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{
"id": "jvasp-41548",
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"updated_at": "2022-09-04T14:37:44.402723Z",
"structure_string": "Zn1 Pd3\n1.0\n-1.974518 1.974518 3.836495\n1.974518 -1.974518 3.836495\n1.974518 1.974518 -3.836495\nZn Pd\n1 3\ndirect\n0.000000 0.000000 0.000000 Zn\n0.750000 0.249999 0.500002 Pd\n0.249999 0.750000 0.500002 Pd\n0.499998 0.499998 0.000000 Pd\n",
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{
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"structure_string": "Zn3 Pd1\n1.0\n-1.881875 1.881875 4.092049\n1.881875 -1.881875 4.092049\n1.881875 1.881875 -4.092049\nZn Pd\n3 1\ndirect\n0.750000 0.249999 0.500001 Zn\n0.249999 0.750000 0.500001 Zn\n0.500000 0.500000 0.000000 Zn\n0.000000 0.000000 0.000000 Pd\n",
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{
"id": "jvasp-19794",
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"structure_string": "Zn2 Pd2\n1.0\n3.426949 0.000000 -0.000000\n0.000000 4.105210 0.000000\n0.000000 0.000000 4.105210\nZn Pd\n2 2\ndirect\n0.500000 0.500000 0.000000 Zn\n0.500000 0.000000 0.500000 Zn\n0.000000 0.500000 0.500000 Pd\n0.000000 0.000000 0.000000 Pd\n",
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"density": 9.880914882937905,
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"volume": 57.75351182662434,
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},
{
"id": "jvasp-18785",
"created_at": "2022-09-04T14:35:48.859116Z",
"updated_at": "2022-09-04T14:35:48.859135Z",
"structure_string": "Zn1 Pt3\n1.0\n3.934989 -0.000000 -0.000000\n0.000000 3.934989 0.000000\n0.000000 0.000000 3.934989\nZn Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n0.000000 0.500000 0.500000 Pt\n",
"nsites": 4,
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"elements": [
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"density": 17.732636264234767,
"density_atomic": 0.06564919776412365,
"volume": 60.929914397003394,
"volume_molar": 9.173213024837624,
"formula_full": "Zn1 Pt3",
"formula_reduced": "ZnPt3",
"formula_anonymous": "AB3",
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"spacegroup": 221
},
{
"id": "jvasp-19884",
"created_at": "2022-09-04T14:36:48.923814Z",
"updated_at": "2022-09-04T14:36:48.923845Z",
"structure_string": "Zn2 Pt2\n1.0\n3.542459 0.000000 0.000000\n-0.000000 4.068943 0.000000\n0.000000 0.000000 4.068943\nZn Pt\n2 2\ndirect\n0.500000 0.500000 0.000000 Zn\n0.500000 0.000000 0.500000 Zn\n0.000000 0.500000 0.500000 Pt\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 4,
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"elements": [
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"chemical_system": "Pt-Zn",
"density": 14.750512363035316,
"density_atomic": 0.06820118910144729,
"volume": 58.65000380052196,
"volume_molar": 8.829964461531954,
"formula_full": "Zn2 Pt2",
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"spacegroup": 123
},
{
"id": "jvasp-41499",
"created_at": "2022-09-04T14:37:44.181150Z",
"updated_at": "2022-09-04T14:37:44.181176Z",
"structure_string": "Zn3 Pt1\n1.0\n-1.896588 1.896588 4.038204\n1.896588 -1.896588 4.038204\n1.896588 1.896588 -4.038204\nZn Pt\n3 1\ndirect\n0.749998 0.250000 0.499999 Zn\n0.250000 0.749998 0.499999 Zn\n0.500000 0.500000 0.000000 Zn\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 4,
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"elements": [
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"density": 11.183478601275477,
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"volume": 58.10242285581915,
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"formula_full": "Zn3 Pt1",
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"formula_anonymous": "AB3",
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"spacegroup": 139
},
{
"id": "jvasp-39558",
"created_at": "2022-09-04T14:37:43.998105Z",
"updated_at": "2022-09-04T14:37:43.998122Z",
