Zobrazeno 1 - 2
of 2
pro vyhledávání: '"Bao-wu Wang"'
Publikováno v:
physica status solidi (b). 251:950-957
We perform density functional theory calculations to investigate the partitioning behavior of Ti and V between cementite and ferrite. The energetics show that Ti and V partition to cementite. The chemical bonds in Ti- and V-substituted cementite are
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::b975d6ec8574a7e33eab630e84088d03
https://doi.org/10.1002/pssb.201350215
https://doi.org/10.1002/pssb.201350215
Publikováno v:
Intermetallics. 44:64-72
First-principles calculations based on density functional theory are performed to study the adsorption and diffusion of hydrogen on ordered Ni 3 Fe(111) surface and in the bulk. The adsorption of H 2 molecule on surface is weak, but the adsorption of
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::d2976ca9c575e3193903b192556eeecd
https://doi.org/10.1016/j.intermet.2013.08.008
https://doi.org/10.1016/j.intermet.2013.08.008