Compilation error with qe-7.2 and 6.6

[nayraa78]

Hello,

I get the following error after trying to compile pw2z2pack.f90 with quantum espresso 7.2 and 6.6 :

mpiifort -O2 -assume byterecl -g -traceback -nomodule -fpp -D__DFTI -D__MPI -Duse_beef -I/gpfs/fs1/home/alvarezp/source/qe-6.6//include -I/gpfs/fs1/home/alvarezp/source/qe-6.6//FoX/finclude -I/gpfs/fs1/home/alvarezp/source/qe-6.6//S3DE/iotk/include/ -I/cluster/easybuild/broadwell/software/imkl/2021.4.0/mkl/2021.4.0/include -I/gpfs/fs1/home/alvarezp/source/qe-6.6//iotk/src -I/gpfs/fs1/home/alvarezp/source/qe-6.6//upflib -I/gpfs/fs1/home/alvarezp/source/qe-6.6//Modules -I/gpfs/fs1/home/alvarezp/source/qe-6.6//FFTXlib -I/gpfs/fs1/home/alvarezp/source/qe-6.6//LAXlib -I/gpfs/fs1/home/alvarezp/source/qe-6.6//UtilXlib -I/gpfs/fs1/home/alvarezp/source/qe-6.6//FoX/finclude -I../../PW/src -I../../dft-d3/ -c pw2z2pack.f90 pw2z2pack.f90(71): error #6580: Name in only-list does not exist or is not accessible. [ECUTWFC] USE wvfct, ONLY : nbnd,ecutwfc ------------------------------^ pw2z2pack.f90(342): error #6580: Name in only-list does not exist or is not accessible. [IGK] USE wvfct, ONLY : nbnd, npw, npwx, igk, g2kin ------------------------------------------------^ pw2z2pack.f90(364): error #6580: Name in only-list does not exist or is not accessible. [ECUTWFC] USE wvfct, ONLY : ecutwfc -------------------------------^ pw2z2pack.f90(344): error #7002: Error in opening the compiled module file. Check INCLUDE paths. [WAVEFUNCTIONS_MODULE] USE wavefunctions_module, ONLY : psic, psic_nc -------^ pw2z2pack.f90(347): error #6580: Name in only-list does not exist or is not accessible. [NLS] USE gvecs, ONLY : nls, nlsm -----------------------------^ pw2z2pack.f90(347): error #6580: Name in only-list does not exist or is not accessible. [NLSM] USE gvecs, ONLY : nls, nlsm ----------------------------------^ pw2z2pack.f90(350): error #6580: Name in only-list does not exist or is not accessible. [NL] USE gvect, ONLY : g, ngm, gstart, nl -----------------------------------------------^ pw2z2pack.f90(365): error #6580: Name in only-list does not exist or is not accessible. [FTAU] USE symm_base, ONLY : ftau -------------------------------^ pw2z2pack.f90(507): error #6911: The syntax of this substring is invalid. [FTAU] ftau_=ftau(:,isym) ------------^ pw2z2pack.f90(860): error #6580: Name in only-list does not exist or is not accessible. [FTAU] USE symm_base, ONLY : s,sr,ftau, nsym,sname,ft ------------------------------------^ pw2z2pack.f90(898): error #6911: The syntax of this substring is invalid. [FTAU] ftau_=ftau(:,isym) --------^ pw2z2pack.f90(1110): error #6580: Name in only-list does not exist or is not accessible. [NL] USE gvect, ONLY : ngm, nl -----------------------------^ pw2z2pack.f90(1111): error #6580: Name in only-list does not exist or is not accessible. [IGK] USE wvfct, ONLY : nbnd, npwx, npw, igk -----------------------------------------^ pw2z2pack.f90(1177): error #6404: This name does not have a type, and must have an explicit type. [NL] psic(nl(igk(1:npw)),ibnd) = evc_nc(1:npw,ipol,ibnd) -------------^ pw2z2pack.f90(1177): error #6366: The shapes of the array expressions do not conform. [PSIC] psic(nl(igk(1:npw)),ibnd) = evc_nc(1:npw,ipol,ibnd) --------^ compilation aborted for pw2z2pack.f90 (code 1) make: *** [../../make.inc:16: pw2z2pack.o] Error 1

Can you please help me solving the installation issue?

[greschd]

The pw2z2pack.f90 module is based on pw2wannier90 as it was shipped with QE 5.3.0. To the best of my knowledge, it's not compatible with other versions of QE.