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{
"id": "mp-21089",
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"structure_string": "Ce1 Mn2 Ge2\n1.0\n-1.996755 1.996755 5.414200\n1.996755 -1.996755 5.414200\n1.996755 1.996755 -5.414200\nCe Mn Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ce\n0.750000 0.250000 0.500000 Mn\n0.250000 0.750000 0.500000 Mn\n0.621037 0.621037 0.000000 Ge\n0.378963 0.378963 0.000000 Ge\n",
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{
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"structure_string": "Ce2 Mn2 Ge2\n1.0\n4.058000 0.000000 0.000000\n0.000000 4.058000 0.000000\n0.000000 0.000000 7.226864\nCe Mn Ge\n2 2 2\ndirect\n0.750000 0.750000 0.329397 Ce\n0.250000 0.250000 0.670603 Ce\n0.750000 0.250000 0.000000 Mn\n0.250000 0.750000 0.000000 Mn\n0.750000 0.750000 0.797055 Ge\n0.250000 0.250000 0.202945 Ge\n",
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"spacegroup": 129
},
{
"id": "mp-1226532",
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"structure_string": "Ce1 Mn1 Cr1 Si2\n1.0\n-2.008371 2.008371 5.143732\n2.008371 -2.008371 5.143732\n2.008371 2.008371 -5.143732\nCe Mn Cr Si\n1 1 1 2\ndirect\n0.000000 0.000000 0.000000 Ce\n0.750000 0.250000 0.500000 Mn\n0.250000 0.750000 0.500000 Cr\n0.622512 0.622512 0.000000 Si\n0.377488 0.377488 0.000000 Si\n",
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"formula_full": "Ce1 Mn1 Cr1 Si2",
"formula_reduced": "CeMnCrSi2",
"formula_anonymous": "ABCD2",
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"spacegroup": 119
},
{
"id": "mp-1104214",
"created_at": "2022-09-04T14:47:21.571894Z",
"structure_string": "Ce1 Mn4 Co8\n1.0\n0.000000 0.000000 4.557716\n-4.193482 4.193482 2.278858\n-4.193482 -4.193482 2.278858\nCe Mn Co\n1 4 8\ndirect\n0.000000 0.000000 0.000000 Ce\n0.000000 0.000000 0.500000 Mn\n0.500000 0.000000 0.500000 Mn\n0.500000 0.500000 0.000000 Mn\n0.000000 0.500000 0.000000 Mn\n0.000000 0.357515 0.642485 Co\n0.000000 0.642485 0.357515 Co\n0.642485 0.357515 0.357515 Co\n0.357515 0.642485 0.642485 Co\n0.500000 0.772079 0.227921 Co\n0.500000 0.227921 0.772079 Co\n0.727921 0.772079 0.772079 Co\n0.272079 0.227921 0.227921 Co\n",
"nsites": 13,
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"elements": [
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],
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"density": 8.611874302295327,
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"volume": 160.29752690244814,
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"formula_full": "Ce1 Mn4 Co8",
"formula_reduced": "Ce(MnCo2)4",
"formula_anonymous": "AB4C8",
"energy": -99.29242645,
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"updated_at": "2021-11-28T01:38:07.219000Z",
"spacegroup": 139
},
{
"id": "mp-1226889",
"created_at": "2022-09-04T14:48:20.053960Z",
"structure_string": "Ce1 Mn4 Co8\n1.0\n0.000000 0.000000 4.696860\n-4.227481 4.227481 2.348429\n-4.227481 -4.227481 -2.348429\nCe Mn Co\n1 4 8\ndirect\n0.000000 0.000000 0.000000 Ce\n0.732693 0.767307 0.232693 Mn\n0.267307 0.232693 0.767307 Mn\n0.500000 0.767307 0.767307 Mn\n0.500000 0.232693 0.232693 Mn\n0.500000 0.000000 0.500000 Co\n0.000000 0.000000 0.500000 Co\n0.500000 0.500000 0.000000 Co\n0.000000 0.500000 0.000000 Co\n0.636890 0.363110 0.636890 Co\n0.363110 0.636890 0.363110 Co\n0.000000 0.363110 0.363110 Co\n0.000000 0.636890 0.636890 Co\n",
"nsites": 13,
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"elements": [
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"formula_full": "Ce1 Mn4 Co8",
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"updated_at": "2021-11-28T01:38:51.153000Z",
"spacegroup": 139
},
{
"id": "mp-1213778",
"created_at": "2022-09-04T14:47:14.269549Z",
