Towards the Search for Thallium Nuclear Schiff Moment in Polyatomic Molecules: Molecular Properties of Thallium Monocyanide (TlCN)

Towards the Search for Thallium Nuclear Schiff Moment in Polyatomic Molecules: Molecular Properties of Thallium Monocyanide (TlCN)

Molecular properties of the thallium monocyanide (Tl·CN) system in its ground electronic state are studied using high-precision ab initio relativistic two-component pseudopotential replacing 60 inner-core electrons of Tl. A relativistic coupled-cluster method with single, double and perturb...

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Bibliographic Details
Main Authors: A. V. Kudrin, A. Zaitsevskii, T. A. Isaev, D. E. Maison, L. V. Skripnikov
Format: Article
Language:English
Published: MDPI AG 2019-06-01
Series:Atoms
Subjects:
molecular electronic structure
parity and time-reversal invariance violating interactions
Schiff moment
relativistic coupled cluster calculation
Online Access:https://www.mdpi.com/2218-2004/7/3/62

Internet

https://www.mdpi.com/2218-2004/7/3/62

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