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Tóm tắt. Cho I là iđêan cạnh của một đồ thị Γ. Bằng cách sử dụng khái niệm đồ thị có trọng đỉnh và các kết quả trước đó của H.M. Lam và N.V. Trung (Transactions of the American Mathematical Society, 2018) về (It : m) \ It tác giả đã đưa ra một số tính chất của đồ thị có trọng Γa ứng với đơn thức xa của hiệu (It : m2) \ (It : m). Từ khóa: Đồ thị...
8 trang | Chia sẻ: thanhle95 | Ngày: 14/07/2021 | Lượt xem: 386 | Lượt tải: 0
Abstract. The structure and mechanical properties of CuNi alloy have been investigated by means of molecular dynamic (MD) simulation. The interactions between atoms of the system were calculated by Sutton-Chen type of embedded atom method. The results show that when the sample was cooled down from 2000K to 300K at the cooling rate of 0.01 K/ps, ...
5 trang | Chia sẻ: thanhle95 | Ngày: 14/07/2021 | Lượt xem: 342 | Lượt tải: 0
Abstract. We investigated the crystal structure and electronic properties of Bismuth tungstate Bi2WO6 by first-principles calculation based on the Density Functional Theory. The calculated electronic density of states confirmed that Bi2WO6 possess the semiconducting properties with the band gap of 2.198 eV. The contribution of each atomic orbita...
6 trang | Chia sẻ: thanhle95 | Ngày: 14/07/2021 | Lượt xem: 369 | Lượt tải: 0
Abstract. To reveal the origin of the (ZrO2)n (n = 1 ÷ 11) cluster stability and to study the structural trends in the zirconium oxide neutral cluster distribution, (ZrO2)n clusters have been constructed and calculated employing Density Functional Theory (DFT). In this work, we calculate the formation energy, electronic structures, stabilities a...
8 trang | Chia sẻ: thanhle95 | Ngày: 14/07/2021 | Lượt xem: 356 | Lượt tải: 0
1. Introduction There are many theoretical and experimental works on thermodynamic and elastic properties of metals and interstitial alloys [1-27], for examples the theory of interstitial alloys [1, 2], the calculations from first principles, the many-body potentials, the molecular dynamics for defects in metals, alloys and solid solutions [3-5], t...
10 trang | Chia sẻ: thanhle95 | Ngày: 14/07/2021 | Lượt xem: 340 | Lượt tải: 0
Abstract. In this work, we investigate the phase diagram of a single-component system of colloidal particles and a binary mixture of hard-core droplets and colloids using means of molecular dynamics. For the former case, we found a variety of different crystal phases, in a good agreement with these observed in the simulation work (Engel et al, N...
10 trang | Chia sẻ: thanhle95 | Ngày: 14/07/2021 | Lượt xem: 299 | Lượt tải: 0
Abstract. In this paper, the moment method in statistical dynamics (SMM) is used to study the thermodynamic quantities of AlyGa1-yAs/GaAs systems taking into account the anharmonicity effects of lattice vibrations. The nearest neighbor distance, lattice parameter, isothermal bulk modulus, specific heats at the constant volume and pressure of Aly...
8 trang | Chia sẻ: thanhle95 | Ngày: 14/07/2021 | Lượt xem: 408 | Lượt tải: 0
Abstract: In this paper, we present the results of the study of the effect of residual La on crystal structure, magnetic properties of La1+Fe11.05Si1.95 ( = 0.00; 0.03; 0.06 and 0.09) compounds. The analysis of X-ray diffractions showed that when the La content increases to 9%, the structure still remains cubic in a typical NaZn13 arrangement ...
6 trang | Chia sẻ: thanhle95 | Ngày: 14/07/2021 | Lượt xem: 309 | Lượt tải: 0
Abstract: In this work, we investigate the defect structure of silicene with a vancacy and the adsorption mechanism of isopropanol on the surface of defected silicene by employing the Density Functional Theory method. The adsorption profile was determined based on the van der Waals functional optPBE-vdW, and the charge transfer between isopropan...
8 trang | Chia sẻ: thanhle95 | Ngày: 14/07/2021 | Lượt xem: 433 | Lượt tải: 0
Abstract: Calculation of gravity anomaly caused by an uneven layer is essential for quantitative interpretation. By comparing calculated anomalies with observed anomalies, we may infer some parameters of subsurface structures. There are many different methods for computing gravity effect of an uneven layer. This paper presents a comparative stud...
9 trang | Chia sẻ: thanhle95 | Ngày: 14/07/2021 | Lượt xem: 371 | Lượt tải: 0