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arXiv · 1304.5128

Tomographic reconstruction of molecular orbitals with twofold mirror antisymmetry: overcoming the nodal plane problem

Xiaosong Zhu·Meiyan Qin·Yang Li·Qingbin Zhang·Zhizhan Xu·Peixiang Lu
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Abstract

We propose a new method to overcome the nodal plane problem for the tomographic reconstruction of molecular orbitals with twofold mirror antisymmetry in the length form based on high-order harmonic generation. It is shown that, by carrying out the reconstruction procedure in the rotating laboratory frame using the component of the dipole moment parallel to the electron recollision direction, the nodal plane problem is avoided and the target orbital is successfully reconstructed. Moreover, it is found that, the proposed method can completely avoid the additional artificial lobes found in the results from the traditional method in the velocity form and therefore provides a more reliable reproduction of the target orbital.

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Xiaosong Zhu, Meiyan Qin, Yang Li, Qingbin Zhang, Zhizhan Xu, Peixiang Lu. 2013-04-18. Tomographic reconstruction of molecular orbitals with twofold mirror antisymmetry: overcoming the nodal plane problem. https://doi.org/10.1103/physreva.87.045402

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