Density Functional Theory III

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Bol Quantum-mechanical interpretation of density functional theory.- Application of density functional theory to the calculation of force fields and vibrational frequencies of transition metal complexes.- Structure and spectroscopy of small atomic clusters.- Density functional theory of clusters of nontransition metals using simple models.

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Quantum-mechanical interpretation of density functional theory.- Application of density functional theory to the calculation of force fields and vibrational frequencies of transition metal complexes.- Structure and spectroscopy of small atomic clusters.- Density functional theory of clusters of nontransition metals using simple models.

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Dealing with density functional theory, this work covers topics such as quantum-mechanical interpretation of density functional theory, and application of density functional theory to the calculation of force fields and vibrational frequencies of transition metal complexes.


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EAN
  • 9783540611325
  • 9783662148396
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