As far as I know, it is not possible. On Wednesday, June 14, 2023, Seyed Javad Hashemifar <hashemi...@iut.ac.ir> wrote:
> Dear Wien2k developers and users > > Is Wien2k able to perform constrained DFT calculations for excited states > study? > > More specifically, I want to empty the Nth state and occupy the (N+1)th > level. > > Bests > > S. Javad Hashemifar > > > -- > ------------------------------ > S. Javad Hashemifar, PhD > Professor, Department of Physics > Isfahan University of Technology, Iran > Personal web page: https://hashemifar.iut.ac.ir > >
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