13 lines
159 B
Bash
13 lines
159 B
Bash
|
source ~/.bashrc
|
||
|
. ~/qp2/quantum_package.rc
|
||
|
|
||
|
basis=$1
|
||
|
|
||
|
for i in *.xyz
|
||
|
do
|
||
|
comand=`qp_create_ezfio_from_g09_zmat $i $1`
|
||
|
echo $comand
|
||
|
eval $comand
|
||
|
done
|
||
|
|