In:
Chinese Journal of Chemistry, Wiley, Vol. 35, No. 8 ( 2017-08), p. 1329-1332
Abstract:
Using density functional theory, we investigated the hydrogen storage capacity of Li coated BC 3 honeycomb sheet. Our result indicates 18 H 2 molecules can be adsorbed on BC 3 Li 6 complex with a storage gravimetric density of 9.68 wt% and the average adsorption energy reaches 0.206 eV / H 2 . This is desirable for absorbing and desorbing H 2 molecules at near ambient conditions.
Type of Medium:
Online Resource
ISSN:
1001-604X
,
1614-7065
DOI:
10.1002/cjoc.201600911
Language:
English
Publisher:
Wiley
Publication Date:
2017
detail.hit.zdb_id:
2144352-X
SSG:
6,25