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Chủ tịch danh dự Chủ tịch Hội nghị Ban Tổ chức Ban ... - Viện Vật lý

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59. Melting Curve of Metals: Pressure Dependence<br />

Vu Van Hung (1), Dang Thanh Hai (2), and Le Thi Binh (1)<br />

(1) Hanoi National University of Education, 136 Xuanthuy, Caugiay,<br />

Hanoi<br />

(2) Vietnam Education Publishing House, Tran Hung Dao, Hai Ba<br />

Trung, Ha Noi<br />

The high-pressure melting curve of metals has been studied using<br />

the statistical moment method. The melting was investigated at<br />

different high pressures, the melting temperature being in good<br />

agreement with previous experiments and several theoretical<br />

calculations. A small slope for the melting dT/dP curve of metals is<br />

estimated and a possible explanation for this behaviour is given.<br />

Finally, a P -V - T equation of states is obtained, the temperature<br />

and pressure dependences of the shear modulus and the bulk<br />

modulus being estimated.<br />

Báo cáo Treo<br />

60. Investigation of Thermodynamic Properties Liquid Cu – Ni<br />

Alloys Using Moment Method<br />

Nguyen Thanh Hai<br />

Institute of Engineering Physics, Hanoi University of Technology, 1<br />

Dai Co Viet, Hai Ba Trung, Ha Noi<br />

Using the model of liquid alloys having structural similar solid<br />

alloys at melting temperature, the expressions nearest-neighbour<br />

distance of liquid alloy are obtained. The change in volume,<br />

entropy, specific heat of alloys on melting at the pressure P=0 is<br />

investigated. Our obtain results are applied to numerical calculations<br />

Báo cáo Treo<br />

61. Study of Thermodynamic Properties of Zirconium under High<br />

Pressure<br />

Vu Van Hung, Le Dinh Hong, and Nguyen Thu Ha<br />

Hanoi University of Education 136 Xuan Thuy, Cau Giay, Ha Noi<br />

The moment method in statistical (SMM) dynamics is used to study<br />

the thermodynamic quantities of zirconium taking into account the<br />

anharmonicity effects of the lattice vibrations and hydrostatic<br />

Hội nghị Vật lý lý thuyết toàn quốc lần thứ 35<br />

61<br />

pressures. The thermodynamic quantities of zirconium are<br />

calculated as a function of the pressure. The SMM calculations are<br />

performed by using the Lennard-Jones potential for the zirconium<br />

crystal with hcp and bcc structures. Numerical results for lattice<br />

parameter, thermal expansion coefficient, specific heats at constant<br />

volume and those at the constant pressure CV and CP of zirconium<br />

crystal with bcc and hcp structures are found to be in good<br />

agreement with experiment.<br />

Báo cáo Treo<br />

62. Study of Elastic Properties of CeO 2 by Statistical Moment<br />

Method<br />

Vu Van Hung (1), Le Thi Mai Thanh(1), and<br />

K. Masuda-Jindo (2)<br />

(1)Hanoi National University of Education, 136 Xuan Thuy, Hanoi,<br />

Vietnam<br />

(2) Department of Material Science and Engineering, Tokyo Institute<br />

of Technology, Nagasuta, Midori-ku, Yokohama 226-8530, Japan<br />

The purpose of the present article is to investigate the temperature<br />

and pressure dependences of the elastic properties of cerium dioxide<br />

using the statistical moment method (SMM). The equation of states<br />

of bulk CeO 2 is derived from the Helmholtz free energy, and the<br />

pressure dependences of the elastic moduli like the bulk modulus,<br />

BT, shear modulus, G, Young’s modulus, E, and elastic constants<br />

(C11, C12 and C44) are presented taking into account the<br />

anharmonicity effects of the thermal lattice vibrations. In the present<br />

study, the influence of temperature and pressure on the elastic<br />

moduli and elastic constants of CeO 2 have also been studied, using<br />

three different interatomic potentials.. We compare the results of the<br />

present calculations with those of the previous theoretial<br />

calculations as well as with the available experiments<br />

Báo cáo Treo<br />

63. Structural and Dynamics Properties of Lithium Silicate<br />

Nguyen Thu Nhan and Pham Khac Hung<br />

Department of Computational Physics, Hanoi University of Science<br />

and Technology, Vietnam<br />

62<br />

Tp. Hồ Chí Minh, 02-06/8/2010<br />

The diffusion mechanism in silicate melts is a long debated topic in<br />

material science. The present paper focuses on to give new insight<br />

in this problem based on the comparative study for pure and lithium<br />

silicate melts (SiO 2 and (Li 2 O) 0.1 .(SiO 2 ) 0.9 ). Both silicate models<br />

