Ab-initio Study of Phase Transition in LaSe

N Munjal
unpublished
In this work, the density functional theory as inbuilt in CRYSTAL code is use to study the phase transition in LaSe The exchange scheme of Becke and correlation theme of PBE is employed. The results obtained are in good agreement with the previous investigations
fatcat:ni3qvqzuhrdzxcrau6n67vvysm