Zobrazeno 1 - 10
of 37
pro vyhledávání: '"Abdel Ghani Boudjahem"'
Autor:
Isma Salah Salah, Zahreddine Nafa, Hocine Oucief, Hamid Satha, Salem Chaguetmi, Abdel-Ghani Boudjahem
Publikováno v:
Results in Engineering, Vol 23, Iss , Pp 102552- (2024)
In recent years, nanoaprticules with different sizes have been incorporated in the cement mortar in order to improve their mechanical characteristics. The present work focuses onto the influence of the silica nanoparticles (SiO2) with low and high su
Externí odkaz:
https://doaj.org/article/0b1bad5fafb747788c2afa813929a3a8
Publikováno v:
Russian Journal of Inorganic Chemistry. 67:S85-S97
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::f26893bc0d70240f877a27e8e95c45eb
https://doi.org/10.1134/s0036023622602008
https://doi.org/10.1134/s0036023622602008
Publikováno v:
Russian Journal of Inorganic Chemistry. 67:S42-S51
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::203651117f0ce4f525b10fdd493eeb9b
https://doi.org/10.1134/s0036023622601325
https://doi.org/10.1134/s0036023622601325
Publikováno v:
Asian Journal of Research in Chemistry. :422-428
The structural, elastic and thermodynamic properties of the manganese monocarbide in ZnS (B3) phase were investigated using the DFT calculation with the PBE functional. The ground state properties of this materials such as lattice constant, bulk modu
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::ccc1fe9a4b32a3abf2bafe0a7c680404
https://doi.org/10.52711/0974-4150.2022.00074
https://doi.org/10.52711/0974-4150.2022.00074
Publikováno v:
Structural Chemistry. 33:2043-2062
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::59034deaf450c96857951ec6829ab4b2
https://doi.org/10.1007/s11224-022-01984-2
https://doi.org/10.1007/s11224-022-01984-2
Publikováno v:
Journal of Molecular Graphics and Modelling. 121:108442
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::911b64b32b4bee584ac729e698648ea0
https://doi.org/10.1016/j.jmgm.2023.108442
https://doi.org/10.1016/j.jmgm.2023.108442
Autor:
Meryem Derdare, Abdel-Ghani Boudjahem
Publikováno v:
Structural Chemistry. 32:2159-2173
A theoretical study has been performed onto the pristine, Nb- and Au-doped boron nitride (BN) nanosheets using DFT calculations with the B3LYP-D3 method in order to evaluate their stabilities and electronic properties. The interaction of the guanine
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::c38a120c44c192b971d543f499b76463
https://doi.org/10.1007/s11224-021-01785-z
https://doi.org/10.1007/s11224-021-01785-z
Publikováno v:
Journal of Superconductivity and Novel Magnetism. 34:561-570
A theoretical study was performed onto the small nickel clusters in order to evaluate their stability and electronic and magnetic properties using density functional theory (DFT) calculations at the BLYP/Def2-TZVP level of theory. The adsorption of C
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::f79ed5e518340cdae6956ff09f9a9a1e
https://doi.org/10.1007/s10948-020-05720-x
https://doi.org/10.1007/s10948-020-05720-x
Publikováno v:
Structural Chemistry. 31:2341-2353
In this work, the stability and electronic properties of the Ru-doped germanium clusters were investigated with DFT calculations at the TPSS/SDD level. The adsorption of the SO2 molecule over the surface of these clusters has also been examined in de
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::d5aa9ce4a71736a5e0bac6ef249692da
https://doi.org/10.1007/s11224-020-01592-y
https://doi.org/10.1007/s11224-020-01592-y
The stability and electronic properties of the RunV (n = 2–10) nanoclusters and their interaction with hydrogen sulphide and serine molecules were conducted using DFT calculations at the PBE/LanL2DZ/6-311G(d,p) level of theory. The results indicate
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ef6926cc756412ca93af80af969a5505
