Zobrazeno 1 - 10
of 26
pro vyhledávání: '"Behnam Vessal"'
Autor:
Jahansooz Toofan, Behnam Vessal
Publikováno v:
International Journal of Chemical Kinetics. 53:1133-1142
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::2b5d31f4a08a1b16edb8bdcf865825f8
https://doi.org/10.1002/kin.21520
https://doi.org/10.1002/kin.21520
Publikováno v:
Journal of Non-Crystalline Solids. :51-58
Neutron diffraction has been used to investigate the structure of two PbO–Ga 2 O 3 glasses with 67 mol% PbO and 80 mol% PbO, respectively. The Ga–O coordination polyhedron is a tetrahedron irrespective of composition. A simple structural model is
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::c0878d73922a112d9aad86ae643d4909
https://doi.org/10.1016/s0022-3093(98)00372-x
https://doi.org/10.1016/s0022-3093(98)00372-x
Autor:
Terry R. Coley, Osamu Terasaki, Momoji Kubo, Masahiko Katagiri, Akira Miyamoto, John M. Newsam, Yasuo Nozue, Behnam Vessal, Yongsheng Sean Li
Publikováno v:
Materials Science and Engineering: A. :112-115
We present the anharmonicity and roughening of Cu surfaces derived from the derivatives of the layer spacings and the surface energies with respect to temperature using the embedded-atom molecular dynamics method. The anharmonicity and roughening of
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::a0bc2336e20bb7856ed0e80d1652b1b6
https://doi.org/10.1016/s0921-5093(96)10298-7
https://doi.org/10.1016/s0921-5093(96)10298-7
Autor:
Yasuo Nozue, Kazuya Tsujimichi, Masahiko Katagiri, Yongsheng Sean Li, Momoji Kubo, Behnam Vessal, Osamu Terasaki, Masaharu Komiyama, Akira Miyamoto
Publikováno v:
Surface Science. :900-904
The perpendicular forces acting on Pt adatoms from Pt(100) surfaces are presented using the embedded-atom method. The force maps are classified into four force regions. When the adatom is very close to the surface the force is repulsive (region 1). T
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::596bb86a9bc504c8dbeef7e67cb8f5dd
https://doi.org/10.1016/0039-6028(96)00288-9
https://doi.org/10.1016/0039-6028(96)00288-9
Publikováno v:
Journal of Non-Crystalline Solids. 196:187-192
Neutron diffraction has been performed on two samples from the PbO-Ga 2 O 3 glass-forming system with 67 mol% PbO and 80 mol% PbO. The results show that the structure involves a network based on GaO 4 tetrahedra. The PbO has an essential oxygen-provi
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::230b832822bdabe84b74a7eb023de27e
https://doi.org/10.1016/0022-3093(95)00584-6
https://doi.org/10.1016/0022-3093(95)00584-6
Publikováno v:
Journal of Non-Crystalline Solids. 196:233-238
Results are presented for the molecular dynamics simulation of three alkali silicate glasses previously studied by neutron diffraction. These simulations have been tested by rigorous comparison with the experimental data. The results demonstrate the
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::8aa5664cf018ac2fc661c20cde3a7324
https://doi.org/10.1016/0022-3093(95)00592-7
https://doi.org/10.1016/0022-3093(95)00592-7
Publikováno v:
Molecular Simulation. 15:123-134
Atomistic computer simulation methods can yield unique insights into the structural properties of glasses. In this paper we report on the simulation of vitreous silica employing three-body terms and the subsequent characterization of the structure us
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::f7024d728adfc4e99d4a0a44cbc9f139
https://doi.org/10.1080/08927029508022333
https://doi.org/10.1080/08927029508022333
Publikováno v:
Chemical Physics Letters. 235:53-57
The structural and electronic properties of neutral cube-like MgO clusters comprising of 8, 18, 32, 48 and 64 atoms have been studied using density functional theory. Geometry optimization of all these stoichiometric clusters was done with C 2v symme
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::45a6aa0b8a9c62e0f422a10312a27a22
https://doi.org/10.1016/0009-2614(95)00095-l
https://doi.org/10.1016/0009-2614(95)00095-l
Autor:
Behnam Vessal
Publikováno v:
Journal of Non-Crystalline Solids. 177:103-124
Atomistic computer simulation methods can yield unique insights into the structural properties of glasses. The range and scope of the materials is illustrated by recent results on vitreous silica, silicate and phosphate materials.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::366dc09d4f86e8b8531ebd503fd4cb18
https://doi.org/10.1016/0022-3093(94)90520-7
https://doi.org/10.1016/0022-3093(94)90520-7
Publikováno v:
Journal of Non-Crystalline Solids. 150:97-102
Pulsed neutron diffraction has been used to study the structure of three alkali silicate glasses of nominal composition SiO 2 · (M 2 O) 0.5 , with M = K, K 0.46 Li 0.54 and Li. The data are quantitatively consistent with the modified random network
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::a2f208174951a3dd6cb77c656534a73a
https://doi.org/10.1016/0022-3093(92)90102-p
https://doi.org/10.1016/0022-3093(92)90102-p