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نام مجله: Computational Materials Science


موارد یافت شده: 20

1 - Large scale mobility calculations in PEDOT (Poly(3,4-ethylenedioxythiophene)): Backmapping the coarse-grained MARTINI morphology (چکیده)
2 - Computational modeling of the photovoltaic activities in EABX⁠3 (EA=ethylammonium, B=Pb, Sn, Ge, X=Cl, Br, I) perovskite solar cells (چکیده)
3 - DFT-NEGF simulation of graphene-graphdiyne-graphene resonant tunneling transistor (چکیده)
4 - The role of hydrogen bond interaction on molecular orientation of alkanolamines through temperature and pressure variation: A mixed molecular dynamics and quantum mechanics study (چکیده)
5 - first principle study of inducing supercunductivity in alpha-graphyne by hole -doping and biaxial tensile strain (چکیده)
6 - The Effects of Connecting Region Length on the Natural Frequencies of Straight and Non-straight Hetero-junction Carbon Nanotubes (چکیده)
7 - Mechanical characteristics of CNT-reinforced metallic glass nanocomposites by molecular dynamics simulations (چکیده)
8 - Effect of external strain on electronic structure of stanene (چکیده)
9 - Frequency analysis of perfect and defective SWCNTs (چکیده)
10 - FEM modeling of the flow curves and failure modes of dual phase steels with different martensite volume fractions using actual microstructure as the representative volume (چکیده)
11 - A novel approach for determining thermal properties of single-walled carbon nanotubes (چکیده)
12 - An analytical solution for thermal shock analysis of multiwall carbon nanotubes (چکیده)
13 - Nonlinear flow-induced vibration of a SWCNT with a geometrical imperfection (چکیده)
14 - Axisymmetric yielding of functionally graded spherical vessel under thermo-mechanical loading (چکیده)
15 - Optical absorption and electron energy loss spectra of single-walled carbon nanotubes (چکیده)
16 - Displacement time history analysis and radial wave propagation velocity in pressurized multiwall carbon nanotubes (چکیده)
17 - First-principles study of structural, dynamical, and dielectric properties of A-La2O3 (چکیده)
18 - The effect of excss titaniun and crystal symmetry on electronic properties of Pb(Zr1-x Tix)O3 (چکیده)
19 - Nickel nanowires under uniaxial loads: A molecular dynamics simulation study (چکیده)
20 - First – principles study of structural, dynamical, and dielectric properties of K- Al2 O3 (چکیده)