Department of Chemistry, Indian Institute of Technology, Guwahati 781039, India.
J Chem Phys. 2011 Jun 14;134(22):224309. doi: 10.1063/1.3598516.
We have applied parametric equations of motion (PEM) to study photodissociation dynamics of H(2)(+). The resonances are extracted using smooth exterior scaling method. This is the first application of PEM to non-Hermitian Hamiltonian that includes resonances and the continuum. Here, we have studied how the different resonance states behave with respect to the change in field amplitude. The advantage of this method is that one can easily trace the different states that are changing as the field parameter changes.
我们已经应用了参数运动方程(PEM)来研究 H(2)(+)的光解动力学。共振是使用光滑外部标度方法提取的。这是 PEM 首次应用于包含共振和连续谱的非厄米哈密顿量。在这里,我们研究了不同的共振态随场振幅变化的行为。这种方法的优点是,随着场参数的变化,可以很容易地追踪到不同的状态变化。