From zeolite nets to sp3 carbon allotropes: a topology-based multiscale theoretical study-Reference-Cited by-同舟云学术

From zeolite nets to sp3 carbon allotropes: a topology-based multiscale theoretical study

Published:2015 Issue:2 Volume:17 Page:1332-1338
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Baburin Igor A.¹²³⁴,Proserpio Davide M.⁵⁶⁷⁸⁹^ORCID,Saleev Vladimir A.⁹¹⁰¹¹¹²,Shipilova Alexandra V.⁹¹⁰¹¹¹²

Affiliation:

1. Technische Universität Dresden

2. Institut für Physikalische Chemie

3. D-01062 Dresden

4. Germany

5. Università degli studi di Milano

6. Dipartimento di Chimica

7. 20133 Milano

8. Italy

9. Samara Center for Theoretical Materials Science (SCTMS)

10. Samara State University

11. Samara 443011

12. Russia

Abstract

Based on the topological approach, we predicted six novel low-energy sp³-carbon allotropes that might be engineered from diamond thin films and graphene.

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2015/CP/C4CP04569F

Reference51 articles.

1. Bonding Changes in Compressed Superhard Graphite

2. Crystal structure prediction usingab initioevolutionary techniques: Principles and applications

3. Crystal structure prediction and simulations of structural transformations: metadynamics and evolutionary algorithms

4. Systematic prediction of crystal structures: An application tosp3-hybridized carbon polymorphs

5. Low-Temperature Phase Transformation from Graphite tosp3Orthorhombic Carbon

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