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"results": [
{
"id": "jvasp-99834",
"created_at": "2022-09-04T14:36:35.274713Z",
"updated_at": "2022-09-04T14:36:35.274739Z",
"structure_string": "Pm2 Dy6\n1.0\n7.163315 0.000000 0.000000\n-3.581657 6.203613 0.000000\n-0.000000 -0.000000 5.658227\nPm Dy\n2 6\ndirect\n0.666666 0.333333 0.250000 Pm\n0.333332 0.666667 0.750000 Pm\n0.834121 0.165879 0.750000 Dy\n0.331757 0.165879 0.750000 Dy\n0.834120 0.668242 0.750000 Dy\n0.165878 0.834121 0.250000 Dy\n0.668242 0.834121 0.250000 Dy\n0.165878 0.331757 0.250000 Dy\n",
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{
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"created_at": "2022-09-04T14:38:48.791312Z",
"updated_at": "2022-09-04T14:38:48.791335Z",
"structure_string": "Au1 Br3\n1.0\n7.326739 -1.364499 -1.403514\n4.631630 -4.649448 -1.302090\n0.686804 -3.685441 -5.053460\nAu Br\n1 3\ndirect\n0.094007 0.648585 0.788629 Au\n0.873087 0.027177 0.973147 Br\n0.684598 0.479193 0.242166 Br\n0.308505 0.207030 0.659780 Br\n",
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{
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"updated_at": "2022-09-04T14:38:31.708756Z",
"structure_string": "Ba2 Th2 Br12\n1.0\n4.570330 0.000000 0.000000\n0.000000 9.486416 0.000000\n0.000000 -0.000000 11.601913\nBa Th Br\n2 2 12\ndirect\n0.500000 0.250000 0.252193 Ba\n0.500000 0.750000 0.747807 Ba\n0.000000 0.250000 0.731589 Th\n0.000000 0.750000 0.268411 Th\n0.000000 0.535571 0.849846 Br\n0.000000 0.250000 0.459968 Br\n0.500000 0.750000 0.089483 Br\n0.500000 0.250000 0.910516 Br\n0.000000 0.750000 0.540032 Br\n0.500000 0.927956 0.362371 Br\n0.000000 0.964430 0.849846 Br\n0.000000 0.464430 0.150154 Br\n0.500000 0.072044 0.637629 Br\n0.500000 0.427956 0.637629 Br\n0.000000 0.035571 0.150154 Br\n0.500000 0.572044 0.362371 Br\n",
"nsites": 16,
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"elements": [
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"density": 5.604018200799351,
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"volume": 503.0131391192302,
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"formula_full": "Ba2 Th2 Br12",
"formula_reduced": "BaThBr6",
"formula_anonymous": "ABC6",
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"spacegroup": 51
},
{
"id": "jvasp-40260",
"created_at": "2022-09-04T14:38:01.053822Z",
"updated_at": "2022-09-04T14:38:01.053844Z",
"structure_string": "Ba1 Na1 Hg2\n1.0\n0.000000 3.976464 3.976464\n3.976464 0.000000 3.976464\n3.976464 3.976464 0.000000\nBa Na Hg\n1 1 2\ndirect\n0.249999 0.249999 0.249999 Ba\n0.749999 0.749999 0.749999 Na\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Hg\n",
"nsites": 4,
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],
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"volume": 125.75381256388516,
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"formula_full": "Ba1 Na1 Hg2",
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"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-8694",
"created_at": "2022-09-04T14:36:38.884484Z",
"updated_at": "2022-09-04T14:36:38.884516Z",
"structure_string": "Rb2 Cd1 Cl4\n1.0\n4.983705 0.000000 -1.527821\n-0.468374 4.961648 -1.527821\n0.001962 0.002156 8.898662\nRb Cd Cl\n2 1 4\ndirect\n0.360655 0.360655 0.721310 Rb\n0.639347 0.639346 0.278691 Rb\n0.000000 0.000000 0.000000 Cd\n0.500000 -0.000000 0.000000 Cl\n0.000000 0.500000 0.000000 Cl\n0.162018 0.162018 0.324035 Cl\n0.837984 0.837983 0.675965 Cl\n",
"nsites": 7,
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"elements": [
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"volume": 220.07351728136908,
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"formula_full": "Rb2 Cd1 Cl4",
"formula_reduced": "Rb2CdCl4",
"formula_anonymous": "AB2C4",
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"spacegroup": 139
},
{
"id": "jvasp-37884",
"created_at": "2022-09-04T14:35:53.556321Z",
"updated_at": "2022-09-04T14:35:53.556335Z",
"structure_string": "Cr3 Cd1 Te4\n1.0\n6.312299 -0.000000 0.000000\n0.000000 6.312299 -0.000000\n0.000000 -0.000000 6.312299\nCr Cd Te\n3 1 4\ndirect\n0.000000 0.500000 0.500000 Cr\n0.500000 0.000000 0.500000 Cr\n0.500000 0.500000 0.000000 Cr\n0.000000 0.000000 0.000000 Cd\n0.261494 0.261494 0.261494 Te\n0.738506 0.738506 0.261494 Te\n0.261494 0.738506 0.738506 Te\n0.738506 0.261494 0.738506 Te\n",
"nsites": 8,
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"Te"
],
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"density": 5.141761914827884,
"density_atomic": 0.03180733625846998,
"volume": 251.5143027064921,
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"formula_anonymous": "AB3C4",
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"spacegroup": 215
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{
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"created_at": "2022-09-04T14:36:09.262826Z",
