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{
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"results": [
{
"id": "jvasp-14385",
"created_at": "2022-09-04T14:38:17.464171Z",
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"structure_string": "K2 Hg7\n1.0\n3.544853 -6.139866 0.000000\n3.544853 6.139866 -0.000000\n-0.000000 -0.000000 6.315821\nK Hg\n2 7\ndirect\n0.333332 0.666667 0.168159 K\n0.666667 0.333332 0.831841 K\n0.183010 0.816989 0.671859 Hg\n0.633976 0.816988 0.671859 Hg\n0.183011 0.366023 0.671859 Hg\n0.816989 0.183010 0.328141 Hg\n0.816988 0.633976 0.328141 Hg\n0.366023 0.183011 0.328141 Hg\n0.000000 0.000000 0.000000 Hg\n",
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{
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"updated_at": "2022-09-04T14:37:30.998811Z",
"structure_string": "Pm1 Dy1 Hg2\n1.0\n0.000000 3.740607 3.740607\n3.740607 -0.000000 3.740607\n3.740607 3.740607 -0.000000\nPm Dy Hg\n1 1 2\ndirect\n0.750001 0.750001 0.750001 Pm\n0.250000 0.250000 0.250000 Dy\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Hg\n",
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{
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"structure_string": "Rb6 Ni6 F18\n1.0\n2.937747 -5.088326 -0.000000\n2.937747 5.088326 0.000000\n-0.000000 -0.000000 14.402744\nRb Ni F\n6 6 18\ndirect\n0.666668 0.333333 0.407709 Rb\n0.333333 0.666668 0.907709 Rb\n0.333333 0.666668 0.592290 Rb\n0.666668 0.333333 0.092291 Rb\n0.000000 0.000000 0.750000 Rb\n0.000000 0.000000 0.250000 Rb\n0.000000 0.000000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.666668 0.333333 0.844333 Ni\n0.333333 0.666668 0.155666 Ni\n0.666668 0.333333 0.655666 Ni\n0.333333 0.666668 0.344333 Ni\n0.834752 0.669503 0.580338 F\n0.482997 0.965992 0.250000 F\n0.517005 0.034009 0.750000 F\n0.965992 0.482997 0.750000 F\n0.482997 0.517005 0.250000 F\n0.165249 0.834752 0.080338 F\n0.330499 0.165249 0.580338 F\n0.165249 0.330499 0.080338 F\n0.165249 0.330499 0.419661 F\n0.834752 0.165249 0.919661 F\n0.330499 0.165249 0.919661 F\n0.834752 0.165249 0.580338 F\n0.834752 0.669503 0.919661 F\n0.034009 0.517005 0.250000 F\n0.165249 0.834752 0.419661 F\n0.669503 0.834752 0.419661 F\n0.669503 0.834752 0.080338 F\n0.517005 0.482997 0.750000 F\n",
"nsites": 30,
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"elements": [
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"F"
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"chemical_system": "F-Ni-Rb",
"density": 4.654463904441579,
"density_atomic": 0.06967174662818425,
"volume": 430.5906117166887,
"volume_molar": 8.643590912308017,
"formula_full": "Rb6 Ni6 F18",
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{
"id": "jvasp-37403",
"created_at": "2022-09-04T14:37:57.702404Z",
"updated_at": "2022-09-04T14:37:57.702424Z",
"structure_string": "Tl3 Br1\n1.0\n-2.368204 2.368204 5.663147\n2.368204 -2.368204 5.663147\n2.368204 2.368204 -5.663147\nTl Br\n3 1\ndirect\n0.749997 0.250000 0.499997 Tl\n0.250000 0.749997 0.499997 Tl\n0.500001 0.500001 0.000000 Tl\n0.000000 0.000000 0.000000 Br\n",
"nsites": 4,
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"elements": [
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"volume": 127.04455221800278,
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"formula_full": "Tl3 Br1",
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"spacegroup": 139
},
{
"id": "jvasp-36191",
"created_at": "2022-09-04T14:37:16.020742Z",
"updated_at": "2022-09-04T14:37:16.020761Z",
"structure_string": "Ba1 Ga1 Cu2\n1.0\n-2.157217 -3.736409 -0.000000\n-4.314433 -0.000000 -0.000000\n-2.157217 -1.245469 -5.643446\nBa Ga Cu\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Ga\n0.810971 0.810971 0.567088 Cu\n0.189029 0.189030 0.432912 Cu\n",
"nsites": 4,
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"elements": [
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"chemical_system": "Ba-Cu-Ga",
"density": 6.0989862295575215,
"density_atomic": 0.043968077739870846,
"volume": 90.97509387754621,