"structure_string": "Zn1 Rh3\n1.0\n-1.911395 1.911395 3.827895\n1.911395 -1.911395 3.827895\n1.911395 1.911395 -3.827895\nZn Rh\n1 3\ndirect\n0.000000 0.000000 0.000000 Zn\n0.750000 0.250000 0.500000 Rh\n0.250000 0.750000 0.500000 Rh\n0.499999 0.499999 0.000000 Rh\n",
"nsites": 4,
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"elements": [
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"Rh"
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"density_atomic": 0.07150544147209298,
"volume": 55.939798673379464,
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"formula_full": "Zn1 Rh3",
"formula_reduced": "ZnRh3",
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"spacegroup": 139
},
{
"id": "jvasp-41492",
"created_at": "2022-09-04T14:37:46.017815Z",
"updated_at": "2022-09-04T14:37:46.017834Z",
"structure_string": "Zn3 Rh1\n1.0\n-1.855531 1.855531 4.083763\n1.855531 -1.855531 4.083763\n1.855531 1.855531 -4.083763\nZn Rh\n3 1\ndirect\n0.750000 0.250001 0.500000 Zn\n0.250001 0.750000 0.500000 Zn\n0.500000 0.500000 0.000000 Zn\n0.000000 0.000000 0.000000 Rh\n",
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"elements": [
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"volume": 56.24150712993813,
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"spacegroup": 139
},
{
"id": "jvasp-15701",
"created_at": "2022-09-04T14:35:49.664872Z",
"updated_at": "2022-09-04T14:35:49.664892Z",
"structure_string": "Zn1 Rh1\n1.0\n3.022686 0.000000 -0.000000\n0.000000 3.022686 -0.000000\n0.000000 0.000000 3.022686\nZn Rh\n1 1\ndirect\n0.500001 0.500001 0.500001 Zn\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 2,
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"elements": [
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"volume": 27.61716556681817,
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"formula_full": "Zn1 Rh1",
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"spacegroup": 221
},
{
"id": "jvasp-37553",
"created_at": "2022-09-04T14:37:54.689511Z",
"updated_at": "2022-09-04T14:37:54.689534Z",
"structure_string": "Zn6 Rh2\n1.0\n2.712852 -4.698797 0.000000\n2.712852 4.698797 -0.000000\n0.000000 0.000000 4.401445\nZn Rh\n6 2\ndirect\n0.662029 0.831015 0.250000 Zn\n0.168984 0.831015 0.250000 Zn\n0.168985 0.337971 0.250000 Zn\n0.337971 0.168985 0.750001 Zn\n0.831015 0.168984 0.750001 Zn\n0.831015 0.662029 0.750001 Zn\n0.333333 0.666667 0.750001 Rh\n0.666667 0.333333 0.250000 Rh\n",
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"elements": [
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"volume": 112.21167862061202,
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"spacegroup": 194
},
{
"id": "jvasp-19686",
"created_at": "2022-09-04T14:38:32.248954Z",
"updated_at": "2022-09-04T14:38:32.248985Z",
"structure_string": "Zn6 Ru2\n1.0\n3.683910 0.000000 -0.867719\n-0.204385 3.678236 -0.867719\n0.001493 0.001578 8.260230\nZn Ru\n6 2\ndirect\n0.629090 0.629091 0.258180 Zn\n0.370908 0.370910 0.741820 Zn\n0.500000 -0.000000 -0.000000 Zn\n-0.000001 0.500001 -0.000000 Zn\n0.749999 0.250001 0.500000 Zn\n0.249999 0.750001 0.500000 Zn\n0.882668 0.882671 0.765339 Ru\n0.117330 0.117330 0.234661 Ru\n",
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},
{
"id": "jvasp-57104",
"created_at": "2022-09-04T14:38:30.916274Z",
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"structure_string": "Zn8 S8\n1.0\n1.920358 -3.326157 0.000000\n1.920358 3.326157 -0.000000\n0.000000 0.000000 25.128044\nZn S\n8 8\ndirect\n0.666668 0.333334 0.750035 Zn\n0.666668 0.333334 0.124941 Zn\n0.000000 0.000000 0.000061 Zn\n0.333334 0.666668 0.875212 Zn\n0.333334 0.666668 0.250035 Zn\n0.666668 0.333334 0.375212 Zn\n0.000000 0.000000 0.500061 Zn\n0.333334 0.666668 0.624941 Zn\n0.000000 0.000000 0.593699 S\n0.333334 0.666668 0.968816 S\n0.666668 0.333334 0.218567 S\n0.333334 0.666668 0.343868 S\n0.666668 0.333334 0.843868 S\n0.666668 0.333334 0.468816 S\n0.333334 0.666668 0.718567 S\n0.000000 0.000000 0.093699 S\n",
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}