Calculation of state-to-state cross sections for triatomic reaction by the multi-configuration time-dependent Hartree method

• Main Authors: Lee, Soo-Ying, Zhao, Bin, Zhang, Dong-H., Sun, Zhigang
• 其他作者: School of Physical and Mathematical Sciences
• 格式: Article
• 語言: English
• 出版: 2014
• 主題: DRNTU::Science::Physics::Atomic physics
• 在線閱讀: https://hdl.handle.net/10356/98630; http://hdl.handle.net/10220/19600
• 機構: Nanyang Technological University

A framework for quantum state-to-state integral and differential cross sections of triatomic reactive scattering using the Multi-Configuration Time-Dependent Hartree (MCTDH) method is introduced, where a modified version of the Heidelberg MCTDH package is applied. Parity of the system is adopted usi...