dimer example running failure

Vasp transition state theory tools

Moderator: moderators

Post Reply
synlquan
Posts: 1
Joined: Wed Mar 14, 2012 8:35 am

dimer example running failure

Post by synlquan » Wed Mar 14, 2012 8:40 am

I have compiled a vtst code with VASP5.2. when I run dimer example (H/Ir) for the test, I got the following error message from out.

"The IMAGES tag should not be set for this implementation of the dimer method."

At the same time I do see some output from vtst in OUTCAR, and it stopped there.

" VTST: version 2.04a, (08/24/11)

CHAIN: initializing optimizer

OPT: Using Conjugate-Gradient optimizer
OPT: CG, Init
OPT: CG, FDSTEP 0.005000
OPT: CG, MAXMOVE 0.200000

CHAIN: Read ICHAIN 2
CHAIN: Running the Dimer method"

Anyone can point out where is compilation going wrong?

thanks!

Bo

Post Reply