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Effect of terminal groups on the relative stability of linear mercury clusters

โœ Scribed by L. V. Akamova; V. V. Pinyaskin; O. B. Tomilin; I. V. Stankevich; A. L. Chistyakov


Book ID
110563841
Publisher
SP MAIK Nauka/Interperiodica
Year
1995
Tongue
English
Weight
316 KB
Volume
36
Category
Article
ISSN
0022-4766

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Effect of terminal groups on the electro
โœ Lioudmila Fomina; Patricia Ponce; Patricia Guadarrama; Serguei Fomine ๐Ÿ“‚ Article ๐Ÿ“… 1999 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 67 KB ๐Ÿ‘ 2 views

Quantum mechanics calculations at B3LYP/6-31G (d)//HF/3-21G (d) level of the theory were carried out on second generation dendritic polyacetylenic oligomers bearing different terminal groups to clarify the impact of their nature on the electronic structure of hyperbranched polyacetylene. It was foun