cp2k 2.6.0 compilation on cygwin
brhr
Hello,
I cannot find the arch file for cygwin in cp2k 2.6.0.
I tried to compile cp2k 2.6.0 using Cygwin-i686-gfortran.sopt in cp2k 2.5.1, but the complilation failed.
(Cp2k 2.5.1 was successfully compiled on cygwin using the same file.)
Is there a way to compile 2.6.0 on Cygwin?
Regards,
Samuel Andermatt
brhr
On Monday, February 16, 2015 at 7:27:59 PM UTC+9, Samuel Andermatt wrote:
I think you will have to be ore specific to receive help.
I use Windows 8.1, cygwin version 1.7.33-1, GNU Fortran version 4.8.3, and GNU Make 4.0.
cp2k-2.5.1/arch to cp2k-2.6.0/arch directory, and I did command operation on cygwin console as follows:
$ make ARCH=Cygwin-i686-gfortran VERSION=sopt
Discovering programs ...
Removing stale archives for sopt ...
Traceback (most recent call last):
File "/home/user/cp2k-2.6.0/tools/build_utils/check_archives.py", line 57, in <module>
main()
File "/home/user/cp2k-2.6.0/tools/build_utils/check_archives.py", line 26, in main
package = eval(content)
File "<string>", line 1
27 mtime=1398856463.517754
^
SyntaxError: invalid syntax
/home/user/cp2k-2.6.0/makefiles/Makefile:320: recipe for target 'makedep' failed
make[2]: *** [makedep] Error 1
/home/user/cp2k-2.6.0/makefiles/Makefile:107: recipe for target 'sopt' failed
make[1]: *** [sopt] Error 2
Makefile:102: recipe for target 'all' failed
make: *** [all] Error 2
brhr
Hello,
The problem was settled.
I had used the archiver of Lhaplus which is very popular in Japan to unpack cp2k-2.6.0.tar.bz2.
Additional directories named PaxHeaders.XXXX and files were generated in the unpacked cp2k-2.6.0 directory and its subdirectories, these files seemed to be responsible for the compilation failure of cp2k 2.6.0.
Instead of using Lhaplus, I used Cygwin command to unpack tar.bz2.
tar -xvf cp2k-2.6.0.tar.bz2
I made a definition file which named Cygwin-i686-gfortran-noflag.sopt as follows,
CC = cc
CPP =
FC = gfortran
LD = gfortran
AR = ar -r
CPPFLAGS =
DFLAGS = -D__FFTSG
FCFLAGS = -O2 -ffast-math -funroll-loops -ftree-vectorize -ffree-form $(DFLAGS)
LDFLAGS = $(FCFLAGS)
LIBS = -llapack -lblas
,which is almost identical to Cygwin-i686-gfortran.sopt in cp2k-2.5.1/arch except absence of -D__FORTRAN and -march=native flags.
-D__FORTRAN may be unnecessary (as I read by an another thread in this group).
I removed -march=native to run the cp2k.sopt on Windows PC which Cygwin is not installed.
After I did the following command operation, “make ARCH=Cygwin-i686-gfortran-noflag VERSION=sopt”, cp2k.sopt and other sopts were generated in exe directory. The cp2k.sopt seems to work fine.
Regards.
Ole Schütt
I'm glad to hear that CP2K apparently also works on Windows. Maybe you could share your experiences by writting a short tutorial for the wiki?
Cheers,
Ole
Am Donnerstag, 12. März 2015 11:54:01 UTC+1 schrieb brhr:
Hello,
The problem was settled.
I had used the archiver of Lhaplus which is very popular in Japan to unpack cp2k-2.6.0.tar.bz2.
Additional directories named PaxHeaders.XXXX and files were generated in the unpacked cp2k-2.6.0 directory and its subdirectories, the compilation failure of cp2k 2.6.0 seemed to be responsible for these files.
Instead of using Lhaplus, I used Cygwin command to unpack tar.bz2.
tar -xvf cp2k-2.6.0.tar.bz2
I made a definition file which named Cygwin-i686-gfortran-noflag.sopt as follows,
CC = cc
CPP =
FC = gfortran
LD = gfortran
AR = ar -r
CPPFLAGS =
DFLAGS = -D__FFTSG
FCFLAGS = -O2 -ffast-math -funroll-loops -ftree-vectorize -ffree-form $(DFLAGS)
LDFLAGS = $(FCFLAGS)
LIBS = -llapack -lblas
,which is almost identical to Cygwin-i686-gfortran.sopt in cp2k-2.5.1/arch except absence of -D__FORTRAN and -march=native flags.
-D__FORTRAN may be unnecessary (as I read by an another thread in this group).
I removed -march=native to run the cp2k.sopt on Windows PC which Cygwin is not installed.
After I did the following command operation, “make ARCH=Cygwin-i686-gfortran-noflag VERSION=sopt”, cp2k.sopt and and other sopts were generated in exe directory. The cp2k.sopt seems to work fine.
Regards.
brhr
Oh, I have not used Wiki, but I will try to write a short tutorial.... Give me some time please.
Ole Schütt
Using the wiki is very simple, it's basically plain text. You can have a look at code of the existing pages.
Let me know if you have any questions.
-Ole
brhr
brhr
Iain Bethune
- Iain
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> On 19 Mar 2015, at 12:45, brhr <iwao....@gmail.com> wrote:
>
> I contributed a article of "How to Compile and Install CP2K on Windows with Cygwin" at http://www.cp2k.org/howto:compile_on_windows_with_cygwin.
> Thank you in advance.
>
> brhr
>
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brhr
Hi