Zobrazeno 1 - 10
of 89
pro vyhledávání: '"M. Jacon"'
Publikováno v:
Journal of Quantitative Spectroscopy and Radiative Transfer. 83:435-444
The rovibrational line intensities of the N 2 O molecule in its ground electronic state have been used to determine its dipole moment derivatives using a fitting procedure. The wavefunctions calculation have been made using a Discrete Variable Repres
Autor:
D. Belmiloud, M. Jacon
Publikováno v:
International Journal of Quantum Chemistry. 76:535-540
Publikováno v:
Chemical Physics Letters. 287:515-524
From the analysis of the lineshape of narrow lines observed in the 000 absorption band of the Wulf transition, we have confirmed the metastable character of the excited 3A2 (v′1=0, v′2=0, v′3=0) level in agreement with recent ab initio determin
Autor:
D. Belmiloud, M. Jacon
Publikováno v:
International Journal of Quantum Chemistry. 70:475-489
Autor:
H. Vilanove, M. Jacon
Publikováno v:
International Journal of Quantum Chemistry. 62:199-211
Autor:
H. Vilanove, M. Jacon
Publikováno v:
International Journal of Quantum Chemistry. 55:419-427
The discrete variable representation method is applied to the determination of the rotation-vibration energy levels of the fundamental electronic state of NO2. The Hamiltonian is expressed in Johnson hyperspherical coordinates and developed on a DVR
Publikováno v:
Chemical Physics. 195:195-206
We present the results of quasiclassical trajectories (QCT) and hemiquantal hyperspherical (HQS) dynamics calculations for the exchange reaction 18O(3P)+16O16O(3Σg−)→18O16O(3Σg−)+16O(3P and its reverse. The effect of rotational excitation on
Publikováno v:
Journal of Quantitative Spectroscopy and Radiative Transfer. 52:439-446
In order to get a first overview on the i.r. spectrum of N 2 O at high temperature, a numerical calculation of the i.r. intensities, using analytical expressions derived from contact transformation theory, is presented. The obtained spectra at room a
Publikováno v:
The Journal of Chemical Physics. 101:271-282
A hemiquantal three‐dimensional calculation of the isotopic exchange reaction O18(3P) +O16O16(3Σ−g)→O18O16 (3Σ−g) +O16(3P), which plays an important part in the atmospheric ozone photochemistry, is presented. The method gives an estimation
Publikováno v:
Journal of Molecular Spectroscopy. 162:335-341