Qmagic

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qmagic

accessible via

git clone git@no.msg.chem.iastate.edu:qmagic

then

cd qmagic/

All references are relative to qmagic; to build

cd qmagic/src/mpi/
make

link the resulting binary qmc2000 to some directory e.g. Scratch

cd ../../
mkdir Scratch
cd Scratch/
ln -s ../src/mpi/qmc2000 .

also link the .lib files as follows

ln -s ../libs/*.lib .

the input files are in

ln -s ../tests/*.inp .

Then pick a one of the .inp files as a test, say test01_3p.inp and link

ln -s ../tests/test01_3p.inxx  inxx

and do

./qmc2000 < test01_3p.inp

which produces

outxx
job
qmc.log
ecp.dat
qmc.out

the qmc.out file can be compared with e.g. tests/test01_3p.out

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