[Wien] Optimizing monoclinic lattice

[Osama Yassin]

Dear Wien2k users and developers,,


1- For optimizing the geometry of a monoclinic lattice we use option 7 (4D). My question: will it going to change the volume or  only varying a,b,c and beta at constant volume?.


2- If varying a,b,c and beta at constant volume, then any new generated structures at different pressures can be relaxed without affecting their volumes, Is it true?.



Best wishes


O A Yassin



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