Dear Bhargab Kakati, One option to see the starting point of the Wannierisation, that is the initial projections orthonormalized, is to set num_iter = 0 and run the Wannierisation: with num_iter = 0 you do not do any Wannierisation step, essentially you do a projection-only Wannier-functions; then, just plot the WFs and check the result.
As a note, remember that in most (all?) cases, the projections won't be intuitive s, p, d-like orbitals. Hope this helps. Best, Giovanni > On 29 Feb 2024, at 12:39, Bhargab Kakati <bhrgabkak...@iasst.res.in> wrote: > > Dear all, > > I used SCDM method in my calculation and I was wandering if there's any way > we can fin out the projections used in the wannierization process. Any > suggestion will be highly appreciated. > > Thank you. > _______________________________________________ > Wannier mailing list > Wannier@lists.quantum-espresso.org > https://lists.quantum-espresso.org/mailman/listinfo/wannier _______________________________________________ Wannier mailing list Wannier@lists.quantum-espresso.org https://lists.quantum-espresso.org/mailman/listinfo/wannier
