Why the 4s Orbital Is Occupied before the 3d

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• Why the 4s Orbital Is Occupied before the 3dJournal of Chemical Education

  • Why the 4s Orbital Is Occupied before the 3d

    Melvyn P. Melrose , Eric R. Scerri
    Journal of Chemical Education 1996 73 (6), p 498

    Abstract:

    It is demonstrated that the difference between the total energies of two electronic configurations can be expressed as an orbital energy difference, provided that the configurations differ only in the assignment of one electron and that each of the ...

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• Why the 4s Orbital Is Occupied before the 3d (the authors reply)Journal of Chemical Education

  • Why the 4s Orbital Is Occupied before the 3d (the authors reply)

    Eric Scerri , Melvyn P. Melrose
    Journal of Chemical Education 1997 74 (6), p 616

    Abstract: Value of the frozen orbital approximation.

    Abstract | PDF w/ Links | Hi-Res PDF
• Protonation of Base Pairs in RNA: Context Analysis and Quantum Chemical Investigations of Their Geometries and StabilitiesThe Journal of Physical Chemistry B

  • Protonation of Base Pairs in RNA: Context Analysis and Quantum Chemical Investigations of Their Geometries and Stabilities

    Mohit Chawla, Purshotam Sharma, Sukanya Halder, Dhananjay Bhattacharyya, and Abhijit Mitra
    The Journal of Physical Chemistry B 2011 115 (6), pp 1469–1484

    Abstract: Base pairs involving protonated nucleobases play important roles in mediating global macromolecular conformational changes and in facilitation of catalysis in a variety of functional RNA molecules. Here we present our attempts at understanding the role of ...

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See also:

• Why the 4s Orbital Is Occupied before the 3d (the authors reply) Journal of Chemical Education
• Why the 4s Orbital Is Occupied before the 3d Journal of Chemical Education