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University proceedings. Volga region. Physical and mathematical sciences, 2011, Issue 3, Pages 69–76 (Mi ivpnz584)  

Physics

The influence of lower energy levels on the first adiabatic ionization potentials of molecules of nitrogen-containing compounds

M. Yu. Dolomatov, K. F. Latypov

Ufa State Academy of Economics and Service, Ufa
References:
Abstract: The authors have discovered a correlation between empirically defined first adiabatic ionization potentials and the lower energy levels in molecules of nitrogen-containing organic compounds. The calculation has been performed by ab initio method RHF-3-21G **. This dependence is observed in nitrogenous compounds of various classes and is related to the exchange and the Coulomb interactions. The results obtained have been confirmed by statistical data processing.
Keywords: first ionization potential, oscillator's integrated strength, electronic spectra, energy of molecular orbitals, nitrogen-containing compounds, quantum chemistry.
Document Type: Article
UDC: 535.34; 541.1
Language: Russian
Citation: M. Yu. Dolomatov, K. F. Latypov, “The influence of lower energy levels on the first adiabatic ionization potentials of molecules of nitrogen-containing compounds”, University proceedings. Volga region. Physical and mathematical sciences, 2011, no. 3, 69–76
Citation in format AMSBIB
\Bibitem{DolLat11}
\by M.~Yu.~Dolomatov, K.~F.~Latypov
\paper The influence of lower energy levels on the first adiabatic ionization potentials of molecules of nitrogen-containing compounds
\jour University proceedings. Volga region. Physical and mathematical sciences
\yr 2011
\issue 3
\pages 69--76
\mathnet{http://mi.mathnet.ru/ivpnz584}
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