"updated_at": "2022-09-04T14:36:09.262851Z",
"structure_string": "Sr2 Zn1 In1\n1.0\n4.870321 -0.000000 2.811882\n1.623441 4.591783 2.811882\n-0.000000 -0.000000 5.623762\nSr Zn In\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.749999 0.750000 Sr\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 In\n",
"nsites": 4,
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"elements": [
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"In"
],
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"volume": 125.76676063445002,
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"formula_full": "Sr2 Zn1 In1",
"formula_reduced": "Sr2ZnIn",
"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-64952",
"created_at": "2022-09-04T14:38:14.608855Z",
"updated_at": "2022-09-04T14:38:14.608887Z",
"structure_string": "Sc1 Be1 Bi4\n1.0\n-0.000000 4.552132 4.552132\n4.552132 -0.000000 4.552132\n4.552132 4.552132 0.000000\nSc Be Bi\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Sc\n0.000000 0.000000 0.000000 Be\n0.625433 0.123698 0.625433 Bi\n0.123698 0.625433 0.625433 Bi\n0.625433 0.625433 0.625433 Bi\n0.625433 0.625433 0.123698 Bi\n",
"nsites": 6,
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"elements": [
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],
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"density": 7.832686383953355,
"density_atomic": 0.03180363157418697,
"volume": 188.65770048945691,
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"formula_full": "Sc1 Be1 Bi4",
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"formula_anonymous": "ABC4",
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"spacegroup": 216
},
{
"id": "jvasp-93407",
"created_at": "2022-09-04T14:36:13.487418Z",
"updated_at": "2022-09-04T14:36:13.487440Z",
"structure_string": "Rb2 Mn2 Sb2\n1.0\n4.726808 0.000000 0.000000\n0.000000 4.726808 -0.000000\n-0.000000 -0.000000 8.443872\nRb Mn Sb\n2 2 2\ndirect\n0.250000 0.250000 0.649507 Rb\n0.750000 0.750000 0.350493 Rb\n0.250000 0.750000 0.000000 Mn\n0.750000 0.250000 0.000000 Mn\n0.250000 0.250000 0.177449 Sb\n0.750000 0.750000 0.822551 Sb\n",
"nsites": 6,
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"Mn",
"Sb"
],
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"density": 4.615063055935482,
"density_atomic": 0.03180340980197906,
"volume": 188.65901604131244,
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"formula_full": "Rb2 Mn2 Sb2",
"formula_reduced": "RbMnSb",
"formula_anonymous": "ABC",
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"spacegroup": 129
},
{
"id": "jvasp-116424",
"created_at": "2022-09-04T14:38:42.456552Z",
"updated_at": "2022-09-04T14:38:42.456577Z",
"structure_string": "Cd1 As1 I2\n1.0\n4.459118 0.000000 0.000000\n0.000000 4.459118 0.000000\n0.000000 0.000000 6.325993\nCd As I\n1 1 2\ndirect\n0.500000 0.500000 0.502368 Cd\n0.000000 0.000000 0.002573 As\n0.000000 0.000000 0.502588 I\n0.500000 0.500000 0.002472 I\n",
"nsites": 4,
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"I"
],
"chemical_system": "As-Cd-I",
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"density_atomic": 0.03180045648343327,
"volume": 125.78435790957388,
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},
{
"id": "jvasp-105690",
"created_at": "2022-09-04T14:36:06.986356Z",
"updated_at": "2022-09-04T14:36:06.986386Z",
"structure_string": "K1 Rb2 As1 Cl6\n1.0\n6.610920 -0.000000 3.816816\n2.203640 6.232835 3.816816\n-0.000000 -0.000000 7.633632\nK Rb As Cl\n1 2 1 6\ndirect\n0.500000 0.500000 0.500000 K\n0.750000 0.749999 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 As\n0.768419 0.231581 0.231581 Cl\n0.231581 0.231581 0.768419 Cl\n0.231581 0.768419 0.768420 Cl\n0.231581 0.768419 0.231581 Cl\n0.768419 0.231581 0.768420 Cl\n0.768420 0.768419 0.231582 Cl\n",
"nsites": 10,
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"volume": 314.54207798662935,
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"formula_full": "K1 Rb2 As1 Cl6",
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},
{
"id": "jvasp-13062",
"created_at": "2022-09-04T14:36:50.501228Z",
"updated_at": "2022-09-04T14:36:50.501247Z",
"structure_string": "Sn4 Br8\n1.0\n4.224787 -0.000000 0.000000\n-0.000000 8.585659 0.000000\n0.000000 0.000000 10.407649\nSn Br\n4 8\ndirect\n0.250000 0.868295 0.831421 Sn\n0.750001 0.131705 0.168580 Sn\n0.250000 0.368295 0.668580 Sn\n0.750001 0.631705 0.331420 Sn\n0.250000 0.167842 0.948508 Br\n0.750001 0.832158 0.051492 Br\n0.250000 0.667842 0.551492 Br\n0.750001 0.332158 0.448508 Br\n0.250000 0.489078 0.178447 Br\n0.750001 0.510922 0.821554 Br\n0.250000 0.989078 0.321553 Br\n0.750001 0.010922 0.678447 Br\n",
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"formula_full": "Sn4 Br8",
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"spacegroup": 62
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}