Theoretical DFT study of homonuclear and binary transition-metal dimers

Alvaro Posada-Borbón, Alvaro Posada-Amarillas

Research output: Contribution to journalArticleResearchpeer-review

14 Citations (Scopus)
Original languageAmerican English
Pages (from-to)66-71
Number of pages6
JournalChemical Physics Letters
DOIs
StatePublished - 1 Jan 2015

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Discrete Fourier transforms
Dimers
Transition metals
transition metals
dimers
Bond length
functionals
Vibrational spectra
Ground state
atomic energy levels
Ion exchange
dissociation
harmonics
ground state
configurations
electronics
energy

Cite this

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title = "Theoretical DFT study of homonuclear and binary transition-metal dimers",
author = "Alvaro Posada-Borb{\'o}n and Alvaro Posada-Amarillas",
year = "2015",
month = "1",
day = "1",
doi = "10.1016/j.cplett.2014.10.069",
language = "American English",
pages = "66--71",
journal = "Chemical Physics Letters",
issn = "0009-2614",
publisher = "Elsevier",

}

Theoretical DFT study of homonuclear and binary transition-metal dimers. / Posada-Borbón, Alvaro; Posada-Amarillas, Alvaro.

In: Chemical Physics Letters, 01.01.2015, p. 66-71.

Research output: Contribution to journalArticleResearchpeer-review

TY - JOUR

T1 - Theoretical DFT study of homonuclear and binary transition-metal dimers

AU - Posada-Borbón, Alvaro

AU - Posada-Amarillas, Alvaro

PY - 2015/1/1

Y1 - 2015/1/1

U2 - 10.1016/j.cplett.2014.10.069

DO - 10.1016/j.cplett.2014.10.069

M3 - Article

SP - 66

EP - 71

JO - Chemical Physics Letters

JF - Chemical Physics Letters

SN - 0009-2614

ER -