Re: [QE-users] Problem when compiling qe-6.7

2021-01-26 Thread Fabrizio Ferrari
You can definitely use libxc, but with version 5.0.0 you need to pay attention to the f03 interfaces, which have been removed and then restored after v5.0.0. In the user guide in doc folder, in the section 'libxc library' you will find everything you need to know, especially in the 'note for libxc

Re: [QE-users] Problem when compiling qe-6.7

2021-01-26 Thread José Carlos Conesa Cegarra
Dear Fabrizio, I am compiling with libxc 5.0.0, which I installed previously. But because the first attempt was not successful, I used the followig recipe, that I found sometime ago: - run configure without any libxc flag - go to the make.inc file and, by following the comments inside, add

Re: [QE-users] Problem when compiling qe-6.7

2021-01-26 Thread Fabrizio Ferrari
Hello, are you compiling with libxc? Which version? Fabrizio On Tue, Jan 26, 2021 at 6:39 PM José Carlos Conesa Cegarra < jccon...@icp.csic.es> wrote: > Dear all, > > I tried compiling qe-6.7. The compilation fails with a number of > messages like these: > > funct.f90(40): error #7002: Error in

[QE-users] Problem when compiling qe-6.7

2021-01-26 Thread José Carlos Conesa Cegarra
Dear all, I tried compiling qe-6.7. The compilation fails with a number of messages like these: funct.f90(40): error #7002: Error in opening the compiled module file.  Check INCLUDE paths.   [XC_F03_LIB_M]   USE xc_f03_lib_m --^ funct.f90(424): error #6457: This derived type name has