Most variables were moved to dffts and dfftp structures, in module fft_base:
nls => dffts%nl nlsm => dffts%nlm nr1s => dffts%nr1 nr2s => dffts%nr2 nr3s => dffts%nr3 nl => dfftp%nl nlm => dfftp%nlm nr1 => dfftp%nr1 nr2 => dfftp%nr2 nr3 => dfftp%nr3 nrx1 => dfftp%nr1x nrx2 => dfftp%nr2x nrx3 => dfftp%nr3x nrxx => dfftp%nnr doublegrid in module gvecs ecutwfc in module gvecw
Indeed, I would like to use the code as it is changing the least possible part since I don't know fortran90.
time to learn :-) Paolo -- Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche, Univ. Udine, via delle Scienze 206, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222 _______________________________________________ The Quantum ESPRESSO community stands by the Ukrainian people and expresses its concerns about the devastating effects that the Russian military offensive has on their country and on the free and peaceful scientific, cultural, and economic cooperation amongst peoples _______________________________________________ Quantum ESPRESSO is supported by MaX (www.max-centre.eu) users mailing list [email protected] https://lists.quantum-espresso.org/mailman/listinfo/users
