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Materials Science-Poland
Édition 33 (2015): Edition 4 (December 2015)
Accès libre
A theoretical analysis of bi-metallic (Cu–Ag)
n = 1 − 7
nano alloy clusters invoking DFT based descriptors
Prabhat Ranjan
Prabhat Ranjan
,
Seema Dhail
Seema Dhail
,
Srujana Venigalla
Srujana Venigalla
,
Ajay Kumar
Ajay Kumar
,
Lalita Ledwani
Lalita Ledwani
et
Tanmoy Chakraborty
Tanmoy Chakraborty
| 06 janv. 2016
Materials Science-Poland
Édition 33 (2015): Edition 4 (December 2015)
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Publié en ligne:
06 janv. 2016
Pages:
719 - 724
Reçu:
05 déc. 2014
Accepté:
11 oct. 2015
DOI:
https://doi.org/10.1515/msp-2015-0121
Mots clés
Density Functional Theory
,
bi-metallic nano-alloy
,
hardness
,
softness
,
electrophilicity index
© 2015 Prabhat Ranjan et al., published by De Gruyter Open
This work is licensed under the Creative Commons Attribution-NonCommercial-NoDerivatives 3.0 License.
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
Department of Chemistry, Manipal University Jaipur
India