## Run this script as $USER to install psi4 first in the home dir of$USER in a rocks linux computer cluster.
## Then make install as su to install it in /share/apps/psi4

#! /bin/bash

cd ~/
wget http://www2.fizik.usm.my/configrepo/howto/psi4/psi4.tar.gz
tar -zxvf psi4.tar.gz
cd psi4.0b5
autoconf

cd madness
autoreconf
cd ..

mkdir obj
cd obj
make clean

rm -rf /tmp/$USERS

### to compile using gcc 492 ##############
../configure --prefix=/share/apps/psi4 --with-cc=gcc --with-cxx=g++ --with-fc=gfortran --with-plugins --with-libdirs='-L/share/apps/estools/ATLAS/3.10.2/lib -L/opt/mpich2/gnu/lib' --with-incdirs='-I/share/apps/estools/ATLAS/3.10.2/include -I/share/apps/estools/ATLAS/3.10.2/include/atlas -I/opt/mpich2/gnu/include' --with-lapack='-llapack -lcblas -latlas' --with-blas='-lcblas -lf77blas -latlas'
### end of to compile using gcc 492 ##############

make 
cd ~/psi4.0b5/obj/plugins
make

make tests

#make install ####### do it as su