[Enhancement]: DCU device

[Cavey-QW]

1. Issue description
   Configure the latest code onto the supercomputer

2. Solution
   (1) Update configuration file
   (2) Add box automatic change function
   (3) Version : 2.1.0
   

3. Version number rule
   
   Currently, optimization has been made on version 2.0.0, with the biggest change being the addition of new-box functionality, which greatly affects subsequent calculations and lays the groundwork for NVP

4. Correctness verification
   H2O:
   PotentialEnergy:
   

MSD:

RDF:

VACF:

PEO:
PotentialEnergy:

MSD:

RDF:

VACF: