Adama:
I think your initial Si atomic positions are incorrect - the distances are too big.
Therefore, the temperature goes down quickly. Please check the pressure.
If it is negative, I am right.
Z.Insepov
Adama:
I think your initial Si atomic positions are incorrect - the distances are too big.
Therefore, the temperature goes down quickly. Please check the pressure.
If it is negative, I am right.
Z.Insepov