keceli/mpi_benchmark:jdft

$ singularity pull shub://keceli/mpi_benchmark:jdft

Singularity Recipe

Bootstrap: shub
From: keceli/mpi_benchmark:theta

%post
   yum update -y
   yum groupinstall -y "Development Tools"
   yum install -y gcc
   yum install -y gcc-c++
   yum install -y which
   yum install -y wget
   yum install -y git
   yum install -y ca-certificates
   yum install -y lapack-devel blas-devel
    yum --enablerepo=extras install -y epel-release
    yum install -y wget  vim 
    yum install -y openssh-clients zip 
    yum install -y python-devel python-pip  python-setuptools
   yum install -y cmake
   yum install -y gsl-devel fftw-devel	
   export PATH=$PATH:/mpich-3.2.1/install/bin
   export LD_LIBRARY_PATH=$LD_LIBRARY_PATH:/mpich-3.2.1/install/lib
   cd /container
   git clone https://github.com/shankar1729/jdftx.git
   cd jdftx
   mkdir -p build; cd build
   cmake ../jdftx
   make

Collection


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Metrics

key value
id /containers/keceli-mpi_benchmark-jdft
collection name keceli/mpi_benchmark
branch master
tag jdft
commit 477ecd3b13ef0e5277afb7f44e0a440945cde771
version (container hash) 9d41038861a27218154aa29565ff5d93
build date 2019-06-19T19:23:11.492Z
size (MB) 1191
size (bytes) 477868063
SIF Download URL (please use pull with shub://)
Datalad URL View on Datalad
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