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{
"id": "mp-1185298",
"created_at": "2022-09-04T14:47:16.173944Z",
"structure_string": "K3 Ce1\n1.0\n-2.990277 2.990277 6.684241\n2.990277 -2.990277 6.684241\n2.990277 2.990277 -6.684241\nK Ce\n3 1\ndirect\n0.750000 0.250000 0.500000 K\n0.250000 0.750000 0.500000 K\n0.500000 0.500000 0.000000 K\n0.000000 0.000000 0.000000 Ce\n",
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{
"id": "mp-1185051",
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"structure_string": "K1 Ce3\n1.0\n5.109016 0.000000 0.000000\n0.000000 5.109016 0.000000\n0.000000 0.000000 5.109016\nK Ce\n1 3\ndirect\n0.000000 0.000000 0.000000 K\n0.000000 0.500000 0.500000 Ce\n0.500000 0.000000 0.500000 Ce\n0.500000 0.500000 0.000000 Ce\n",
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"spacegroup": 221
},
{
"id": "mp-1185353",
"created_at": "2022-09-04T14:42:13.554242Z",
"structure_string": "K6 Ce2\n1.0\n5.258868 -9.108627 0.000000\n5.258868 9.108627 0.000000\n0.000000 0.000000 8.174406\nK Ce\n6 2\ndirect\n0.169887 0.339774 0.250000 K\n0.660226 0.830113 0.250000 K\n0.169887 0.830113 0.250000 K\n0.830113 0.660226 0.750000 K\n0.339774 0.169887 0.750000 K\n0.830113 0.169887 0.750000 K\n0.333333 0.666667 0.750000 Ce\n0.666667 0.333333 0.250000 Ce\n",
"nsites": 8,
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"density": 1.0916279290038582,
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"formula_full": "K6 Ce2",
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"updated_at": "2021-11-28T01:35:44.232000Z",
"spacegroup": 194
},
{
"id": "mp-1184962",
"created_at": "2022-09-04T14:42:55.264184Z",
"structure_string": "K1 Cd3\n1.0\n0.000000 3.910743 3.910743\n3.910743 0.000000 3.910743\n3.910743 3.910743 0.000000\nK Cd\n1 3\ndirect\n0.000000 0.000000 0.000000 K\n0.250000 0.250000 0.250000 Cd\n0.750000 0.750000 0.750000 Cd\n0.500000 0.500000 0.500000 Cd\n",
"nsites": 4,
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"elements": [
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"chemical_system": "Cd-K",
"density": 5.2241015760713765,
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"volume": 119.6211093016899,
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"formula_full": "K1 Cd3",
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"updated_at": "2021-11-28T01:35:56.877000Z",
"spacegroup": 225
},
{
"id": "mp-1184907",
"created_at": "2022-09-04T14:42:54.464516Z",
"structure_string": "K3 Cd1\n1.0\n-3.353889 3.353889 4.928353\n3.353889 -3.353889 4.928353\n3.353889 3.353889 -4.928353\nK Cd\n3 1\ndirect\n0.750000 0.250000 0.500000 K\n0.250000 0.750000 0.500000 K\n0.500000 0.500000 0.000000 K\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 4,
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"chemical_system": "Cd-K",
"density": 1.7201332026851592,
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"updated_at": "2021-11-28T01:35:55.766000Z",
"spacegroup": 139
},
{
"id": "mp-1202778",
"created_at": "2022-09-04T14:41:55.995020Z",
"structure_string": "K6 Cd32\n1.0\n9.492957 0.000000 0.000000\n0.000000 9.492957 0.000000\n0.000000 0.000000 11.572590\nK Cd\n6 32\ndirect\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.162167 K\n0.500000 0.500000 0.837833 K\n0.000000 0.000000 0.337833 K\n0.000000 0.000000 0.662167 K\n0.155258 0.359825 0.687371 Cd\n0.844742 0.640175 0.687371 Cd\n0.844742 0.359825 0.312629 Cd\n0.155258 0.640175 0.312629 Cd\n0.344742 0.140175 0.812629 Cd\n0.655258 0.859825 0.812629 Cd\n0.655258 0.140175 0.187371 Cd\n0.344742 0.859825 0.187371 Cd\n0.359825 0.155258 0.312629 Cd\n0.640175 0.844742 0.312629 Cd\n0.359825 0.844742 0.687371 Cd\n0.640175 0.155258 0.687371 Cd\n0.140175 0.344742 0.187371 Cd\n0.859825 0.655258 0.187371 Cd\n0.140175 0.655258 0.812629 Cd\n0.859825 0.344742 0.812629 Cd\n0.648730 0.855025 0.562594 Cd\n0.351270 0.144975 0.562594 Cd\n0.351270 0.855025 0.437406 Cd\n0.648730 0.144975 0.437406 Cd\n0.851270 0.644975 0.937406 Cd\n0.148730 0.355025 0.937406 Cd\n0.148730 0.644975 0.062594 Cd\n0.851270 0.355025 0.062594 Cd\n0.855025 0.648730 0.437406 Cd\n0.144975 0.351270 0.437406 Cd\n0.855025 0.351270 0.562594 Cd\n0.144975 0.648730 0.562594 Cd\n0.644975 0.851270 0.062594 Cd\n0.355025 0.148730 0.062594 Cd\n0.644975 0.148730 0.937406 Cd\n0.355025 0.851270 0.937406 Cd\n",
