On 12/19/13, Suman Chowdhury <sumanchowdhur...@gmail.com> wrote: > Dear all siesta user, > How do I know if my molecular dynamics simulation is converging or not? > Hi dear Suman when you face with outcoor: Relaxed atomic coordinates (Ang).in your output file.
- [SIESTA-L] Convergence Suman Chowdhury
- [SIESTA-L] Fwd: Convergence Suman Chowdhury
- Re: [SIESTA-L] Convergence Mostafa Shabani