It should have been fixed in 6.7, but it wasn't :-( https://gitlab.com/QEF/q-e/-/merge_requests/1243/diffs?commit_id=47953f0be5c98d0706e152694d1435579d86a7fd
Paolo On Thu, Dec 17, 2020 at 8:20 AM Pietro Delugas <[email protected]> wrote: > Hi > > > > this should be a bug in version 6.6., fixed in 6.7 > > > https://github.com/QEF/q-e/releases/download/qe-6.7.0/qe-6.7-ReleasePack.tgz > > > > regards > > Pietro > > > > Sent from Mail <https://go.microsoft.com/fwlink/?LinkId=550986> for > Windows 10 > > > > *From: *Soumyadeep <[email protected]> > *Sent: *Thursday, December 17, 2020 4:48 AM > *To: *Users <[email protected]> > *Subject: *[QE-users] Error in VCA with QE v6.6 (virtual_v2.x) > > > > Dear All, > > > > I am getting an error when performing VCA using virtual_v2.x for QE > > v6.6 (~qe-6.6/upflib/virtual_v2.x). The error message is, > > Fortran runtime error: Attempting to allocate already allocated > > variable 'upf_vca' > > > > But VCA works successfully when using virtual_v2.x for QE v6.5 > > (~qe-6.5/upftools/virtual_v2.x). Both the output files are attached for > > your reference. Kindly suggest the solution. > > > > with many thanks and best regards > > Soumyadeep > > ------------------------------------------------------------------- > > Soumyadeep Ghosh, > > Senior Research Fellow, > > Homi Bhabha National Institute (HBNI), > > Raja Ramanna Centre for Advanced Technology, Indore, India-452013 > > Mob: (+91)9424664553 > > User Lab: 0731244-2580 > > Email: [email protected], [email protected] > > ------------------------------------------------------------------- > > > _______________________________________________ > Quantum ESPRESSO is supported by MaX (www.max-centre.eu) > users mailing list [email protected] > https://lists.quantum-espresso.org/mailman/listinfo/users -- Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche, Univ. Udine, via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222
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