[Pw_forum] Minimization of Energy by fixing lattice parameters and relaxing lattice parameters

Gulcin Kucukdalyan gkucukdalyan at gmail.com
Sun Mar 4 02:29:02 CET 2012


Hi Everyone,

I would like to minimize the energy of graphene lithium system by fixing
lattice parameters and relaxing lattice parameters. How should i do so?

Thanks,

Gulcin
-------------- next part --------------
An HTML attachment was scrubbed...
URL: http://www.democritos.it/pipermail/pw_forum/attachments/20120303/50b32e7d/attachment.htm 


More information about the Pw_forum mailing list