Theoretical studies for the N2–N2O van der Waals complex: The potential energy surface, intermolecular vibrations, and rotational transition frequencies

• Main Authors: Zheng, Rui, Zheng, Limin, Lu, Yunpeng, Yang, Minghui
• Other Authors: School of Physical and Mathematical Sciences
• Format: Article
• Language: English
• Published: 2015
• Subjects: Polymers
• Online Access: https://hdl.handle.net/10356/81097; http://hdl.handle.net/10220/39083
• Institution: Nanyang Technological University

Theoretical studies of the potential energy surface (PES) and bound states are performed for the N2–N2O van der Waals (vdW) complex. A four-dimensional intermolecular PES is constructed at the level of single and double excitation coupled-cluster method with a non-iterative perturbation treatment of...