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A theoretical analysis of bi-metallic (Cu–Ag)n = 1 − 7 nano alloy clusters invoking DFT based descriptors Cover

A theoretical analysis of bi-metallic (Cu–Ag)n = 1 − 7 nano alloy clusters invoking DFT based descriptors

Materials Science-Poland
Volume 33 (2015): Issue 4 (December 2015)
By: Prabhat Ranjan,  Seema Dhail,  Srujana Venigalla,  Ajay Kumar,  Lalita Ledwani and  Tanmoy Chakraborty  
Open Access
|Jan 2016

Authors

Prabhat Ranjan

Department of Mechatronics Engineering, Manipal University Jaipur, India

Seema Dhail

Department of Chemistry, Manipal University Jaipur, India

Srujana Venigalla

Department of Chemistry, Manipal University Jaipur, India

Ajay Kumar

Department of Mechatronics Engineering, Manipal University Jaipur, India

Lalita Ledwani

Department of Chemistry, Manipal University Jaipur, India

Tanmoy Chakraborty

tanmoychem@gmail.com

Department of Chemistry, Manipal University Jaipur, India
DOI: https://doi.org/10.1515/msp-2015-0121 | Journal eISSN: 2083-134X | Journal ISSN: 2083-1331
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Language: English
Page range: 719 - 724
Submitted on: Dec 5, 2014
Accepted on: Oct 11, 2015
Published on: Jan 6, 2016
Published by: Wroclaw University of Science and Technology
In partnership with: Paradigm Publishing Services
Publication frequency: 4 issues per year
Keywords:
Density Functional Theory,
bi-metallic nano-alloy,
hardness,
softness,
electrophilicity index
Related subjects:
Materials sciences,
Materials sciences, other,
Nanomaterials,
Functional and smart materials,
Materials characterization and properties

© 2016 Prabhat Ranjan, Seema Dhail, Srujana Venigalla, Ajay Kumar, Lalita Ledwani, Tanmoy Chakraborty, published by Wroclaw University of Science and Technology
This work is licensed under the Creative Commons Attribution-NonCommercial-NoDerivatives 3.0 License.

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