Quantum scattering code to simulate photodetachment process of penta-atomic system in the A + BCDE Jacobi coordinates. Users are required to cite the following papers:
- J. Chem. Phys. 2016, 145, 131101；
- Phys. Chem. Chem. Phys. 2021, 23, 22298；
- Nat. Chem. 2023, 15, 194.
- J. Chem. Phys. 2024, 161, 034304.
Corresponding author : Hongwei Song
Email: hwsong@wipm.ac.cn
Affiliation: − State Key Laboratory of Magnetic Resonance Spectroscopy and Imaging, Innovation Academy for Precision Measurement Science and Technology, Chinese Academy of Sciences, Wuhan, China
All Copyrights Reserved by the Original Authors.
Table of contents
PES： Subroutine of the potential energy surfaces of ClNH3 and Cl-NH3.
BOUND: Code to calculate the bound states a penta-atomic system.
SCATT: Code to perform progation by Chebyshev propagator.