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Electronic states and spectroscopic properties of GeSi by Susmita Chakrabarti; Kalyan Kumar Das is a Chemistry article available to read on EtoBox.
What is Electronic states and spectroscopic properties of GeSi about?
Electronic structure and spectroscopy of the GeSi molecule have been investigated by performing ab initio based multireference configuration interaction calculations. Potential energy curves of 29 K-S states of singlet, triplet, and quintet spin multiplicities have been constructed. Spectroscopic constants of 24 bound states within 36 000 cm À1 are reported and compared with the available data. The calculated dissociation energy of GeSi in the ground state is 2.80 eV. Effects of the spin-orbit coupling on the spectroscopic properties of the molecule have been found to be small. However, the computed zero-field-splitting of the ground state compares well with the earlier prediction. Transitions such as 2
Who reads Electronic states and spectroscopic properties of GeSi?
It is typically read by researchers, students, and practitioners in Chemistry.
- Author
- Susmita Chakrabarti; Kalyan Kumar Das
- Publisher
- Elsevier Science; Elsevier ; Elsevier Inc.; Elsevier BV (ISSN 0022-2852)
- Published
- 2008
- Language
- EN
- Field
- Chemistry (Physical Sciences)