"structure_string": "Ce4 Mn4 B16\n1.0\n0.000000 0.000000 3.504530\n5.941008 0.000000 0.000000\n0.000000 11.495681 0.000000\nCe Mn B\n4 4 16\ndirect\n0.500000 0.374727 0.150357 Ce\n0.500000 0.625273 0.849643 Ce\n0.500000 0.125273 0.650357 Ce\n0.500000 0.874727 0.349643 Ce\n0.500000 0.371056 0.414190 Mn\n0.500000 0.628944 0.585810 Mn\n0.500000 0.128944 0.914190 Mn\n0.500000 0.871056 0.085810 Mn\n0.000000 0.111264 0.045480 B\n0.000000 0.888736 0.954520 B\n0.000000 0.388736 0.545480 B\n0.000000 0.611264 0.454520 B\n0.000000 0.140798 0.466981 B\n0.000000 0.859202 0.533019 B\n0.000000 0.359202 0.966981 B\n0.000000 0.640798 0.033019 B\n0.000000 0.024440 0.189153 B\n0.000000 0.975560 0.810847 B\n0.000000 0.475560 0.689153 B\n0.000000 0.524440 0.310847 B\n0.000000 0.220995 0.316971 B\n0.000000 0.779005 0.683029 B\n0.000000 0.279005 0.816971 B\n0.000000 0.720995 0.183029 B\n",
"nsites": 24,
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"elements": [
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],
"chemical_system": "B-Ce-Mn",
"density": 6.613097795227574,
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"volume": 239.3451453280906,
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"formula_full": "Ce4 Mn4 B16",
"formula_reduced": "CeMnB4",
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"energy": -181.37297483,
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"updated_at": "2021-11-28T01:38:02.428000Z",
"spacegroup": 55
},
{
"id": "mp-1078286",
"created_at": "2022-09-04T14:39:34.653030Z",
"structure_string": "Ce2 Mn2 As2 O2\n1.0\n4.052511 0.000000 0.000000\n0.000000 4.052511 0.000000\n0.000000 0.000000 8.945474\nCe Mn As O\n2 2 2 2\ndirect\n0.000000 0.500000 0.864350 Ce\n0.500000 0.000000 0.135650 Ce\n0.000000 0.000000 0.500000 Mn\n0.500000 0.500000 0.500000 Mn\n0.000000 0.500000 0.307361 As\n0.500000 0.000000 0.692639 As\n0.000000 0.000000 0.000000 O\n0.500000 0.500000 0.000000 O\n",
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"elements": [
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],
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"volume": 146.91013657752939,
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"formula_full": "Ce2 Mn2 As2 O2",
"formula_reduced": "CeMnAsO",
"formula_anonymous": "ABCD",
"energy": -64.40644843999999,
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"updated_at": "2021-11-28T01:34:30.995000Z",
"spacegroup": 129
},
{
"id": "mp-16487",
"created_at": "2022-09-04T14:48:20.754775Z",
"structure_string": "Ce1 Mn4 Al8\n1.0\n4.778994 0.000000 1.965216\n2.389497 6.255111 0.982608\n0.010561 0.000000 6.767682\nCe Mn Al\n1 4 8\ndirect\n0.000000 0.000000 0.000000 Ce\n0.000000 0.000000 0.500000 Mn\n0.500000 0.000000 0.500000 Mn\n0.000000 0.500000 0.000000 Mn\n0.500000 0.500000 0.000000 Mn\n0.340197 0.659803 0.659803 Al\n0.000000 0.340197 0.659803 Al\n0.000000 0.659803 0.340197 Al\n0.659803 0.340197 0.340197 Al\n0.274294 0.225706 0.225706 Al\n0.500000 0.774294 0.225706 Al\n0.500000 0.225706 0.774294 Al\n0.725706 0.774294 0.774294 Al\n",
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],
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"volume": 202.1774289331835,
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"formula_full": "Ce1 Mn4 Al8",
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"spacegroup": 139
},
{
"id": "mp-1226628",
"created_at": "2022-09-04T14:42:47.326508Z",
"structure_string": "Ce2 Mn2 Al2\n1.0\n-3.885255 0.012167 -3.773787\n3.897422 -3.897422 0.000000\n-3.873088 -3.873088 0.000000\nCe Mn Al\n2 2 2\ndirect\n0.221798 0.110899 0.139101 Ce\n0.778202 0.889101 0.860899 Ce\n0.500000 0.000000 0.500000 Mn\n0.500000 0.500000 0.500000 Mn\n0.000000 0.500000 0.000000 Al\n0.000000 0.500000 0.500000 Al\n",
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],
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"density": 6.472312780964126,
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"volume": 113.93107015084902,
