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0011041243
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note
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3h symmetry are given in parentheses.
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36
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0011044583
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-
note
-
3] complexes for the early lanthanides are more akin to the mid actinides than the first 5f elements.
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38
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0011009547
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note
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[38] The HOMOs of the non-relativistic calculations are indicated by a vertical arrow representing the single unpaired electron. The arrow notation implies a direction of electron spin, arrows pointing up are usually taken to represent α spin electrons and those pointing down β spin electrons. Such a representation is conceptually incorrect for the HOMOs of the relativistic calculations as electron spin is incorporated in the symmetry labels of the orbitals. The relativistic HOMOs are therefore represented by a dashed horizontal line.
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40
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0011008966
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note
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[40] From now on, unless otherwise stated, f is taken to mean the total f orbital (i.e. f+f̄) to a given MO (and similarly for the other AOs).
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-
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45
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0011003354
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note
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2) ligands.
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47
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