Structures and properties of linear Cn molecules

Autor:	D.W. Ewing, Gary V. Pfeiffer
Rok vydání:	1982
Předmět:	Bond length Basis (linear algebra) Chemistry General Physics and Astronomy Molecule Charge (physics) Electron configuration Physical and Theoretical Chemistry Atomic physics Polarization (waves)
Zdroj:	Chemical Physics Letters. 86:365-368
ISSN:	0009-2614
Popis:	Total energies, bond lengths, charge distributions, electronic configurations, and cohesive energies are calculated for linear Cn clusters, n = 2–6. The calculations are done at the single determinant Hartree-Fock level using both double-zeta and double-zeta plus polarization basis sets.
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::471c15a96c739db1acd0d2328a8fa4fe https://doi.org/10.1016/0009-2614(82)83524-0 Zobrazit plný text záznamu