Requests for technical support from the VASP group should be posted in the VASP-forum.

# NSW

From Vaspwiki

Jump to navigationJump to searchNSW = [integer]

Default: **NSW** = 0

Description: NSW sets the maximum number of ionic steps.

IBRION = 0:

- NSW gives the number of steps in all ab-initio Molecular Dynamics runs, it
*has*to be supplied therefore, otherwise VASP crashes immediately after having started.

IBRION != 0:

- In all minimization algorithms (quasi-Newton, conjugate gradient, and damped molecular dynamics) NSW defines the maximum number of ionic steps.

**Mind**: Within each ionic step at most NELM electronic-SC loops are performed unless the EDIFF convergence criterium is matched before. Exact Hellmann-Feynman forces and stresses are calculated for each ionic step.