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"formula_full": "Ce2 Mn2 Al2",
"formula_reduced": "CeMnAl",
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"updated_at": "2021-11-28T01:36:06.590000Z",
"spacegroup": 74
},
{
"id": "mp-1226703",
"created_at": "2022-09-04T14:39:38.234030Z",
"structure_string": "Ce1 Mn7 Ni5\n1.0\n0.000000 0.000000 4.765081\n-4.205320 4.179150 2.382540\n-4.205320 -4.179150 -2.382540\nCe Mn Ni\n1 7 5\ndirect\n0.008435 0.991565 0.008435 Ce\n0.504338 0.999788 0.504461 Mn\n0.000335 0.999788 0.504461 Mn\n0.504338 0.495539 0.000212 Mn\n0.000335 0.495539 0.000212 Mn\n0.268434 0.231566 0.768434 Mn\n0.501694 0.762845 0.766232 Mn\n0.501694 0.233768 0.237155 Mn\n0.651223 0.348777 0.651223 Ni\n0.350524 0.649476 0.350524 Ni\n0.996327 0.357970 0.350625 Ni\n0.996327 0.649375 0.642030 Ni\n0.715997 0.784003 0.215997 Ni\n",
"nsites": 13,
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"elements": [
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"Ni"
],
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"density": 8.111373087330932,
"density_atomic": 0.07761685855272328,
"volume": 167.48938622875866,
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"formula_full": "Ce1 Mn7 Ni5",
"formula_reduced": "CeMn7Ni5",
"formula_anonymous": "AB5C7",
"energy": -98.43599926,
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"spacegroup": 44
},
{
"id": "mp-1226606",
"created_at": "2022-09-04T14:41:03.082472Z",
"structure_string": "Ce1 Mn5 Co7\n1.0\n0.000000 0.000000 4.593344\n-4.162757 4.194998 2.296672\n-4.162757 -4.194998 -2.296672\nCe Mn Co\n1 5 7\ndirect\n0.996748 0.003252 0.996748 Ce\n0.498696 0.997949 0.497118 Mn\n0.000474 0.997949 0.497118 Mn\n0.498696 0.502882 0.002051 Mn\n0.000474 0.502882 0.002051 Mn\n0.730675 0.769325 0.230675 Mn\n0.641367 0.358633 0.641367 Co\n0.357810 0.642190 0.357810 Co\n0.000519 0.356741 0.357779 Co\n0.000519 0.642221 0.643259 Co\n0.272156 0.227844 0.772156 Co\n0.500933 0.772474 0.774340 Co\n0.500933 0.225660 0.227526 Co\n",
"nsites": 13,
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"elements": [
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],
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"density": 8.56368322931806,
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"volume": 160.42490283823355,
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"formula_full": "Ce1 Mn5 Co7",
"formula_reduced": "CeMn5Co7",
"formula_anonymous": "AB5C7",
"energy": -100.9897882,
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"spacegroup": 44
},
{
"id": "mp-1106150",
"created_at": "2022-09-04T14:41:16.605387Z",
"structure_string": "Ce1 Mn4 Cu3 O12\n1.0\n-3.716152 -3.716152 3.716152\n-3.716152 3.716152 -3.716152\n3.716152 -3.716152 -3.716152\nCe Mn Cu O\n1 4 3 12\ndirect\n0.000000 0.000000 0.000000 Ce\n0.000000 0.000000 0.500000 Mn\n0.500000 0.000000 0.000000 Mn\n0.000000 0.500000 0.000000 Mn\n0.500000 0.500000 0.500000 Mn\n0.500000 0.000000 0.500000 Cu\n0.000000 0.500000 0.500000 Cu\n0.500000 0.500000 0.000000 Cu\n0.702436 0.825367 0.527803 O\n0.702436 0.174633 0.877069 O\n0.297564 0.825367 0.122931 O\n0.297564 0.174633 0.472197 O\n0.825367 0.527803 0.702436 O\n0.174633 0.877069 0.702436 O\n0.825367 0.122931 0.297564 O\n0.174633 0.472197 0.297564 O\n0.527803 0.702436 0.825367 O\n0.877069 0.702436 0.174633 O\n0.122931 0.297564 0.825367 O\n0.472197 0.297564 0.174633 O\n",
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],
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"volume": 205.27705080281163,
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"formula_full": "Ce1 Mn4 Cu3 O12",
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"energy": -151.94382093,
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"updated_at": "2021-11-28T01:35:17.208000Z",
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}
]
}