Diborane-tetraborane conversion in C-60 vesicles - a theoretical study
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, cilt.26, sa.8, ss.837-842, 2001 (SCI-Expanded, Scopus)
- Yayın Türü: Makale / Tam Makale
- Cilt numarası: 26 Sayı: 8
- Basım Tarihi: 2001
- Doi Numarası: 10.1016/s0360-3199(01)00016-7
- Dergi Adı: INTERNATIONAL JOURNAL OF HYDROGEN ENERGY
- Derginin Tarandığı İndeksler: Science Citation Index Expanded (SCI-EXPANDED), Scopus
- Sayfa Sayıları: ss.837-842
- Orta Doğu Teknik Üniversitesi Adresli: Hayır
Özet
Diborane-tetraborane conversion in a C-60 cage is theoretically considered by using AM1-RHF type semiempirical quantum chemical approach. Molecular orbital characteristics of some endohedrally boron hydride doped C-60 composite systems are investigated and the likeliness of diborane-tetraborane conversion in a C-60 vesicle for the purpose of hydrogen storage is discussed. (C) 2001 International Association for Hydrogen Energy. Published by Elsevier Science Ltd. All rights reserved.