DFT studies on the influence of ligation on optical and redox properties of bimetallic [Au4M2] clusters-Reference-Cited by-同舟云学术

DFT studies on the influence of ligation on optical and redox properties of bimetallic [Au4M2] clusters

Published:2016 Issue:89 Volume:6 Page:86051-86060
ISSN:2046-2069
Container-title:RSC Advances
language:en
Short-container-title:RSC Adv.

Author:

Pillegowda Manohar¹²³⁴⁵,Periyasamy Ganga¹²³⁴⁵

Affiliation:

1. Department of Chemistry

2. Central College Campus

3. Bangalore University

4. Bangalore-560001

5. India

Abstract

Computational studies have been employed to understand the lowest energy conformers and the properties of bare [Au₄M₂] and ligated [Au₄M₂(SCH₃)₆], [Au₄M₂(PH₃)₆]²⁺ clusters in both gas phase and implicit solvent media.

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2016/RA/C6RA14886G

Reference93 articles.

1. Probing the structural and electronic properties of bimetallic Group-III metal-doped gold clusters: AunM2 (M = Na, Mg, Al; n = 1–8)

2. Structural and electronic properties of stable Aun (n=2–13) clusters: A density functional study

3. Electronic structure studies of six-atom gold clusters

4. Electronic Properties of [Core+exo]-type Gold Clusters: Factors Affecting the Unique Optical Transitions

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