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Interaction potential models for bulk ZnS, ZnS nanoparticle, and ZnS nanoparticle-PMMA from first-principles

Sadanandam Namsani1, Nisanth N Nair, Jayant K Singh

  • 1Department of Chemical Engineering, Indian Institute of Technology Kanpur, Kanpur, 208016, India.

Journal of Computational Chemistry
|April 23, 2015
PubMed

Keywords:
PMMAZnSdensity functional theoryempirical force-field

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