Demonstrating the Potential of Alkali Metal-Doped Cyclic C(6)O(6)Li(6) Organometallics as Electrides and High-Performance NLO Materials

[Image: see text] In this report, the geometric and electronic properties and static and dynamic hyperpolarizabilities of alkali metal-doped C(6)O(6)Li(6) organometallics are analyzed via density functional theory methods. The thermal stability of the considered complexes is examined through interac...

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Detalles Bibliográficos
Autores principales: Wajid, Sunaina, Kosar, Naveen, Ullah, Faizan, Gilani, Mazhar Amjad, Ayub, Khurshid, Muhammad, Shabbir, Mahmood, Tariq
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2021
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8582031/
https://www.ncbi.nlm.nih.gov/pubmed/34778658
http://dx.doi.org/10.1021/acsomega.1c04349

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8582031/
https://www.ncbi.nlm.nih.gov/pubmed/34778658
http://dx.doi.org/10.1021/acsomega.1c04349

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