Bowl-shaped CuB12- Cluster. A viable Global Minimum with Twofold Aromaticity

Jose Solar-Encinas; Luis Leyva-Parra; Osvaldo Yanez; Diego Inostroza; Julio R. Barrios-Llacuachaqui; Alejandro Vasquez-Espinal; Walter Orellana; William Tiznado

doi:10.1002/cphc.202200366

Bowl-shaped CuB12- Cluster. A viable Global Minimum with Twofold Aromaticity

Jose Solar-Encinas, Luis Leyva-Parra, Osvaldo Yanez, Diego Inostroza, Julio R. Barrios-Llacuachaqui, Alejandro Vasquez-Espinal, Walter Orellana, William Tiznado

Exact Sciences School

Research output: Contribution to journal › Article › peer-review

2 Citations (Scopus)

Original language	English
Journal	ChemPhysChem
DOIs	https://doi.org/10.1002/cphc.202200366
Publication status	E-pub ahead of print - 19 Jul 2022

Keywords

aromaticity
chemical bonding
density functional calculations
diatropic ring currents
metal doped boron clusters

Access to Document

10.1002/cphc.202200366

Cite this

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title = "Bowl-shaped CuB12- Cluster. A viable Global Minimum with Twofold Aromaticity",

keywords = "aromaticity, chemical bonding, density functional calculations, diatropic ring currents, metal doped boron clusters",

author = "Jose Solar-Encinas and Luis Leyva-Parra and Osvaldo Yanez and Diego Inostroza and Barrios-Llacuachaqui, {Julio R.} and Alejandro Vasquez-Espinal and Walter Orellana and William Tiznado",

year = "2022",

month = jul,

day = "19",

doi = "10.1002/cphc.202200366",

language = "English",

journal = "ChemPhysChem",

issn = "1439-4235",

publisher = "Wiley-VCH Verlag",

}

TY - JOUR

T1 - Bowl-shaped CuB12- Cluster. A viable Global Minimum with Twofold Aromaticity

AU - Solar-Encinas, Jose

AU - Leyva-Parra, Luis

AU - Yanez, Osvaldo

AU - Inostroza, Diego

AU - Barrios-Llacuachaqui, Julio R.

AU - Vasquez-Espinal, Alejandro

AU - Orellana, Walter

AU - Tiznado, William

PY - 2022/7/19

Y1 - 2022/7/19

KW - aromaticity

KW - chemical bonding

KW - density functional calculations

KW - diatropic ring currents

KW - metal doped boron clusters

U2 - 10.1002/cphc.202200366

DO - 10.1002/cphc.202200366

M3 - Article

SN - 1439-4235

JO - ChemPhysChem

JF - ChemPhysChem

ER -