consisting of 3000 atoms have been prepared at ambient pressure<br />

and temperature from 1500 to 4000 K. The simulation reveals a<br />

significant difference in the tetrahedral-network structures which<br />

results in the change in the diffusion mechanism of silicon and<br />

oxygen. The local structure of both melts is also analyzed and<br />

discussed here.<br />

Báo cáo Treo<br />

64. Order – Disorder Phase Transition in Cu 3 Au under Pressure<br />

Pham Dinh Tam (1), Nguyen Quang Hoc (2), Le Tien Hai<br />

(1), and Pham Duy Tan (1)<br />

(1) Le Quy Don University of Technology, 100 Hoang Quoc Viet, Cau<br />

Giay, Hanoi<br />

(2) Hanoi National University of Education, 136 Xuan Thuy, Cau<br />

Giay, Hanoi<br />

The dependence of the critical temperature Tc for alloy Cu 3 Au on<br />

pressure in the interval from 0 to 30 kbar is studied by the statistical<br />

moment method. The calculated velocity of critical temperature<br />

changing to pressure is 2.1K/ kbar in the interval from 7 to 21 kbar<br />

and this result is in a good agreement with the experimental data.<br />

Báo cáo Treo<br />

65. Study of Elastic Properties of Quantum Crystals by Statistical<br />

Moment Method<br />

Vu Van Hung, Hoang Van Thai, and Dinh Quang Vinh<br />

Hanoi National University of Education, 136 Xuan Thuy, Hanoi,<br />

Vietnam<br />

Temperature and pressure dependences of the elastic properties of<br />

quantum crystals have been studied using the analytic statistical<br />

moment method (SMM). The equation of states of the quantum<br />

crystals is derived from the Helmholtz free energy, and the pressure<br />

dependences of the elastic moduli like the bulk modulus, BT, shear<br />

modulus, G, Young’s modulus, E, and elastic constants (C11, C12<br />

63<br />

Hội nghị Vật lý lý thuyết toàn quốc lần thứ 35<br />

64<br />

and C44) are presented taking into account the anharmonicity<br />

effects of the thermal lattice vibrations. In the present study, the<br />

influence of temperature and pressure on the elastic moduli and<br />

elastic constants of Ar, Kr, and Xe have also been studied, using the<br />

Lennard-Jones potentials and we compare the SMM results with<br />

those of the previous theoretial calculations as well as with the<br />

available experimental results.<br />

Báo cáo Treo<br />

66. A Thermodynamic Lattice Theory on Lindemann’s Melting<br />

Temperature and Eutectic Point of FCC Binary Alloys<br />

Nguyen Van Hung, Nguyen Cong Toan, Tong Sy Tien,<br />

Nguyen Bao Trung<br />

Department of Physics, University of Science, VNU-Hanoi. 334<br />

Nguyen Trai, Thanh Xuan, Hanoi<br />

A thermodynamic lattice theory has been developed for<br />

determination of the melting curves and eutectic points of fcc binary<br />

alloys. Based on Lindemann’s criterion the analytical expressions<br />

for the ratio of root mean square fluctuation in atomic positions on<br />

the equilibrium lattice positions and the nearest neighbor distance,<br />

and then from which those for the melting curves of binary alloys<br />

composed by fcc constituent elements have been derived. This<br />

melting curve provides information on Lindemann’s melting<br />

temperatures of binary alloys with respect to any proportion of<br />

constituent elements and on their eutectic points. Numerical results<br />

for some fcc binary alloys provide a good correspondence between<br />

the calculated and experimental phase diagrams, where the<br />

calculated results for Cu 1-x Ni x agree well with the measured values.<br />

Báo cáo Treo<br />

67. Atomic Radii of Noble Gas Elements in Condensed Phases<br />

Nguyen Quang Hoc and Dinh Quang Vinh<br />

Hanoi National University of Education, 136 Xuan Thuy, Cau Giay,<br />

Hanoi<br />

Neutral atomic radii of dissolved noble gas elements in condensed<br />

phases are obtained by treating the neutral atoms as “ions” of zero<br />

Tp. Hồ Chí Minh, 02-06/8/2010

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