mirror of
https://github.com/pfloos/quack
synced 2024-06-13 16:55:28 +02:00
7 lines
128 B
Bash
Executable File
7 lines
128 B
Bash
Executable File
#! /bin/bash
|
|
|
|
cp ./methods.test ../input/methods
|
|
cp ./options.test ../input/options
|
|
cd ..
|
|
python3 PyDuck.py -x He -b 6-31g -m 1
|