Qiskit NWchem Driver

Based on work from https://github.com/dlr-wf/Qiskit-Quantum-Espresso-Driver

Instruction to run the demo

1. install package

pip install -r requirements.txt

2. The file nwchem_qiskit_driver.ipynb explain single sample step by step.

3. The file nwchem_qiskit_driver_batch.ipynb change the bond distance of two atoms and make a figure to show it