CONTCAR disp-N: Difference between revisions
m (Csheldon moved page CONTCAR disp-N to Construction:CONTCAR disp-N over redirect) |
m (Huebsch moved page Construction:CONTCAR disp-N to CONTCAR disp-N over a redirect without leaving a redirect) |
Revision as of 14:15, 11 March 2026
The CONTCAR_disp-N file is an output file of a split finite differences calculation that contains the structural information of the Nth displacement.
| Mind: Available as of VASP 6.6.0 |
This file has the same format as the CONTCAR or POSCAR file.
It is typically generated alongside the vaspcheckfd.h5 file by setting CHECKPOINT_FD = PREPARE.
The CONTCAR_disp-N file can be renamed and used as the POSCAR input for a subsequent displacement calculation, e.g., CHECKPOINT_FD = SINGLE.
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