Applicability of equation of state in extreme compression region and study of diatomic solids under pressure

摘要

In the present study, the expression of first pressure derivative of bulk modulus B' earlier derived by Goyal and Gupta EoS [7] is corrected and the validity of the EoS is then verified in extreme compression region. The expressions of second and third order pressure derivative (B '', B ''') of bulk modulus are obtained. The values of B', (BB)-B-2 ''' to BB '', Grunesien parameters lambda(infinity), gamma(infinity), q(infinity) at infinite pressure (P - infinity) are calculated using the identities [11-13] to check the validity of the equation in extreme compression region. The Goyal and Gupta EoS is then used to study the volume compression in diatomic solids, LiH and MgO. The values of pressure, bulk modulus and its first order pressure derivative at different compressions are calculated and compared with the results obtained from Hama-Suito EoS. The results justify the validity of the present EoS in high pressure region and the results for diatomic solids are also found in good consistency with the compared results.