"nsites": 38,
"nelements": 2,
"elements": [
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"chemical_system": "Cd-K",
"density": 6.101150524739445,
"density_atomic": 0.03643761999526664,
"volume": 1042.878212268977,
"volume_molar": 16.527261552160365,
"formula_full": "K6 Cd32",
"formula_reduced": "K3Cd16",
"formula_anonymous": "A3B16",
"energy": -39.95301768,
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"updated_at": "2021-11-28T01:35:32.755000Z",
"spacegroup": 126
},
{
"id": "mp-397",
"created_at": "2022-09-04T14:42:06.128849Z",
"structure_string": "K2 Cd26\n1.0\n0.000000 7.054920 7.054920\n7.054920 0.000000 7.054920\n7.054920 7.054920 0.000000\nK Cd\n2 26\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.440943 0.198537 0.801463 Cd\n0.940943 0.698537 0.059057 Cd\n0.698537 0.940943 0.301463 Cd\n0.301463 0.698537 0.940943 Cd\n0.940943 0.059057 0.301463 Cd\n0.698537 0.059057 0.940943 Cd\n0.301463 0.940943 0.059057 Cd\n0.801463 0.440943 0.198537 Cd\n0.198537 0.801463 0.440943 Cd\n0.440943 0.559057 0.198537 Cd\n0.440943 0.801463 0.559057 Cd\n0.198537 0.559057 0.801463 Cd\n0.559057 0.440943 0.801463 Cd\n0.559057 0.198537 0.440943 Cd\n0.801463 0.198537 0.559057 Cd\n0.059057 0.940943 0.698537 Cd\n0.059057 0.301463 0.940943 Cd\n0.940943 0.301463 0.698537 Cd\n0.059057 0.698537 0.301463 Cd\n0.301463 0.059057 0.698537 Cd\n0.698537 0.301463 0.059057 Cd\n0.198537 0.440943 0.559057 Cd\n0.801463 0.559057 0.440943 Cd\n0.559057 0.801463 0.198537 Cd\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.500000 Cd\n",
"nsites": 28,
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"elements": [
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],
"chemical_system": "Cd-K",
"density": 7.0956441451456325,
"density_atomic": 0.03987050674730513,
"volume": 702.273491968911,
"volume_molar": 15.104249359476828,
"formula_full": "K2 Cd26",
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"energy": -27.46462856,
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"spacegroup": 226
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{
"id": "mp-982780",
"created_at": "2022-09-04T14:42:49.240253Z",
"structure_string": "K3 Cd1\n1.0\n5.952904 0.000000 0.000000\n0.000000 5.952904 0.000000\n0.000000 0.000000 5.952904\nK Cd\n3 1\ndirect\n0.000000 0.500000 0.500000 K\n0.500000 0.000000 0.500000 K\n0.500000 0.500000 0.000000 K\n0.000000 0.000000 0.000000 Cd\n",
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{
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"structure_string": "K3 Cd1\n1.0\n0.000000 4.685085 4.685085\n4.685085 0.000000 4.685085\n4.685085 4.685085 0.000000\nK Cd\n3 1\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Cd\n",
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{
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"structure_string": "K1 Ca3\n1.0\n0.000000 4.535974 4.535974\n4.535974 0.000000 4.535974\n4.535974 4.535974 0.000000\nK Ca\n1 3\ndirect\n0.000000 0.000000 0.000000 K\n0.250000 0.250000 0.250000 Ca\n0.750000 0.750000 0.750000 Ca\n0.500000 0.500000 0.500000 Ca\n",
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{
"id": "mp-1184877",
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"structure_string": "K3 Ca1\n1.0\n0.000000 5.034152 5.034152\n5.034152 0.000000 5.034152\n5.034152 5.034152 0.000000\nK Ca\n3 1\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Ca\n",
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{
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"structure_string": "K3 Ca1\n1.0\n6.324127 0.000000 0.000000\n0.000000 6.324127 0.000000\n0.000000 0.000000 6.324127\nK Ca\n3 1\ndirect\n0.000000 0.500000 0.500000 K\n0.500000 0.000000 0.500000 K\n0.500000 0.500000 0.000000 K\n0.000000 0.000000 0.000000 Ca\n",
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]
}