回复： 回复： [CP2K:3706] Re: vdw and scf convergence

[shoutian sun]

Hi Jun,
Please have a look at this paper (the smooth method part):

J. VandeVondele et al. / Computer Physics Communications 167 (2005) 103–128

Title: QUICKSTEP Fast and accurate density functional calculations using a mixed Gaussian and plane waves approach


Regards,
SUN
CUHK
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