-
Notifications
You must be signed in to change notification settings - Fork 4
keeeto/SplitXDATCAR
Folders and files
Name | Name | Last commit message | Last commit date | |
---|---|---|---|---|
Repository files navigation
Program : SplitXDATCAR Author : Keith Butler Description : Reads in VASP MD trajectory ('XDATCAR') and splits it, printing a POSCAR of a snapshot each 'n' steps. Requirements: Python, numpy Useage : SplitXDAT.py Simply edit the SplitXDAT.py file, just change the parameter n at the end of the file
About
Splitting VASP tajectory XDATCAR to multiple POSCARs at as many points as required.
Resources
Stars
Watchers
Forks
Releases
No releases published
Packages 0
No packages published