On Fri, 2013-03-01 at 06:37 -0800, Chukwuemeka Okoye wrote: > I noticed that when ev.x is used to calculate structural parameters, > different equations of state give very different values of the bulk > modulus. For instance, the Murnaghan, Keane and Birch values are never > close. Should this be the case?
Results from Murnaghan and Birch equations of state ARE close. Only the (little-used) Keane equation of state yields rather different results. P. -- Paolo Giannozzi, IOM-Democritos and University of Udine, Italy
