[CP2K-user] [CP2K:14041] Hi...while instaling cp2k via cygwin getting error

sumit agrawal sumitag... at gmail.com
Wed Oct 14 10:07:14 UTC 2020
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Dear matthias,

After your suggestion I added a flag to FCFLAGS. But this time after a long
time of compilation, I got an error again. Error is as follows:

gfortran -c -O2 -ffast-math -funroll-loops -ftree-vectorize -ffree-form
-fallow-argument-mismatch -D__FFTSG
 -D__COMPILE_ARCH="\"Cygwin-i686-gfortran\"" -D__COMPILE_DATE="\"Wed, Oct
14, 2020  3:28:01 PM\"" -D__COMPILE_HOST="\"DESKTOP-RGFVIHK\""
-D__COMPILE_REVISION="\"git:e635599\"" -D__DATA_DIR="\"/cp2k-7.1/data\""
-D__SHORT_FILE__="\"environment.F\"" -I'/cp2k-7.1/src/'
-I'/cp2k-7.1/obj/Cygwin-i686-gfortran/sopt/exts/dbcsr' environment.F90
/cp2k-7.1/src/environment.F:223:2:

  223 | #error -ffast-math (GCC) or -hfpN (N>0, Cray) can lead to wrong
results and numerical instabilities and are therefore no longer supported
      |  1~~~~
Error: #error -ffast-math (GCC) or -hfpN (N>0, Cray) can lead to wrong
results and numerical instabilities and are therefore no longer supported
make[3]: *** [/cp2k-7.1/Makefile:466: environment.o] Error 1
make[2]: *** [/cp2k-7.1/Makefile:134: all] Error 2
make[1]: *** [/cp2k-7.1/Makefile:123: sopt] Error 2
make: *** [Makefile:118: all] Error 2

User at DESKTOP-RGFVIHK /cp2k-7.1

I have attached the arch file of cp2k.



On Wed, Oct 14, 2020 at 3:18 PM Krack Matthias (PSI) <matthi... at psi.ch>
wrote:

> In that arch file, add the flag to FCFLAGS.
>
>
>
> Matthias
>
>
>
> *From:* cp... at googlegroups.com <cp... at googlegroups.com> *On Behalf Of *sumit
> agrawal
> *Sent:* Mittwoch, 14. Oktober 2020 09:37
> *To:* cp... at googlegroups.com
> *Subject:* Re: [CP2K:14039] Hi...while instaling cp2k via cygwin getting
> error
>
>
>
> Dear Matthias,
>
>
>
> Thanks for the help. I added to CFLAGS in the Cygwin-i686-gfortran.sopt
> file. I again get errors as follows:
>
>
>
> /cp2k-7.1/src/pw/realspace_grid_types.F:921:27:
>
>   910 |             CALL dcopy(nn, sendbuf, 1, pw%cr3d, 1)
>       |                           2
> ......
>   921 |             CALL dcopy(nn, pw%cc3d, 2, sendbuf, 1)
>       |                           1
> Error: Type mismatch between actual argument at (1) and actual argument at
> (2) (COMPLEX(8)/REAL(8)).
> make[3]: *** [/cp2k-7.1/Makefile:466: realspace_grid_types.o] Error 1
> make[2]: *** [/cp2k-7.1/Makefile:134: all] Error 2
> make[1]: *** [/cp2k-7.1/Makefile:123: sopt] Error 2
> make: *** [Makefile:118: all] Error 2
>
>
>
>
>
> I have attached the arch file of cp2k which I am using to compile.
>
>
>
>
>
>
>
> On Wed, Oct 14, 2020 at 2:05 PM vasanth kumar <vasan... at gmail.com>
> wrote:
>
> hi
>
> I am following this to install cp2k, but getting error like I said in
> previous email
>
>
>
> https://www.cp2k.org/exercises:2019_uzh_acpc2:installation
>
>
>
>
>
>
>
> On Wed, 14 Oct 2020 at 12:48, Krack Matthias (PSI) <matthi... at psi.ch>
> wrote:
>
> Hi
>
>
>
> If you are using a recent GNU compiler version like 10.2 then adding the
> compiler flag “–fallow-argument-mismatch” might help.
>
>
>
> HTH
>
>
>
> Matthias
>
>
>
> *From:* cp... at googlegroups.com <cp... at googlegroups.com> *On Behalf Of *sumit
> agrawal
> *Sent:* Mittwoch, 14. Oktober 2020 07:36
> *To:* cp... at googlegroups.com
> *Subject:* Re: [CP2K:14034] Hi...while instaling cp2k via cygwin getting
> error
>
>
>
> Hii,
>
>
>
> I also tried with cp2k version 7.1, but in this case the errors were as
> following:
>
>
>
>  /cp2k-7.1/src/pw/realspace_grid_types.F:921:27:
>
>
>   910 |             CALL dcopy(nn, sendbuf, 1, pw%cr3d, 1)
>       |                           2
> ......
>   921 |             CALL dcopy(nn, pw%cc3d, 2, sendbuf, 1)
>       |                           1
> Error: Type mismatch between actual argument at (1) and actual argument at
> (2) (COMPLEX(8)/REAL(8)).
> make[3]: *** [/cp2k-7.1/Makefile:466: realspace_grid_types.o] Error 1
> make[2]: *** [/cp2k-7.1/Makefile:134: all] Error 2
> make[1]: *** [/cp2k-7.1/Makefile:123: sopt] Error 2
> make: *** [Makefile:118: all] Error 2
>
>
>
> Please help me.
>
>
>
> Thanks
>
>
>
> On Tue, Oct 13, 2020 at 8:50 PM Amir Said <amirsa... at gmail.com> wrote:
>
> Dear Vasanth kumar,
>
> I also have the same problem i'm trying from last two weeks but it make
> the problem as same like you
>
>
>
>
>
> On Tue, Oct 13, 2020 at 5:11 PM vasanth kumar <vasan... at gmail.com>
> wrote:
>
> Hi
>
>
>
> I am unable to install cp2k in my windows-10 , it showing the
> error....copied below
>
>
>
> VASANTH at LAPTOP-UL1N39OG ~/cp2k-7.1/makefiles
> $ make ARCH=Cygwin-i686-gfortran VERSION=sopt
> Discovering programs ...
> Removing stale archives for sopt ...
> Resolving dependencies for sopt ...
> makedep error: Module filename format must be either of "lower", "upper",
> or "no".
> make[2]: *** [/home/VASANTH/cp2k-7.1/makefiles/Makefile:389: makedep]
> Error 1
> make[1]: *** [/home/VASANTH/cp2k-7.1/makefiles/Makefile:118: sopt] Error 2
> make: *** [makefile:113: all] Error 2
>
>
>
> pl suggest the solution
>
>
>
> thanks in advance
>
>
>
> --
>
> With Regards
>
> Dr. V. Vasantha Kumar
>
> Assoc. Prof. of Physics
>
> Vignan Institute of Technology and Science
>
> Hyderabad.
>
> Mob:9959363113
>
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>
>
>
> --
>
> With Regards
>
> Dr. V. Vasantha Kumar
>
> Assoc. Prof. of Physics
>
> Vignan Institute of Technology and Science
>
> Hyderabad.
>
> Mob:9959363113
>
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