RT info:eu-repo/semantics/article
T1 CaH Rydberg Series, Oscillator Strengths and Photoionization Cross Sections from Molecular Quantum Defect and Dyson Orbital Theories
A1 Velasco Sanz, Ana María
A1 Lavín Puente, María del Carmen
A1 Díaz Tinoco, Manuel
A1 Ortiz, J. V.
K1 Fotoionización
K1 Electrones
AB In this work, electron-propagator methods are applied to the calculation of the ionization potential and vertical excitation energies for several Rydberg series of the CaH molecule. The present calculations cover more highly excited states than those previously reported. In particular, excitation energies for ns (n>5), np (n>5), nd (n>4) and nf Rydberg states are given. Oscillator strengths for electronic transitions involving Rydberg states of CaH, as well as photoionization cross sections for Rydberg channels, also have been determined by using the Molecular Quantum Defect Orbital approach. Good agreement has been found with the scarce comparative data that are available for oscillator strengths. To our knowledge, predictions of photoionization cross sections from the outermost orbital of CaH are made here for the first time. A Cooper minimum and mixed atomic orbital character in some of the Dyson orbitals are among the novel features of these present calculations
PB Elsevier
YR 2017
FD 2017
LK http://uvadoc.uva.es/handle/10324/22626
UL http://uvadoc.uva.es/handle/10324/22626
LA eng
NO Journal of Quantitative Spectroscopy and Radiative Transfer, Volume 187, January 2017, p. 161–166
NO Producción Científica
DS UVaDOC
RD 24-nov-2024