ABC: a quantum reactive scattering program
This article describes a quantum mechanical reactive scattering program for atom-diatom chemical reactions that we have written during the past several years. The program uses a coupled-channel hyperspherical coordinate method to solve the Schrodinger equation for the motion of the three nuclei on a...
Główni autorzy: | Skouteris, D, Castillo, J, Manolopoulos, D |
---|---|
Format: | Journal article |
Język: | English |
Wydane: |
Elsevier
2000
|
Podobne zapisy
-
Quantum reactive scattering with a transmission-free absorbing potential.
od: Gonzalez-Lezana, T, i wsp.
Wydane: (2004) -
Quantum calculations on reactive collisions
od: Manolopoulos, D, i wsp.
Wydane: (1989) -
QUANTUM REACTIVE SCATTERING VIA THE LOG DERIVATIVE VERSION OF THE KOHN VARIATIONAL PRINCIPLE - GENERAL-THEORY FOR BIMOLECULAR CHEMICAL-REACTIONS
od: Manolopoulos, D, i wsp.
Wydane: (1989) -
TRANSLATIONAL BASIS SET CONTRACTION IN VARIATIONAL REACTIVE SCATTERING
od: Manolopoulos, D, i wsp.
Wydane: (1990) -
Quantum reactive scattering of H + hydrocarbon reactions.
od: Kerkeni, B, i wsp.
Wydane: (2006)