Zobrazeno 1 - 10
of 98
pro vyhledávání: '"Van, Cao Long"'
Publikováno v:
AIMS Materials Science, Vol 9, Iss 3, Pp 406-429 (2022)
This paper uses Molecular Dynamics (MD) method to study the influence of high temperature (T) and high pressure (P) on the structure and phase transition of Fe2O3 materials. The results show that, when increasing the temperature from T = 300 K to T =
Externí odkaz:
https://doaj.org/article/1a0ccba0abba4c0a89b1aa6cf4f24302
Publikováno v:
AIP Advances, Vol 13, Iss 1, Pp 015209-015209-11 (2023)
In this paper, we studied the effect of the 2D epoxy thin films’ shape with equilateral triangle and square structures, and matrix size Lx × Ly of (10 × 9), (20 × 19), (30 × 29), and (40 × 39) with equilateral triangle structure and (10 × 10)
Externí odkaz:
https://doaj.org/article/70405e520df647c39652390210d09db5
Publikováno v:
AIP Advances, Vol 12, Iss 6, Pp 065016-065016-11 (2022)
This study aims to provide new insights into the influencing factors of the Earth (low temperature, depth, and annealing time) on the heterogeneous kinetics of bulk Fe2O3 by the molecular dynamics simulation method. The obtained results show that the
Externí odkaz:
https://doaj.org/article/d06096eef6024af8a205751382551aca
Autor:
Trung Vu Quoc, Dai Do Ba, Duong Tran Thi Thuy, Linh Nguyen Ngoc, Chinh Nguyen Thuy, Huong Vu Thi, Linh Duong Khanh, Oanh Doan Thi Yen, Hoang Thai, Van Cao Long, Stefan Talu, Dung Nguyen Trong
Publikováno v:
Designed Monomers and Polymers, Vol 24, Iss 1, Pp 274-284 (2021)
The content of this paper focuses/shed light on the effects of X (X = S in P1 and X = O in P2) in C11H7NSX and R (R = H in P3, R = OCH3 in P4, and R = Cl in P5) in C18H9ON2S2-R on structural features and band gaps of the polythiophenes containing ben
Externí odkaz:
https://doaj.org/article/7d8c70a9d8514b4e9e8643bb67f4d03a
Publikováno v:
ACS Omega, Vol 5, Iss 48, Pp 31391-31397 (2020)
Externí odkaz:
https://doaj.org/article/e371eb3584164a7fabde5a0488a9a3c4
Publikováno v:
Journal of Composites Science, Vol 6, Iss 12, p 383 (2022)
In this research, we have explored the effect of Au:Cu ratio on the crystallographic and electronic structural properties, formation energies, and radial distribution function (RDF) of Au-Cu alloy materials via density functional calculations. The re
Externí odkaz:
https://doaj.org/article/29fb47fd878c49d082c2af777a497b7a
A Study on the Structural Features of Amorphous Nanoparticles of Ni by Molecular Dynamics Simulation
Publikováno v:
Journal of Composites Science, Vol 6, Iss 9, p 278 (2022)
This study deals with the impact of the heating rate (HR), temperature (T), and the number of atoms (N) on the structural features of amorphous nanoparticles (ANPs) of Ni by molecular dynamics simulation (MDS) with the Pak–Doyama pair interaction p
Externí odkaz:
https://doaj.org/article/147317876a574b65b4ccb91697c65703
Autor:
Nguyen Quang Hoc, Dung Nguyen Trong, Nguyen Chinh Cuong, Bui Duc Tinh, Nguyen Duc Hien, Van Cao Long, Umut Saraç, Ştefan Ţălu
Publikováno v:
Journal of Composites Science, Vol 6, Iss 9, p 250 (2022)
In this research, the numerical calculation for elastic and nonlinear strains of Fe metal and FeC alloy under different pressures has been performed by the statistical moment method SMM with Mie–-Lennard–Jones potential (MLJ) and Embedded-Jones p
Externí odkaz:
https://doaj.org/article/7b6563f40f3c406082a806f77daba37c
Publikováno v:
Journal of Composites Science, Vol 6, Iss 8, p 234 (2022)
In this paper, the structure and phase transition temperature of bulk silicate materials are studied by the simulation method (SM) of molecular dynamics (MD). In this research, all samples are prepared on the same nanoscale material model with the at
Externí odkaz:
https://doaj.org/article/66220b1477df432e98812d6c91fd7cfd
Publikováno v:
Applied Sciences, Vol 12, Iss 17, p 8473 (2022)
In this study, molecular dynamics simulations are employed to study the influencing factors such as doping concentration, number of atoms, and temperature on the structural characteristics, phase transition, and crystallization of Fe1-x-yNixCoy alloy
Externí odkaz:
https://doaj.org/article/ae4c5415d9334d62ba2fea87808c1ee7