001 0.236456 0.041818 Ba\n0.250000 0.763544 0.958182 Ba\n0.750001 0.736456 0.458182 Ba\n0.250000 0.922292 0.214812 Ba\n0.750001 0.077708 0.785188 Ba\n0.250000 0.422292 0.285188 Ba\n0.750001 0.577708 0.714812 Ba\n0.250000 0.377731 0.868525 Cd\n0.250000 0.877731 0.631475 Cd\n0.750001 0.622269 0.131475 Cd\n0.750001 0.122269 0.368525 Cd\n0.250000 0.314529 0.724318 S\n0.250000 0.484299 0.095953 S\n0.750001 0.515701 0.904047 S\n0.250000 0.984299 0.404047 S\n0.750001 0.015701 0.595953 S\n0.250000 0.618747 0.572204 S\n0.750001 0.381253 0.427796 S\n0.250000 0.118747 0.927796 S\n0.750001 0.685471 0.275682 S\n0.250000 0.814529 0.775682 S\n0.750001 0.185471 0.224318 S\n0.750001 0.881253 0.072204 S\n",
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