Rvg. Rao et R. Venkatesh, A DETAILED INVESTIGATION OF THE DYNAMIC AND THERMODYNAMIC PROPERTIES OF LIQUID GERMANIUM, Physica status solidi. b, Basic research, 176(2), 1993, pp. 317-326
Using Rao-Joardar's equation the potential energy of interaction in li
quid germanium at a density of 46.5 nm-1 is derived. The potential fun
ction shows a kink at 0.29 nm and an attractive minimum at 0.46 nm cor
responding to the first and second nearest-neighbour distances. The va
lues calculated by other methods is found to be in good agreement with
the present values. The derivatives of the potential function are use
d to calculate the phonon frequencies using Bhatia-Singh's (BS) method
and also by that of Hubbard and Beeby (HB). The agreement between the
two methods is fair. Using Bhatia-Singh's method the elastic constant
s are calculated. They are also calculated through the use of velociti
es in the long-wave limit as obtained from the equations of Takeno and
Goda and are from the phonon frequencies as obtained from Hubbard and
Beeby's equations. The elastic constants calculated by different meth
ods are found to be in good agreement with each other. Using the third
and second derivatives of the potential the Gruneisen constant gamma(
g) is evaluated. It is also calculated through pressure and energy of
the vibrations. The values obtained by different methods are intercons
istent. An average value of 1.39 for gamma(g) is obtained. The Gruneis
en constant is used to evaluate the pressure derivative of the diffusi
on coefficient.