Ab-initio techniques, VASP and CASTEP, are used to investigate the electronic properties of B2 compounds formed between Ti and group VIII elements - a comparative study
Cesium-chloride (CsCl) based intermetallic alloys that are formed between Ti and Group VIIIB and IB metals (Fe, Ni, Ru, Rh, Pd, Os Ir, Pt and Au) are currently explored for various potential applications as hydrogen storage, shape memory and biomedical materials. These compounds display excellent st...
Main Authors: | Ngobe Bongani, Diale Ramogohlo, Phasha Maje, Molepo Mahlaga, Chauke Hasani |
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Format: | Article |
Language: | English |
Published: |
EDP Sciences
2022-01-01
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Series: | MATEC Web of Conferences |
Online Access: | https://www.matec-conferences.org/articles/matecconf/pdf/2022/17/matecconf_rapdasa2022_02005.pdf |
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