Literature DB >> 23425451

Communication: Designed diamond ground state via optimized isotropic monotonic pair potentials.

É Marcotte1, F H Stillinger, Salvatore Torquato.   

Abstract

We apply inverse statistical-mechanical methods to find a simple family of optimized isotropic, monotonic pair potentials (that may be experimentally realizable) whose classical ground state is the diamond crystal for the widest possible pressure range, subject to certain constraints (e.g., desirable phonon spectra). We also ascertain the ground-state phase diagram for a specific optimized potential to show that other crystal structures arise for pressures outside the diamond stability range. Cooling disordered configurations interacting with our optimized potential to absolute zero frequently leads to the desired diamond crystal ground state, revealing that the capture basin for the global energy minimum is large and broad relative to the local energy minima basins.

Entities:  

Year:  2013        PMID: 23425451     DOI: 10.1063/1.4790634

Source DB:  PubMed          Journal:  J Chem Phys        ISSN: 0021-9606            Impact factor:   3.488


  5 in total

1.  Diamond family of nanoparticle superlattices.

Authors:  Wenyan Liu; Miho Tagawa; Huolin L Xin; Tong Wang; Hamed Emamy; Huilin Li; Kevin G Yager; Francis W Starr; Alexei V Tkachenko; Oleg Gang
Journal:  Science       Date:  2016-02-05       Impact factor: 47.728

2.  Structural Characterization and Statistical-Mechanical Model of Epidermal Patterns.

Authors:  Duyu Chen; Wen Yih Aw; Danelle Devenport; Salvatore Torquato
Journal:  Biophys J       Date:  2016-12-06       Impact factor: 4.033

3.  Effective potentials induced by self-assembly of patchy particles.

Authors:  Nicolás Ariel García; Nicoletta Gnan; Emanuela Zaccarelli
Journal:  Soft Matter       Date:  2017-09-20       Impact factor: 3.679

4.  Colloidal crystals with diamond symmetry at optical lengthscales.

Authors:  Yifan Wang; Ian C Jenkins; James T McGinley; Talid Sinno; John C Crocker
Journal:  Nat Commun       Date:  2017-02-13       Impact factor: 14.919

5.  Confinement of Colloids with Competing Interactions in Ordered Porous Materials.

Authors:  Horacio Serna; Eva G Noya; Wojciech T Góźdź
Journal:  J Phys Chem B       Date:  2020-11-03       Impact factor: 2.991

  5 in total

北京卡尤迪生物科技股份有限公司 © 2022-2023.