MADWAVE3: A quantum time dependent wave packet code for nonadiabatic state-to-state reaction dynamics of triatomic systems-Reference-Cited by-同舟云学术

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MADWAVE3: A quantum time dependent wave packet code for nonadiabatic state-to-state reaction dynamics of triatomic systems

Published:2025-03 Issue: Volume:308 Page:109471
ISSN:0010-4655
Container-title:Computer Physics Communications
language:en
Short-container-title:Computer Physics Communications

Author:

Roncero Octavio^ORCID,del Mazo-Sevillano Pablo^ORCID

Publisher

Elsevier BV

Reference65 articles.

1. From the sparse to the statistical limit of intramolecular vibrational redistribution in vibrational predissociation: ArCl2 as an example;Roncero;J. Chem. Phys.,1997

2. Coordinate transformation methods to calculate state-to-state reaction probabilities with wave packet treatments;Gómez-Carrasco;J. Chem. Phys.,2006

3. Abc: a quantum reactive scattering program;Skouteris;Comput. Phys. Commun.,2000

4. The multi-configurational time-dependent Hartree approach;Meyer;Chem. Phys. Lett.,1990

5. Wave-packet dynamics within the multiconfiguration Hartree framework: general aspects and application to NOCl;Manthe;J. Chem. Phys.,1992

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1. Understanding the destruction of CH⁺ with atomic hydrogen at low temperatures: a non-adiabatic dynamical study;Physical Chemistry Chemical Physics;2025

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