Closoborate-transition metal complexes for hydrogen storage

Author:

Konda Ravinder12345,Kalamse Vijayanand5634,Deshmukh Amol7891011,Chaudhari Ajay512134

Affiliation:

1. School of Physical Sciences

2. S. R. T. M. University

3. Nanded-431 606

4. India

5. Department of Physics

6. S. G. G. S. I. E & T

7. Molecular Science and Technology Program

8. Taiwan International Graduate Program

9. Academia Sinica

10. Taipei 11529

11. Taiwan

12. The Institute of Science

13. Mumbai-400 032

Abstract

We report hydrogen uptake capacity of early transition metal (TM) atom (Sc, Ti and V) decorated closoborate (B6H6) using density functional theory and second order Møller–Plesset method.

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

Reference55 articles.

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