Stability issues in computational screening of carbon nanostructures: illustrations on La endohedrals-Reference-Cited by-同舟云学术

Stability issues in computational screening of carbon nanostructures: illustrations on La endohedrals

Published:2017-06-25 Issue:17 Volume:43 Page:1472-1479
ISSN:0892-7022
Container-title:Molecular Simulation
language:en
Short-container-title:Molecular Simulation

Author:

Slanina Zdeněk¹,Uhlík Filip²,Adamowicz Ludwik³,Akasaka Takeshi¹,Nagase Shigeru⁴,Lu Xing⁵

Affiliation:

1. Life Science Center of Tsukuba Advanced Research Alliance, University of Tsukuba, Tsukuba, Japan.

2. Faculty of Science, Department of Physical and Macromolecular Chemistry, Charles University, Praha, Czech Republic.

3. Department of Chemistry and Biochemistry, University of Arizona, Tucson, AZ, USA.

4. Fukui Institute for Fundamental Chemistry, Kyoto University, Kyoto, Japan.

5. State Key Laboratory of Materials Processing and Die & Mould Technology, School of Material Science and Engineering, Huazhong University of Science and Technology, Wuhan, China.

Funder

Ministerio de Economía y Competitividad

Czech Science Foundation/GACR

NSFC

National Thousand Talents Program of China

Charles University Centre of Advanced Materials/CUCAM

Changjiang Scholars and Innovative Research Team in University

Publisher

Informa UK Limited

Subject

Condensed Matter Physics,General Materials Science,General Chemical Engineering,Modeling and Simulation,Information Systems,General Chemistry

Link

https://www.tandfonline.com/doi/pdf/10.1080/08927022.2017.1321752

Reference93 articles.

1. The stabilization of fused-pentagon fullerene molecules

2. Chemical, Electrochemical, and Structural Properties of Endohedral Metallofullerenes

3. Bonding in Endohedral Metallofullerenes as Studied by Quantum Theory of Atoms in Molecules

4. Endohedral Metal Atoms in Pristine and Functionalized Fullerene Cages

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