Structural characteristics and chemical reactivity of gold-based clusters Au<sub>n</sub> (n = 16, 17) toward lone pairs.

Tho, Nguyen Huu; Bui, Thanh Q; Si, Nguyen Thanh; Nhat, Pham Vu; Nhung, Nguyen Thi Ai

Structural characteristics and chemical reactivity of gold-based clusters Au_n (n = 16, 17) toward lone pairs.

Tho, Nguyen Huu; Bui, Thanh Q; Si, Nguyen Thanh; Nhat, Pham Vu; Nhung, Nguyen Thi Ai.

Afiliação

Tho NH; Faculty of Natural Sciences Education, Sai Gon University, Ho Chi Minh City, 700000, Vietnam.
Bui TQ; Department of Chemistry, University of Sciences, Hue University, Hue City, 530000, Vietnam.
Si NT; Department of Chemistry, Can Tho University, Can Tho, 90000, Vietnam.
Nhat PV; Department of Chemistry, Can Tho University, Can Tho, 90000, Vietnam. nhat@ctu.edu.vn.
Nhung NTA; Department of Chemistry, University of Sciences, Hue University, Hue City, 530000, Vietnam. ntanhung@hueuni.edu.vn.

J Mol Model ; 28(3): 54, 2022 Feb 07.

Article em En | MEDLINE | ID: mdl-35128580

Palavras-chave

Binding energy; DFT calculations; Gold clusters; Lone-pair affinity

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Revista: J Mol Model Assunto da revista: BIOLOGIA MOLECULAR Ano de publicação: 2022 Tipo de documento: Article País de afiliação: Vietnã

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