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Just Got Here
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| 5:29:30 AM PDT - Tue, Jun 14th 2016 | ||
| Hi. I've been following the procedure as quoted many times on here: Suggested process to compile and run NWchem on Windows 8.1 1. Download NWchem from http://nwchemgit.github.io/index.php/Download 2. Download MinGW from http://sourceforge.net/projects/mingw/files/ . Install the Basic Setup, and from All Packages, install pthreads-w32 as well as MSYS. 3. Download and install MPICH2 from http://www.mpich.org/static/tarballs/1.4.1p1/mpich2-1.4.1p1-win-ia32.msi . 4. Assuming your MinGW installation is in the C drive, go to C:/MinGW/msys/1.0 and open msys.bat. The first time you open this application, it will create a folder C:/MinGW/msys/1.0/home/<user_name>. Unpack the NWchem download inside this folder. If necessary, shorten the name of the NWchem folder to nwchem-6.6. 5. Cut and paste the MPICH2 folder also inside the folder C:/MinGW/msys/1.0/home/<user_name>. 6. Inside the msys console, enter the following command to add the path of MinGW to the PATH environment variable: export PATH=/c/MinGW/bin:$PATH 7. Inside the msys console, enter the following commands export NWCHEM_TOP=~/nwchem-6.6 export NWCHEM_TARGET=LINUX export USE_MPI=yes export MPI_LOC=~/MPICH2 export MPI_INCLUDE=$MPI_LOC/include export MPI_LIB=$MPI_LOC/lib export LIBMPI="-lfmpich2g -lmpi" export NWCHEM_MODULES=all export DEPEND_CC=gcc export USE_INTERNALBLAS=y cd $NWCHEM_TOP/src make nwchem_config make FC=gfortran DEPEND_CC=gcc Everything runs fine until I get the error: collect2.exe: error: ld returned 1 exit status make: *** [all] Error 1 Any help would be most appreciated  Thanks! |
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