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{
"id": "jvasp-38030",
"created_at": "2022-09-04T14:38:00.996509Z",
"updated_at": "2022-09-04T14:38:00.996544Z",
"structure_string": "Sn2 Br2 F2\n1.0\n4.097321 -0.000000 0.000000\n0.000000 4.097321 0.000000\n0.000000 -0.000000 7.779761\nSn Br F\n2 2 2\ndirect\n0.500000 0.000000 0.811577 Sn\n0.000000 0.500000 0.188423 Sn\n0.000000 0.500000 0.652986 Br\n0.500000 0.000000 0.347014 Br\n0.000000 0.000000 0.000000 F\n0.500000 0.500000 0.000000 F\n",
"nsites": 6,
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"spacegroup": 129
},
{
"id": "jvasp-110076",
"created_at": "2022-09-04T14:37:54.951557Z",
"updated_at": "2022-09-04T14:37:54.951582Z",
"structure_string": "Rb2 Na1 Pd1 F6\n1.0\n5.217612 0.003039 -3.189938\n-1.638870 4.953543 -3.189938\n-0.002194 -0.003039 6.115486\nRb Na Pd F\n2 1 1 6\ndirect\n0.750000 0.250000 0.500000 Rb\n0.250000 0.749999 0.500000 Rb\n0.500000 0.500000 -0.000001 Na\n0.000000 0.000000 0.000000 Pd\n0.234763 0.234763 0.469527 F\n0.765237 0.765236 0.530473 F\n0.234763 0.765236 -0.000001 F\n0.765236 0.234763 -0.000000 F\n0.247864 0.247864 -0.000000 F\n0.752135 0.752135 -0.000001 F\n",
"nsites": 10,
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"elements": [
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"density": 4.35488847188481,
"density_atomic": 0.06329588732140286,
"volume": 157.98814777999965,
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"formula_full": "Rb2 Na1 Pd1 F6",
"formula_reduced": "Rb2NaPdF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-22445",
"created_at": "2022-09-04T14:37:54.083328Z",
"updated_at": "2022-09-04T14:37:54.083338Z",
"structure_string": "Ge1 F4\n1.0\n4.392928 0.000000 -1.553134\n-2.196464 3.804387 -1.553134\n-0.000000 -0.000000 4.659404\nGe F\n1 4\ndirect\n0.000000 0.000000 0.000000 Ge\n0.000000 0.000000 0.630249 F\n0.369751 0.369750 0.369751 F\n0.630250 -0.000000 0.000001 F\n0.000001 0.630250 0.000001 F\n",
"nsites": 5,
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"spacegroup": 217
},
{
"id": "jvasp-40253",
"created_at": "2022-09-04T14:37:54.619370Z",
"updated_at": "2022-09-04T14:37:54.619389Z",
"structure_string": "Sm1 Zn2 Ag1\n1.0\n-0.000002 3.384813 3.384817\n3.384817 0.000000 3.384815\n3.384818 3.384812 -0.000001\nSm Zn Ag\n1 2 1\ndirect\n0.749999 0.750001 0.750000 Sm\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500002 0.500001 Zn\n0.250001 0.250001 0.250001 Ag\n",
"nsites": 4,
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"spacegroup": 225
},
{
"id": "jvasp-12540",
"created_at": "2022-09-04T14:38:06.331126Z",
"updated_at": "2022-09-04T14:38:06.331153Z",
"structure_string": "K4 Zn2 Br8\n1.0\n0.000000 7.252918 -0.034134\n7.440578 0.000000 0.000000\n0.000000 -2.843582 -8.427289\nK Zn Br\n4 2 8\ndirect\n0.233226 0.773507 0.430980 K\n0.766775 0.273507 0.569020 K\n0.282367 0.770985 0.947504 K\n0.717634 0.270985 0.052495 K\n0.719601 0.738550 0.797877 Zn\n0.280399 0.238550 0.202123 Zn\n0.903650 0.708808 0.077327 Br\n0.096350 0.208808 0.922673 Br\n0.917207 0.716393 0.623700 Br\n0.082794 0.216393 0.376300 Br\n0.519771 0.007397 0.744998 Br\n0.480230 0.507397 0.255001 Br\n0.474830 0.499552 0.731707 Br\n0.525170 0.999552 0.268293 Br\n",
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"elements": [
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"volume": 455.50845674060605,
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{
"id": "jvasp-36945",
"created_at": "2022-09-04T14:38:18.074851Z",
"updated_at": "2022-09-04T14:38:18.074863Z",
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{
"id": "jvasp-109587",
"created_at": "2022-09-04T14:38:27.246792Z",
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"structure_string": "Pm1 Tm1 Zn2\n1.0\n4.376447 -0.000000 2.526743\n1.458816 4.126154 2.526743\n-0.000000 -0.000000 5.053486\nPm Tm Zn\n1 1 2\ndirect\n0.500001 0.499999 0.500000 Pm\n0.000000 0.000000 0.000000 Tm\n0.250000 0.250000 0.250000 Zn\n0.750001 0.749999 0.749999 Zn\n",
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