Hello everyone, I am just starting to use siesta to attack my questions. But i have some serious trouble to do it. I have a system with 184 Atoms and I want to simulate it a distinct time at 1500 K and ambient pressure with a time step of 10 fs. Using the Anneal option everything seems to run fine. But switching it to Nose or NoseParrinelloRahman siesta performs the SCF calculation, calculates the forces- and than nothing. It still runs but it do not produce any output. Has anyone a idea whats going wrong?
Thank you very much Michael
