Zobrazeno 1 - 2
of 2
pro vyhledávání: '"S. Ahmad Nabavi Amri"'
Publikováno v:
International Journal of Hydrogen Energy. 45:23048-23055
We studied the adsorption of water molecules via the density functional theory on the pure and silicon and/or germanium doped graphene. We investigated the electrostatic surface potential of the structures to predict the possible interactions. Also,
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::a084310620ee0e9f608975e6dfad744f
https://doi.org/10.1016/j.ijhydene.2020.06.039
https://doi.org/10.1016/j.ijhydene.2020.06.039
Publikováno v:
Russian Journal of Physical Chemistry A. 94:158-166
The interaction of many biomarker gas molecules on pure, AlB-doped and GaB-doped boron nitride nanotube was studied by the density functional theory method at the B3LYP/6-31+G(d) level of theory. Dimethylamine, carbon disulfide, acetone, dimethyl sul
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::e7222337b606342d9bce1ab5eaf989b3
https://doi.org/10.1134/s003602442001029x
https://doi.org/10.1134/s003602442001029x