Dear All,
I have constructed a cell of length=100Angstrom ,packed it with a polymer and solvent molecules.Is it possible to perform an NVT run at 1 atm pressure?How do we set the pressure to 1 atm in NVT run?
Thanks a lot for your time and consideration.
I have constructed a cell of length=100Angstrom ,packed it with a polymer and solvent molecules.Is it possible to perform an NVT run at 1 atm pressure?How do we set the pressure to 1 atm in NVT run?
Thanks a lot for your time and consideration.