Structure, stability and bonding of the leapfrog B 24 0 ,±1,±2-Reference-Cited by-同舟云学术

Structure, stability and bonding of the leapfrog B 24 0 ,±1,±2

Published:2020-10-16 Issue:2 Volume:42 Page:72-80
ISSN:0192-8651
Container-title:Journal of Computational Chemistry
language:en
Short-container-title:J Comput Chem

Author:

Muya Jules Tshishimbi¹²³^ORCID,Isamura Bienfait Kabuyaya¹²^ORCID,Patouossa Issofa²⁴^ORCID,Nguyen Minh Tho⁵⁶^ORCID,Ceulemans Arnout⁵^ORCID

Affiliation:

1. Department of Chemistry, Faculty of Sciences University of Kinshasa Kinshasa Democratic Republic of the Congo

2. Research Center for Theoretical Chemistry and Physics in Central Africa Faculty of Science, University of Kinshasa Kinshasa Democratic Republic of the Congo

3. Department of Chemistry Hanyang University Seoul South Korea

4. Faculty of Sciences, Laboratory of Physical and Theoretical Chemistry University of Yaoundé I Yaoundé Cameroon

5. Department of Chemistry, KU Leuven Leuven Belgium

6. Institute for Computational Science and Technology (ICST) Ho Chi Minh City Vietnam

Funder

National Research Foundation of Korea

Publisher

Wiley

Subject

Computational Mathematics,General Chemistry

Link

https://onlinelibrary.wiley.com/doi/pdf/10.1002/jcc.26434

Reference58 articles.

1. A comparative study of ab initio SCF-CI and DFT. Example of small boron clusters

2. Interaction of small boron cluster ions with HF

3. Oxidation of small boron cluster ions (B+1–13) by oxygen

4. DFT calculations of static dipole polarizabilities and hyperpolarizabilities for the boron clusters Bn (n=3-8,10)

5. Structure and energetic of Bn (n = 2–12) clusters: Electronic structure calculations

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