All bound states of NO_2 (J=0)
| dc.creator | Salzgeber, R. F. | |
| dc.creator | Mandelshtam, V. | |
| dc.creator | Schlier, Ch. | |
| dc.creator | Taylor, H. S. | |
| dc.date | 1997-12-11 | |
| dc.date | 1998-02-06 | |
| dc.date.accessioned | 2026-07-07T06:14:38Z | |
| dc.date.available | 2026-07-07T06:14:38Z | |
| dc.description | We calculated all 2967 even and odd bound states of the adiabatic ground state of NO_2, using a modification of the ab initio potential energy surface of Leonardi et al. [J. Chem. Phys. 105, 9051 (1996)]. The calculation was performed by harmonic inversion of the Chebyshev correlation function generated by a DVR Hamiltonian in Radau coordinates. The relative error for the computed eigenenergies is $10^{-4}$ or better. Near the dissociation threshold the density of states is about 0.3cm$^{-1}$. Statistical analysis of the states shows some interesting structure of the rigidity parameter $Δ_3$ as a function of energy. | |
| dc.description | 18 pages of LaTeX including 4 figures. A Postscript of HTML version of this paper can be obtained via: http://phya3.physik.uni-freiburg.de/~rfs/rfs.html This paper was submitted to Journ. Chem. Phys | |
| dc.identifier | https://arxiv.org/abs/quant-ph/9712024 | |
| dc.identifier | http://arxiv.org/abs/quant-ph/9712024 | |
| dc.identifier.uri | http://salesiana.dossiersoluciones.com/handle/123456789/93537 | |
| dc.subject | Quantum Physics | |
| dc.title | All bound states of NO_2 (J=0) | |
| dc.type | text |